data_6860_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 6860
_Entry.PDB_ID 2GW6
_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 7 . 1 1 1 A 2 2 GLU H H 2 8.994 8.555 0.439 1
1 8 . 1 1 1 A 2 2 GLU HA H 2 4.278 4.705 -0.427 1
1 13 . 1 1 1 A 2 2 GLU C C 2 175.315 176.512 -1.197 1
1 14 . 1 1 1 A 2 2 GLU CA C 2 57.318 55.590 1.728 1
1 15 . 1 1 1 A 2 2 GLU CB C 2 29.221 30.476 -1.255 1
1 17 . 1 1 1 A 2 2 GLU N N 2 122.259 119.268 2.991 1
1 18 . 1 1 1 A 3 3 ASP H H 3 8.048 8.062 -0.014 1
1 19 . 1 1 1 A 3 3 ASP HA H 3 4.580 5.108 -0.528 1
1 21 . 1 1 1 A 3 3 ASP C C 3 175.636 176.284 -0.648 1
1 22 . 1 1 1 A 3 3 ASP CA C 3 54.579 53.218 1.361 1
1 23 . 1 1 1 A 3 3 ASP CB C 3 40.984 41.618 -0.634 1
1 24 . 1 1 1 A 3 3 ASP N N 3 119.830 119.058 0.772 1
1 25 . 1 1 1 A 4 4 ALA H H 4 8.090 7.773 0.317 1
1 26 . 1 1 1 A 4 4 ALA HA H 4 4.216 5.102 -0.886 1
1 30 . 1 1 1 A 4 4 ALA C C 4 177.157 177.938 -0.781 1
1 31 . 1 1 1 A 4 4 ALA CA C 4 53.620 50.939 2.681 1
1 32 . 1 1 1 A 4 4 ALA CB C 4 18.728 19.311 -0.583 1
1 33 . 1 1 1 A 4 4 ALA N N 4 123.957 121.098 2.859 1
1 34 . 1 1 1 A 5 5 TRP H H 5 7.941 7.785 0.156 1
1 35 . 1 1 1 A 5 5 TRP HA H 5 4.559 4.376 0.183 1
1 39 . 1 1 1 A 5 5 TRP C C 5 176.072 177.494 -1.422 1
1 40 . 1 1 1 A 5 5 TRP CA C 5 57.744 59.987 -2.243 1
1 41 . 1 1 1 A 5 5 TRP CB C 5 28.906 29.136 -0.230 1
1 42 . 1 1 1 A 5 5 TRP N N 5 118.408 119.803 -1.395 1
1 44 . 1 1 1 A 6 6 MET H H 6 7.679 8.122 -0.443 1
1 45 . 1 1 1 A 6 6 MET HA H 6 3.785 4.681 -0.896 1
1 52 . 1 1 1 A 6 6 MET C C 6 175.174 177.050 -1.876 1
1 53 . 1 1 1 A 6 6 MET CA C 6 57.724 56.407 1.317 1
1 54 . 1 1 1 A 6 6 MET CB C 6 31.640 34.881 -3.241 1
1 57 . 1 1 1 A 6 6 MET N N 6 121.538 116.584 4.954 1
1 58 . 1 1 1 A 7 7 GLY H H 7 7.247 8.032 -0.785 1
1 59 . 1 1 1 A 7 7 GLY HA2 H 7 3.455 4.250 -0.795 1
1 60 . 1 1 1 A 7 7 GLY HA3 H 7 3.578 4.364 -0.786 1
1 61 . 1 1 1 A 7 7 GLY C C 7 172.852 173.682 -0.830 1
1 62 . 1 1 1 A 7 7 GLY CA C 7 45.896 44.537 1.359 1
1 63 . 1 1 1 A 7 7 GLY N N 7 104.055 109.116 -5.061 1
1 64 . 1 1 1 A 8 8 THR H H 8 7.436 8.473 -1.037 1
1 65 . 1 1 1 A 8 8 THR HA H 8 4.428 4.795 -0.367 1
1 70 . 1 1 1 A 8 8 THR C C 8 172.973 173.546 -0.573 1
1 71 . 1 1 1 A 8 8 THR CA C 8 60.751 61.507 -0.756 1
1 72 . 1 1 1 A 8 8 THR CB C 8 69.637 71.245 -1.608 1
1 74 . 1 1 1 A 8 8 THR N N 8 107.669 115.425 -7.756 1
1 75 . 1 1 1 A 9 9 HIS H H 9 8.048 7.852 0.196 1
1 76 . 1 1 1 A 9 9 HIS HA H 9 4.654 4.942 -0.288 1
1 79 . 1 1 1 A 9 9 HIS CA C 9 56.163 53.490 2.673 1
1 80 . 1 1 1 A 9 9 HIS CB C 9 32.619 31.378 1.241 1
1 81 . 1 1 1 A 9 9 HIS N N 9 127.281 121.277 6.004 1
1 82 . 1 1 1 A 10 10 PRO HA H 10 4.257 4.244 0.013 1
1 88 . 1 1 1 A 10 10 PRO C C 10 178.779 179.116 -0.337 1
1 89 . 1 1 1 A 10 10 PRO CA C 10 65.565 65.869 -0.304 1
1 90 . 1 1 1 A 10 10 PRO CB C 10 32.422 31.873 0.549 1
1 93 . 1 1 1 A 11 11 LYS H H 11 10.994 8.510 2.484 1
1 94 . 1 1 1 A 11 11 LYS HA H 11 4.282 4.176 0.106 1
1 100 . 1 1 1 A 11 11 LYS C C 11 177.279 178.680 -1.401 1
1 101 . 1 1 1 A 11 11 LYS CA C 11 56.859 59.490 -2.631 1
1 102 . 1 1 1 A 11 11 LYS CB C 11 31.279 32.260 -0.981 1
1 104 . 1 1 1 A 11 11 LYS N N 11 121.398 118.182 3.216 1
1 105 . 1 1 1 A 12 12 TYR H H 12 7.146 8.355 -1.209 1
1 106 . 1 1 1 A 12 12 TYR HA H 12 3.722 4.236 -0.514 1
1 113 . 1 1 1 A 12 12 TYR C C 12 176.265 177.506 -1.241 1
1 114 . 1 1 1 A 12 12 TYR CA C 12 61.189 61.416 -0.227 1
1 115 . 1 1 1 A 12 12 TYR CB C 12 37.796 38.351 -0.555 1
1 116 . 1 1 1 A 12 12 TYR N N 12 121.579 121.872 -0.293 1
1 117 . 1 1 1 A 13 13 LEU H H 13 7.778 8.991 -1.213 1
1 118 . 1 1 1 A 13 13 LEU HA H 13 3.773 3.910 -0.137 1
1 127 . 1 1 1 A 13 13 LEU C C 13 178.462 178.610 -0.148 1
1 128 . 1 1 1 A 13 13 LEU CA C 13 57.942 58.113 -0.171 1
1 129 . 1 1 1 A 13 13 LEU CB C 13 41.064 41.467 -0.403 1
1 132 . 1 1 1 A 13 13 LEU N N 13 117.518 120.878 -3.360 1
1 133 . 1 1 1 A 14 14 GLU H H 14 7.867 8.839 -0.972 1
1 134 . 1 1 1 A 14 14 GLU HA H 14 3.935 3.951 -0.016 1
1 139 . 1 1 1 A 14 14 GLU C C 14 178.326 179.221 -0.895 1
1 140 . 1 1 1 A 14 14 GLU CA C 14 59.368 60.021 -0.653 1
1 141 . 1 1 1 A 14 14 GLU CB C 14 30.147 29.299 0.848 1
1 143 . 1 1 1 A 14 14 GLU N N 14 119.135 118.376 0.759 1
1 144 . 1 1 1 A 15 15 MET H H 15 7.773 7.672 0.101 1
1 145 . 1 1 1 A 15 15 MET HA H 15 3.936 4.123 -0.187 1
1 152 . 1 1 1 A 15 15 MET C C 15 177.886 177.675 0.211 1
1 153 . 1 1 1 A 15 15 MET CA C 15 59.465 58.225 1.240 1
1 154 . 1 1 1 A 15 15 MET CB C 15 33.987 32.062 1.925 1
1 157 . 1 1 1 A 15 15 MET N N 15 117.884 119.604 -1.720 1
1 158 . 1 1 1 A 16 16 MET H H 16 8.145 8.004 0.141 1
1 159 . 1 1 1 A 16 16 MET HA H 16 4.159 4.159 0.000 1
1 166 . 1 1 1 A 16 16 MET C C 16 177.835 177.619 0.216 1
1 167 . 1 1 1 A 16 16 MET CA C 16 57.397 57.252 0.145 1
1 168 . 1 1 1 A 16 16 MET CB C 16 31.867 32.178 -0.311 1
1 171 . 1 1 1 A 16 16 MET N N 16 119.555 115.456 4.099 1
1 172 . 1 1 1 A 17 17 GLU H H 17 7.761 7.680 0.081 1
1 173 . 1 1 1 A 17 17 GLU HA H 17 4.117 4.280 -0.163 1
1 176 . 1 1 1 A 17 17 GLU C C 17 175.994 177.136 -1.142 1
1 177 . 1 1 1 A 17 17 GLU CA C 17 57.392 57.760 -0.368 1
1 178 . 1 1 1 A 17 17 GLU CB C 17 29.432 29.628 -0.196 1
1 180 . 1 1 1 A 17 17 GLU N N 17 118.216 118.006 0.210 1
1 181 . 1 1 1 A 18 18 LEU H H 18 7.201 7.356 -0.155 1
1 182 . 1 1 1 A 18 18 LEU HA H 18 4.111 4.208 -0.097 1
1 191 . 1 1 1 A 18 18 LEU C C 18 175.781 177.313 -1.532 1
1 192 . 1 1 1 A 18 18 LEU CA C 18 56.366 55.318 1.048 1
1 193 . 1 1 1 A 18 18 LEU CB C 18 42.030 42.223 -0.193 1
1 196 . 1 1 1 A 18 18 LEU N N 18 117.448 122.404 -4.956 1
1 197 . 1 1 1 A 19 19 ASP H H 19 7.789 8.944 -1.155 1
1 198 . 1 1 1 A 19 19 ASP HA H 19 4.360 4.638 -0.278 1
1 201 . 1 1 1 A 19 19 ASP C C 19 173.765 176.228 -2.463 1
1 202 . 1 1 1 A 19 19 ASP CA C 19 54.851 55.046 -0.195 1
1 203 . 1 1 1 A 19 19 ASP CB C 19 39.115 40.449 -1.334 1
1 204 . 1 1 1 A 19 19 ASP N N 19 115.844 122.239 -6.395 1
1 205 . 1 1 1 A 20 20 ILE H H 20 8.142 7.484 0.658 1
1 206 . 1 1 1 A 20 20 ILE HA H 20 4.128 4.175 -0.047 1
1 216 . 1 1 1 A 20 20 ILE C C 20 174.710 176.818 -2.108 1
1 217 . 1 1 1 A 20 20 ILE CA C 20 60.465 62.799 -2.334 1
1 218 . 1 1 1 A 20 20 ILE CB C 20 40.407 38.603 1.804 1
1 222 . 1 1 1 A 20 20 ILE N N 20 117.287 117.502 -0.215 1
1 223 . 1 1 1 A 21 21 GLY H H 21 8.207 8.276 -0.069 1
1 224 . 1 1 1 A 21 21 GLY HA2 H 21 3.889 3.989 -0.100 1
1 225 . 1 1 1 A 21 21 GLY HA3 H 21 3.924 3.995 -0.071 1
1 226 . 1 1 1 A 21 21 GLY C C 21 172.162 173.576 -1.414 1
1 227 . 1 1 1 A 21 21 GLY CA C 21 45.017 46.190 -1.173 1
1 228 . 1 1 1 A 21 21 GLY N N 21 110.656 109.514 1.142 1
1 229 . 1 1 1 A 22 22 ASP H H 22 7.727 7.954 -0.227 1
1 230 . 1 1 1 A 22 22 ASP HA H 22 4.794 4.987 -0.193 1
1 233 . 1 1 1 A 22 22 ASP C C 22 174.884 175.985 -1.101 1
1 234 . 1 1 1 A 22 22 ASP CA C 22 52.471 52.815 -0.344 1
1 235 . 1 1 1 A 22 22 ASP CB C 22 42.069 42.916 -0.847 1
1 236 . 1 1 1 A 22 22 ASP N N 22 119.305 119.813 -0.508 1
1 237 . 1 1 1 A 23 23 ALA H H 23 8.644 9.094 -0.450 1
1 238 . 1 1 1 A 23 23 ALA HA H 23 4.120 4.041 0.079 1
1 242 . 1 1 1 A 23 23 ALA C C 23 179.546 179.758 -0.212 1
1 243 . 1 1 1 A 23 23 ALA CA C 23 55.609 54.773 0.836 1
1 244 . 1 1 1 A 23 23 ALA CB C 23 18.573 18.551 0.022 1
1 245 . 1 1 1 A 23 23 ALA N N 23 122.468 128.818 -6.350 1
1 246 . 1 1 1 A 24 24 THR H H 24 8.238 7.909 0.329 1
1 247 . 1 1 1 A 24 24 THR HA H 24 4.184 4.015 0.169 1
1 252 . 1 1 1 A 24 24 THR C C 24 174.841 176.884 -2.043 1
1 253 . 1 1 1 A 24 24 THR CA C 24 66.241 66.419 -0.178 1
1 254 . 1 1 1 A 24 24 THR CB C 24 68.376 68.150 0.226 1
1 256 . 1 1 1 A 24 24 THR N N 24 114.824 114.076 0.748 1
1 257 . 1 1 1 A 25 25 GLN H H 25 8.037 8.551 -0.514 1
1 258 . 1 1 1 A 25 25 GLN HA H 25 4.095 4.046 0.049 1
1 265 . 1 1 1 A 25 25 GLN C C 25 177.603 178.929 -1.326 1
1 266 . 1 1 1 A 25 25 GLN CA C 25 59.261 58.812 0.449 1
1 267 . 1 1 1 A 25 25 GLN CB C 25 28.437 28.255 0.182 1
1 269 . 1 1 1 A 25 25 GLN N N 25 122.518 120.148 2.370 1
1 271 . 1 1 1 A 26 26 VAL H H 26 7.994 7.620 0.374 1
1 272 . 1 1 1 A 26 26 VAL HA H 26 3.469 3.762 -0.293 1
1 280 . 1 1 1 A 26 26 VAL C C 26 175.552 177.996 -2.444 1
1 281 . 1 1 1 A 26 26 VAL CA C 26 66.909 65.666 1.243 1
1 282 . 1 1 1 A 26 26 VAL CB C 26 31.582 31.352 0.230 1
1 285 . 1 1 1 A 26 26 VAL N N 26 119.112 116.812 2.300 1
1 286 . 1 1 1 A 27 27 TYR H H 27 8.003 8.132 -0.129 1
1 287 . 1 1 1 A 27 27 TYR HA H 27 4.357 4.473 -0.116 1
1 294 . 1 1 1 A 27 27 TYR C C 27 175.856 177.282 -1.426 1
1 295 . 1 1 1 A 27 27 TYR CA C 27 62.197 61.673 0.524 1
1 296 . 1 1 1 A 27 27 TYR CB C 27 38.394 38.805 -0.411 1
1 297 . 1 1 1 A 27 27 TYR N N 27 119.170 124.821 -5.651 1
1 298 . 1 1 1 A 28 28 VAL H H 28 8.087 8.772 -0.685 1
1 299 . 1 1 1 A 28 28 VAL HA H 28 3.652 3.511 0.141 1
1 307 . 1 1 1 A 28 28 VAL C C 28 176.134 178.564 -2.430 1
1 308 . 1 1 1 A 28 28 VAL CA C 28 66.247 66.462 -0.215 1
1 309 . 1 1 1 A 28 28 VAL CB C 28 31.241 31.593 -0.352 1
1 312 . 1 1 1 A 28 28 VAL N N 28 113.112 119.286 -6.174 1
1 313 . 1 1 1 A 29 29 ALA H H 29 7.853 8.576 -0.723 1
1 314 . 1 1 1 A 29 29 ALA HA H 29 3.913 4.141 -0.228 1
1 318 . 1 1 1 A 29 29 ALA C C 29 177.850 179.750 -1.900 1
1 319 . 1 1 1 A 29 29 ALA CA C 29 55.274 54.918 0.356 1
1 320 . 1 1 1 A 29 29 ALA CB C 29 17.876 18.497 -0.621 1
1 321 . 1 1 1 A 29 29 ALA N N 29 121.350 122.395 -1.045 1
1 322 . 1 1 1 A 30 30 PHE H H 30 8.724 7.934 0.790 1
1 323 . 1 1 1 A 30 30 PHE HA H 30 4.098 4.335 -0.237 1
1 327 . 1 1 1 A 30 30 PHE C C 30 175.035 177.055 -2.020 1
1 328 . 1 1 1 A 30 30 PHE CA C 30 61.264 61.508 -0.244 1
1 329 . 1 1 1 A 30 30 PHE CB C 30 38.926 39.440 -0.514 1
1 330 . 1 1 1 A 30 30 PHE N N 30 120.478 120.699 -0.221 1
1 331 . 1 1 1 A 31 31 LEU H H 31 8.146 8.092 0.054 1
1 332 . 1 1 1 A 31 31 LEU HA H 31 3.597 3.606 -0.009 1
1 341 . 1 1 1 A 31 31 LEU C C 31 179.508 179.240 0.268 1
1 342 . 1 1 1 A 31 31 LEU CA C 31 57.884 58.023 -0.139 1
1 343 . 1 1 1 A 31 31 LEU CB C 31 41.829 41.917 -0.088 1
1 346 . 1 1 1 A 31 31 LEU N N 31 118.427 120.200 -1.773 1
1 347 . 1 1 1 A 32 32 VAL H H 32 7.627 7.641 -0.014 1
1 348 . 1 1 1 A 32 32 VAL HA H 32 3.464 3.771 -0.307 1
1 356 . 1 1 1 A 32 32 VAL C C 32 174.956 177.619 -2.663 1
1 357 . 1 1 1 A 32 32 VAL CA C 32 66.373 65.635 0.738 1
1 358 . 1 1 1 A 32 32 VAL CB C 32 31.121 31.430 -0.309 1
1 361 . 1 1 1 A 32 32 VAL N N 32 119.497 114.563 4.934 1
1 362 . 1 1 1 A 33 33 TYR H H 33 8.366 8.616 -0.250 1
1 363 . 1 1 1 A 33 33 TYR HA H 33 3.485 3.926 -0.441 1
1 370 . 1 1 1 A 33 33 TYR C C 33 174.883 176.876 -1.993 1
1 371 . 1 1 1 A 33 33 TYR CA C 33 62.866 61.228 1.638 1
1 372 . 1 1 1 A 33 33 TYR CB C 33 37.778 38.270 -0.492 1
1 373 . 1 1 1 A 33 33 TYR N N 33 121.842 124.206 -2.364 1
1 374 . 1 1 1 A 34 34 LEU H H 34 8.000 8.426 -0.426 1
1 375 . 1 1 1 A 34 34 LEU HA H 34 3.495 3.599 -0.104 1
1 385 . 1 1 1 A 34 34 LEU C C 34 178.240 179.067 -0.827 1
1 386 . 1 1 1 A 34 34 LEU CA C 34 57.453 57.222 0.231 1
1 387 . 1 1 1 A 34 34 LEU CB C 34 41.828 40.924 0.904 1
1 390 . 1 1 1 A 34 34 LEU N N 34 116.692 119.525 -2.833 1
1 391 . 1 1 1 A 35 35 ASP H H 35 7.688 7.891 -0.203 1
1 392 . 1 1 1 A 35 35 ASP HA H 35 4.302 4.288 0.014 1
1 395 . 1 1 1 A 35 35 ASP C C 35 177.507 178.434 -0.927 1
1 396 . 1 1 1 A 35 35 ASP CA C 35 58.196 57.660 0.536 1
1 397 . 1 1 1 A 35 35 ASP CB C 35 43.070 41.092 1.978 1
1 398 . 1 1 1 A 35 35 ASP N N 35 120.507 120.035 0.472 1
1 399 . 1 1 1 A 36 36 LEU H H 36 8.482 8.335 0.147 1
1 400 . 1 1 1 A 36 36 LEU HA H 36 3.328 3.535 -0.207 1
1 410 . 1 1 1 A 36 36 LEU C C 36 176.774 178.786 -2.012 1
1 411 . 1 1 1 A 36 36 LEU CA C 36 57.461 57.555 -0.094 1
1 412 . 1 1 1 A 36 36 LEU CB C 36 41.344 40.882 0.462 1
1 416 . 1 1 1 A 36 36 LEU N N 36 117.671 120.352 -2.681 1
1 417 . 1 1 1 A 37 37 MET H H 37 7.822 7.840 -0.018 1
1 418 . 1 1 1 A 37 37 MET HA H 37 4.401 3.907 0.494 1
1 425 . 1 1 1 A 37 37 MET C C 37 177.862 177.792 0.070 1
1 426 . 1 1 1 A 37 37 MET CA C 37 56.434 58.603 -2.169 1
1 427 . 1 1 1 A 37 37 MET CB C 37 31.573 33.101 -1.528 1
1 430 . 1 1 1 A 37 37 MET N N 37 112.952 116.093 -3.141 1
1 431 . 1 1 1 A 38 38 GLU H H 38 8.667 7.783 0.884 1
1 432 . 1 1 1 A 38 38 GLU HA H 38 4.457 4.211 0.246 1
1 436 . 1 1 1 A 38 38 GLU C C 38 176.582 177.231 -0.649 1
1 437 . 1 1 1 A 38 38 GLU CA C 38 57.659 58.187 -0.528 1
1 438 . 1 1 1 A 38 38 GLU CB C 38 29.936 30.275 -0.339 1
1 440 . 1 1 1 A 38 38 GLU N N 38 116.463 118.784 -2.321 1
1 441 . 1 1 1 A 39 39 SER H H 39 7.657 8.305 -0.648 1
1 442 . 1 1 1 A 39 39 SER HA H 39 4.658 4.496 0.162 1
1 445 . 1 1 1 A 39 39 SER C C 39 175.661 175.356 0.305 1
1 446 . 1 1 1 A 39 39 SER CA C 39 60.449 60.463 -0.014 1
1 447 . 1 1 1 A 39 39 SER CB C 39 63.341 64.536 -1.195 1
1 448 . 1 1 1 A 39 39 SER N N 39 113.870 113.450 0.420 1
1 449 . 1 1 1 A 40 40 LYS H H 40 8.165 7.906 0.259 1
1 450 . 1 1 1 A 40 40 LYS HA H 40 4.454 4.187 0.267 1
1 458 . 1 1 1 A 40 40 LYS C C 40 174.970 176.307 -1.337 1
1 459 . 1 1 1 A 40 40 LYS CA C 40 55.753 58.401 -2.648 1
1 460 . 1 1 1 A 40 40 LYS CB C 40 32.337 33.128 -0.791 1
1 464 . 1 1 1 A 40 40 LYS N N 40 116.671 121.671 -5.000 1
1 465 . 1 1 1 A 41 41 SER H H 41 7.017 7.991 -0.974 1
1 466 . 1 1 1 A 41 41 SER HA H 41 4.209 4.118 0.091 1
1 469 . 1 1 1 A 41 41 SER C C 41 173.770 173.424 0.346 1
1 470 . 1 1 1 A 41 41 SER CA C 41 58.435 59.137 -0.702 1
1 471 . 1 1 1 A 41 41 SER CB C 41 61.700 61.725 -0.025 1
1 472 . 1 1 1 A 41 41 SER N N 41 109.989 113.702 -3.713 1
1 473 . 1 1 1 A 42 42 TRP H H 42 8.876 8.799 0.077 1
1 474 . 1 1 1 A 42 42 TRP HA H 42 4.698 4.987 -0.289 1
1 478 . 1 1 1 A 42 42 TRP C C 42 174.477 176.640 -2.163 1
1 479 . 1 1 1 A 42 42 TRP CA C 42 59.443 56.127 3.316 1
1 480 . 1 1 1 A 42 42 TRP CB C 42 28.203 32.881 -4.678 1
1 481 . 1 1 1 A 42 42 TRP N N 42 121.116 127.220 -6.104 1
1 483 . 1 1 1 A 43 43 HIS H H 43 8.132 8.439 -0.307 1
1 484 . 1 1 1 A 43 43 HIS HA H 43 4.445 4.514 -0.069 1
1 488 . 1 1 1 A 43 43 HIS C C 43 174.405 174.504 -0.099 1
1 489 . 1 1 1 A 43 43 HIS CA C 43 58.556 58.093 0.463 1
1 490 . 1 1 1 A 43 43 HIS CB C 43 29.430 31.042 -1.612 1
1 491 . 1 1 1 A 43 43 HIS N N 43 119.397 122.325 -2.928 1
1 492 . 1 1 1 A 44 44 GLU H H 44 8.140 7.564 0.576 1
1 493 . 1 1 1 A 44 44 GLU HA H 44 4.432 4.687 -0.255 1
1 497 . 1 1 1 A 44 44 GLU C C 44 173.010 174.470 -1.460 1
1 498 . 1 1 1 A 44 44 GLU CA C 44 56.421 56.093 0.328 1
1 499 . 1 1 1 A 44 44 GLU CB C 44 33.285 33.237 0.048 1
1 501 . 1 1 1 A 44 44 GLU N N 44 116.181 118.058 -1.877 1
1 502 . 1 1 1 A 45 45 VAL H H 45 8.428 8.911 -0.483 1
1 503 . 1 1 1 A 45 45 VAL HA H 45 4.492 5.223 -0.731 1
1 511 . 1 1 1 A 45 45 VAL C C 45 172.339 174.879 -2.540 1
1 512 . 1 1 1 A 45 45 VAL CA C 45 63.071 61.472 1.599 1
1 513 . 1 1 1 A 45 45 VAL CB C 45 35.145 34.815 0.330 1
1 516 . 1 1 1 A 45 45 VAL N N 45 123.272 126.148 -2.876 1
1 517 . 1 1 1 A 46 46 ASN H H 46 9.050 8.992 0.058 1
1 518 . 1 1 1 A 46 46 ASN HA H 46 5.261 5.459 -0.198 1
1 523 . 1 1 1 A 46 46 ASN C C 46 172.845 173.437 -0.592 1
1 524 . 1 1 1 A 46 46 ASN CA C 46 51.895 51.920 -0.025 1
1 525 . 1 1 1 A 46 46 ASN CB C 46 42.322 42.199 0.123 1
1 526 . 1 1 1 A 46 46 ASN N N 46 123.901 124.549 -0.648 1
1 528 . 1 1 1 A 47 47 CYS H H 47 9.039 9.071 -0.032 1
1 529 . 1 1 1 A 47 47 CYS HA H 47 5.160 5.348 -0.188 1
1 532 . 1 1 1 A 47 47 CYS C C 47 172.454 173.370 -0.916 1
1 533 . 1 1 1 A 47 47 CYS CA C 47 56.473 56.884 -0.411 1
1 534 . 1 1 1 A 47 47 CYS CB C 47 29.297 29.968 -0.671 1
1 535 . 1 1 1 A 47 47 CYS N N 47 119.663 121.040 -1.377 1
1 536 . 1 1 1 A 48 48 VAL H H 48 9.083 9.493 -0.410 1
1 537 . 1 1 1 A 48 48 VAL HA H 48 4.344 4.740 -0.396 1
1 542 . 1 1 1 A 48 48 VAL C C 48 173.307 175.067 -1.760 1
1 543 . 1 1 1 A 48 48 VAL CA C 48 61.368 60.767 0.601 1
1 544 . 1 1 1 A 48 48 VAL CB C 48 35.345 34.960 0.385 1
1 546 . 1 1 1 A 48 48 VAL N N 48 124.672 126.859 -2.187 1
1 547 . 1 1 1 A 49 49 GLY H H 49 9.019 9.092 -0.073 1
1 548 . 1 1 1 A 49 49 GLY HA2 H 49 3.460 4.199 -0.739 1
1 549 . 1 1 1 A 49 49 GLY HA3 H 49 4.539 4.201 0.338 1
1 550 . 1 1 1 A 49 49 GLY C C 49 171.278 172.429 -1.151 1
1 551 . 1 1 1 A 49 49 GLY CA C 49 45.075 44.572 0.503 1
1 552 . 1 1 1 A 49 49 GLY N N 49 113.131 115.889 -2.758 1
1 553 . 1 1 1 A 50 50 LEU H H 50 8.747 9.099 -0.352 1
1 554 . 1 1 1 A 50 50 LEU HA H 50 5.102 4.971 0.131 1
1 564 . 1 1 1 A 50 50 LEU CA C 50 51.417 51.428 -0.011 1
1 565 . 1 1 1 A 50 50 LEU CB C 50 41.754 42.145 -0.391 1
1 569 . 1 1 1 A 50 50 LEU N N 50 124.471 126.709 -2.238 1
1 570 . 1 1 1 A 51 51 PRO HA H 51 4.106 4.275 -0.169 1
1 577 . 1 1 1 A 51 51 PRO C C 51 178.422 178.572 -0.150 1
1 578 . 1 1 1 A 51 51 PRO CA C 51 65.680 64.661 1.019 1
1 579 . 1 1 1 A 51 51 PRO CB C 51 31.939 32.021 -0.082 1
1 582 . 1 1 1 A 52 52 GLU H H 52 9.721 8.484 1.237 1
1 583 . 1 1 1 A 52 52 GLU HA H 52 4.176 4.062 0.114 1
1 588 . 1 1 1 A 52 52 GLU C C 52 176.146 178.546 -2.400 1
1 589 . 1 1 1 A 52 52 GLU CA C 52 59.158 59.396 -0.238 1
1 590 . 1 1 1 A 52 52 GLU CB C 52 28.442 29.223 -0.781 1
1 592 . 1 1 1 A 52 52 GLU N N 52 118.552 118.067 0.485 1
1 593 . 1 1 1 A 53 53 LEU H H 53 7.089 7.898 -0.809 1
1 594 . 1 1 1 A 53 53 LEU HA H 53 4.511 4.418 0.093 1
1 603 . 1 1 1 A 53 53 LEU C C 53 174.027 176.606 -2.579 1
1 604 . 1 1 1 A 53 53 LEU CA C 53 53.825 55.307 -1.482 1
1 605 . 1 1 1 A 53 53 LEU CB C 53 43.825 43.173 0.652 1
1 608 . 1 1 1 A 53 53 LEU N N 53 116.763 119.277 -2.514 1
1 609 . 1 1 1 A 54 54 GLN H H 54 7.964 8.046 -0.082 1
1 610 . 1 1 1 A 54 54 GLN HA H 54 3.591 3.912 -0.321 1
1 616 . 1 1 1 A 54 54 GLN C C 54 172.604 174.314 -1.710 1
1 617 . 1 1 1 A 54 54 GLN CA C 54 56.961 57.205 -0.244 1
1 618 . 1 1 1 A 54 54 GLN CB C 54 26.545 27.560 -1.015 1
1 620 . 1 1 1 A 54 54 GLN N N 54 115.489 119.194 -3.705 1
1 622 . 1 1 1 A 55 55 LEU H H 55 7.139 7.222 -0.083 1
1 623 . 1 1 1 A 55 55 LEU HA H 55 4.750 4.866 -0.116 1
1 629 . 1 1 1 A 55 55 LEU C C 55 173.475 175.459 -1.984 1
1 630 . 1 1 1 A 55 55 LEU CA C 55 53.698 53.486 0.212 1
1 631 . 1 1 1 A 55 55 LEU CB C 55 47.859 44.012 3.847 1
1 633 . 1 1 1 A 55 55 LEU N N 55 116.422 119.695 -3.273 1
1 634 . 1 1 1 A 56 56 ILE H H 56 8.223 8.784 -0.561 1
1 635 . 1 1 1 A 56 56 ILE HA H 56 4.540 5.281 -0.741 1
1 643 . 1 1 1 A 56 56 ILE C C 56 173.938 174.244 -0.306 1
1 644 . 1 1 1 A 56 56 ILE CA C 56 61.020 59.697 1.323 1
1 645 . 1 1 1 A 56 56 ILE CB C 56 39.403 41.199 -1.796 1
1 648 . 1 1 1 A 56 56 ILE N N 56 122.792 121.982 0.810 1
1 649 . 1 1 1 A 57 57 CYS H H 57 8.995 9.004 -0.009 1
1 650 . 1 1 1 A 57 57 CYS HA H 57 5.036 5.130 -0.094 1
1 653 . 1 1 1 A 57 57 CYS C C 57 170.483 172.800 -2.317 1
1 654 . 1 1 1 A 57 57 CYS CA C 57 56.484 56.797 -0.313 1
1 655 . 1 1 1 A 57 57 CYS CB C 57 30.545 31.558 -1.013 1
1 656 . 1 1 1 A 57 57 CYS N N 57 121.575 122.746 -1.171 1
1 657 . 1 1 1 A 58 58 LEU H H 58 9.076 8.630 0.446 1
1 658 . 1 1 1 A 58 58 LEU HA H 58 5.472 5.753 -0.281 1
1 668 . 1 1 1 A 58 58 LEU C C 58 174.009 175.980 -1.971 1
1 669 . 1 1 1 A 58 58 LEU CA C 58 52.851 53.816 -0.965 1
1 670 . 1 1 1 A 58 58 LEU CB C 58 42.177 42.883 -0.706 1
1 674 . 1 1 1 A 58 58 LEU N N 58 121.895 122.266 -0.371 1
1 675 . 1 1 1 A 59 59 VAL H H 59 8.966 8.640 0.326 1
1 676 . 1 1 1 A 59 59 VAL HA H 59 5.488 5.209 0.279 1
1 681 . 1 1 1 A 59 59 VAL C C 59 176.034 175.852 0.182 1
1 682 . 1 1 1 A 59 59 VAL CA C 59 59.820 60.789 -0.969 1
1 683 . 1 1 1 A 59 59 VAL CB C 59 34.786 35.023 -0.237 1
1 685 . 1 1 1 A 59 59 VAL N N 59 121.702 124.329 -2.627 1
1 686 . 1 1 1 A 60 60 GLY H H 60 9.258 7.811 1.447 1
1 687 . 1 1 1 A 60 60 GLY HA2 H 60 4.673 4.394 0.279 1
1 688 . 1 1 1 A 60 60 GLY HA3 H 60 4.804 4.454 0.350 1
1 689 . 1 1 1 A 60 60 GLY C C 60 169.831 172.480 -2.649 1
1 690 . 1 1 1 A 60 60 GLY CA C 60 46.399 46.162 0.237 1
1 691 . 1 1 1 A 60 60 GLY N N 60 114.126 112.823 1.303 1
1 692 . 1 1 1 A 61 61 THR H H 61 8.834 8.188 0.646 1
1 693 . 1 1 1 A 61 61 THR HA H 61 4.418 4.985 -0.567 1
1 698 . 1 1 1 A 61 61 THR C C 61 171.985 174.926 -2.941 1
1 699 . 1 1 1 A 61 61 THR CA C 61 60.634 60.499 0.135 1
1 700 . 1 1 1 A 61 61 THR CB C 61 70.983 70.525 0.458 1
1 702 . 1 1 1 A 61 61 THR N N 61 114.856 112.500 2.356 1
1 703 . 1 1 1 A 62 62 GLU H H 62 8.502 8.703 -0.201 1
1 704 . 1 1 1 A 62 62 GLU HA H 62 2.867 3.456 -0.589 1
1 709 . 1 1 1 A 62 62 GLU C C 62 174.650 175.995 -1.345 1
1 710 . 1 1 1 A 62 62 GLU CA C 62 58.785 58.574 0.211 1
1 711 . 1 1 1 A 62 62 GLU CB C 62 28.981 29.535 -0.554 1
1 713 . 1 1 1 A 62 62 GLU N N 62 129.915 123.756 6.159 1
1 714 . 1 1 1 A 63 63 ILE H H 63 6.928 7.844 -0.916 1
1 715 . 1 1 1 A 63 63 ILE HA H 63 4.038 4.516 -0.478 1
1 725 . 1 1 1 A 63 63 ILE C C 63 173.482 174.484 -1.002 1
1 726 . 1 1 1 A 63 63 ILE CA C 63 58.664 60.290 -1.626 1
1 727 . 1 1 1 A 63 63 ILE CB C 63 40.009 41.372 -1.363 1
1 731 . 1 1 1 A 63 63 ILE N N 63 117.075 117.838 -0.763 1
1 732 . 1 1 1 A 64 64 GLU H H 64 8.585 8.656 -0.071 1
1 733 . 1 1 1 A 64 64 GLU HA H 64 3.427 4.159 -0.732 1
1 738 . 1 1 1 A 64 64 GLU C C 64 175.186 176.902 -1.716 1
1 739 . 1 1 1 A 64 64 GLU CA C 64 58.703 57.620 1.083 1
1 740 . 1 1 1 A 64 64 GLU CB C 64 28.999 29.412 -0.413 1
1 742 . 1 1 1 A 64 64 GLU N N 64 126.422 127.786 -1.364 1
1 743 . 1 1 1 A 65 65 GLY H H 65 8.754 8.560 0.194 1
1 744 . 1 1 1 A 65 65 GLY HA2 H 65 3.631 3.952 -0.321 1
1 745 . 1 1 1 A 65 65 GLY HA3 H 65 4.287 3.959 0.328 1
1 746 . 1 1 1 A 65 65 GLY C C 65 174.005 175.068 -1.063 1
1 747 . 1 1 1 A 65 65 GLY CA C 65 44.954 45.423 -0.469 1
1 748 . 1 1 1 A 65 65 GLY N N 65 114.614 114.210 0.404 1
1 749 . 1 1 1 A 66 66 GLU H H 66 7.760 7.712 0.048 1
1 750 . 1 1 1 A 66 66 GLU HA H 66 4.462 4.621 -0.159 1
1 754 . 1 1 1 A 66 66 GLU C C 66 175.255 175.687 -0.432 1
1 755 . 1 1 1 A 66 66 GLU CA C 66 55.582 55.649 -0.067 1
1 756 . 1 1 1 A 66 66 GLU CB C 66 30.654 31.552 -0.898 1
1 758 . 1 1 1 A 66 66 GLU N N 66 119.292 120.567 -1.275 1
1 759 . 1 1 1 A 67 67 GLY H H 67 8.262 8.321 -0.059 1
1 760 . 1 1 1 A 67 67 GLY HA2 H 67 3.875 4.157 -0.282 1
1 761 . 1 1 1 A 67 67 GLY HA3 H 67 4.088 4.172 -0.084 1
1 762 . 1 1 1 A 67 67 GLY C C 67 172.197 173.373 -1.176 1
1 763 . 1 1 1 A 67 67 GLY CA C 67 44.845 45.623 -0.778 1
1 764 . 1 1 1 A 67 67 GLY N N 67 106.161 108.256 -2.095 1
1 765 . 1 1 1 A 68 68 LEU H H 68 8.142 7.577 0.565 1
1 766 . 1 1 1 A 68 68 LEU HA H 68 4.491 4.755 -0.264 1
1 775 . 1 1 1 A 68 68 LEU C C 68 176.194 175.100 1.094 1
1 776 . 1 1 1 A 68 68 LEU CA C 68 55.123 54.234 0.889 1
1 777 . 1 1 1 A 68 68 LEU CB C 68 44.527 43.480 1.047 1
1 780 . 1 1 1 A 68 68 LEU N N 68 120.269 121.333 -1.064 1
1 781 . 1 1 1 A 69 69 GLN H H 69 9.253 8.286 0.967 1
1 782 . 1 1 1 A 69 69 GLN HA H 69 4.770 4.655 0.115 1
1 788 . 1 1 1 A 69 69 GLN C C 69 173.607 174.036 -0.429 1
1 789 . 1 1 1 A 69 69 GLN CA C 69 54.736 55.947 -1.211 1
1 790 . 1 1 1 A 69 69 GLN CB C 69 33.782 31.591 2.191 1
1 792 . 1 1 1 A 69 69 GLN N N 69 119.336 124.530 -5.194 1
1 794 . 1 1 1 A 70 70 THR H H 70 8.803 8.939 -0.136 1
1 795 . 1 1 1 A 70 70 THR HA H 70 5.033 5.182 -0.149 1
1 800 . 1 1 1 A 70 70 THR C C 70 172.596 173.954 -1.358 1
1 801 . 1 1 1 A 70 70 THR CA C 70 62.768 61.700 1.068 1
1 802 . 1 1 1 A 70 70 THR CB C 70 69.990 71.626 -1.636 1
1 804 . 1 1 1 A 70 70 THR N N 70 118.372 121.101 -2.729 1
1 805 . 1 1 1 A 71 71 VAL H H 71 9.882 9.382 0.500 1
1 806 . 1 1 1 A 71 71 VAL HA H 71 5.239 5.286 -0.047 1
1 811 . 1 1 1 A 71 71 VAL C C 71 174.015 175.253 -1.238 1
1 812 . 1 1 1 A 71 71 VAL CA C 71 60.577 59.845 0.732 1
1 813 . 1 1 1 A 71 71 VAL CB C 71 34.149 34.710 -0.561 1
1 815 . 1 1 1 A 71 71 VAL N N 71 129.063 121.748 7.315 1
1 816 . 1 1 1 A 72 72 VAL H H 72 9.491 8.652 0.839 1
1 817 . 1 1 1 A 72 72 VAL HA H 72 4.672 4.941 -0.269 1
1 825 . 1 1 1 A 72 72 VAL CA C 72 59.568 57.989 1.579 1
1 826 . 1 1 1 A 72 72 VAL CB C 72 34.057 34.292 -0.235 1
1 829 . 1 1 1 A 72 72 VAL N N 72 128.521 119.924 8.597 1
1 830 . 1 1 1 A 73 73 PRO HA H 73 5.368 4.840 0.528 1
1 836 . 1 1 1 A 73 73 PRO C C 73 175.079 176.043 -0.964 1
1 837 . 1 1 1 A 73 73 PRO CA C 73 61.324 62.477 -1.153 1
1 838 . 1 1 1 A 73 73 PRO CB C 73 33.089 31.758 1.331 1
1 841 . 1 1 1 A 74 74 THR H H 74 9.103 8.840 0.263 1
1 842 . 1 1 1 A 74 74 THR HA H 74 5.191 4.872 0.319 1
1 847 . 1 1 1 A 74 74 THR CA C 74 57.986 59.182 -1.196 1
1 848 . 1 1 1 A 74 74 THR CB C 74 72.212 71.861 0.351 1
1 850 . 1 1 1 A 74 74 THR N N 74 118.075 118.825 -0.750 1
1 851 . 1 1 1 A 75 75 PRO HA H 75 5.015 4.638 0.377 1
1 858 . 1 1 1 A 75 75 PRO C C 75 178.704 177.880 0.824 1
1 859 . 1 1 1 A 75 75 PRO CA C 75 63.038 62.816 0.222 1
1 860 . 1 1 1 A 75 75 PRO CB C 75 32.529 32.814 -0.285 1
1 863 . 1 1 1 A 76 76 ILE H H 76 8.221 9.082 -0.861 1
1 864 . 1 1 1 A 76 76 ILE HA H 76 4.218 4.007 0.211 1
1 873 . 1 1 1 A 76 76 ILE C C 76 172.375 177.429 -5.054 1
1 874 . 1 1 1 A 76 76 ILE CA C 76 63.509 63.348 0.161 1
1 875 . 1 1 1 A 76 76 ILE CB C 76 39.322 38.241 1.081 1
1 879 . 1 1 1 A 76 76 ILE N N 76 122.273 123.860 -1.587 1
1 880 . 1 1 1 A 77 77 THR H H 77 6.984 7.672 -0.688 1
1 881 . 1 1 1 A 77 77 THR HA H 77 4.227 4.605 -0.378 1
1 886 . 1 1 1 A 77 77 THR C C 77 173.531 174.144 -0.613 1
1 887 . 1 1 1 A 77 77 THR CA C 77 61.435 61.291 0.144 1
1 888 . 1 1 1 A 77 77 THR CB C 77 68.944 68.968 -0.024 1
1 890 . 1 1 1 A 77 77 THR N N 77 105.803 114.631 -8.828 1
1 891 . 1 1 1 A 78 78 ALA H H 78 7.647 7.557 0.090 1
1 892 . 1 1 1 A 78 78 ALA HA H 78 4.757 4.353 0.404 1
1 896 . 1 1 1 A 78 78 ALA C C 78 173.520 176.994 -3.474 1
1 897 . 1 1 1 A 78 78 ALA CA C 78 51.164 52.197 -1.033 1
1 898 . 1 1 1 A 78 78 ALA CB C 78 20.011 20.398 -0.387 1
1 899 . 1 1 1 A 78 78 ALA N N 78 126.635 125.785 0.850 1
1 900 . 1 1 1 A 79 79 SER H H 79 7.884 8.762 -0.878 1
1 901 . 1 1 1 A 79 79 SER HA H 79 4.386 5.332 -0.946 1
1 903 . 1 1 1 A 79 79 SER C C 79 176.077 172.661 3.416 1
1 904 . 1 1 1 A 79 79 SER CA C 79 57.465 56.540 0.925 1
1 905 . 1 1 1 A 79 79 SER CB C 79 65.285 64.591 0.694 1
1 906 . 1 1 1 A 79 79 SER N N 79 115.272 113.458 1.814 1
1 907 . 1 1 1 A 80 80 LEU H H 80 7.700 8.935 -1.235 1
1 908 . 1 1 1 A 80 80 LEU HA H 80 4.912 4.970 -0.058 1
1 915 . 1 1 1 A 80 80 LEU C C 80 173.927 174.694 -0.767 1
1 916 . 1 1 1 A 80 80 LEU CA C 80 53.829 53.866 -0.037 1
1 917 . 1 1 1 A 80 80 LEU CB C 80 45.990 43.992 1.998 1
1 920 . 1 1 1 A 80 80 LEU N N 80 121.507 128.402 -6.895 1
1 921 . 1 1 1 A 81 81 SER H H 81 7.885 8.818 -0.933 1
1 922 . 1 1 1 A 81 81 SER HA H 81 5.269 4.861 0.408 1
1 925 . 1 1 1 A 81 81 SER C C 81 175.756 175.521 0.235 1
1 926 . 1 1 1 A 81 81 SER CA C 81 55.507 56.969 -1.462 1
1 927 . 1 1 1 A 81 81 SER CB C 81 65.966 65.468 0.498 1
1 928 . 1 1 1 A 81 81 SER N N 81 118.323 123.736 -5.413 1
1 929 . 1 1 1 A 82 82 HIS H H 82 8.935 8.967 -0.032 1
1 930 . 1 1 1 A 82 82 HIS HA H 82 4.407 4.392 0.015 1
1 932 . 1 1 1 A 82 82 HIS C C 82 176.550 177.032 -0.482 1
1 933 . 1 1 1 A 82 82 HIS CA C 82 60.960 59.190 1.770 1
1 934 . 1 1 1 A 82 82 HIS CB C 82 30.755 29.483 1.272 1
1 935 . 1 1 1 A 82 82 HIS N N 82 124.042 121.894 2.148 1
1 936 . 1 1 1 A 83 83 ASN H H 83 8.435 8.182 0.253 1
1 937 . 1 1 1 A 83 83 ASN HA H 83 4.439 4.248 0.191 1
1 941 . 1 1 1 A 83 83 ASN C C 83 174.769 177.834 -3.065 1
1 942 . 1 1 1 A 83 83 ASN CA C 83 56.575 56.703 -0.128 1
1 943 . 1 1 1 A 83 83 ASN CB C 83 38.731 39.200 -0.469 1
1 944 . 1 1 1 A 83 83 ASN N N 83 118.543 120.493 -1.950 1
1 946 . 1 1 1 A 84 84 ARG H H 84 7.716 7.875 -0.159 1
1 947 . 1 1 1 A 84 84 ARG HA H 84 4.183 4.191 -0.008 1
1 953 . 1 1 1 A 84 84 ARG C C 84 177.399 178.685 -1.286 1
1 954 . 1 1 1 A 84 84 ARG CA C 84 59.045 58.845 0.200 1
1 955 . 1 1 1 A 84 84 ARG CB C 84 29.992 30.050 -0.058 1
1 957 . 1 1 1 A 84 84 ARG N N 84 121.312 119.650 1.662 1
1 958 . 1 1 1 A 85 85 ILE H H 85 8.354 7.784 0.570 1
1 959 . 1 1 1 A 85 85 ILE HA H 85 3.650 3.936 -0.286 1
1 967 . 1 1 1 A 85 85 ILE C C 85 176.098 177.666 -1.568 1
1 968 . 1 1 1 A 85 85 ILE CA C 85 66.704 64.565 2.139 1
1 969 . 1 1 1 A 85 85 ILE CB C 85 38.017 37.681 0.336 1
1 972 . 1 1 1 A 85 85 ILE N N 85 119.321 119.277 0.044 1
1 973 . 1 1 1 A 86 86 ARG H H 86 7.690 8.412 -0.722 1
1 974 . 1 1 1 A 86 86 ARG HA H 86 3.704 4.118 -0.414 1
1 981 . 1 1 1 A 86 86 ARG C C 86 177.524 178.163 -0.639 1
1 982 . 1 1 1 A 86 86 ARG CA C 86 59.881 58.464 1.417 1
1 983 . 1 1 1 A 86 86 ARG CB C 86 29.248 29.968 -0.720 1
1 986 . 1 1 1 A 86 86 ARG N N 86 118.362 122.626 -4.264 1
1 987 . 1 1 1 A 87 87 GLU H H 87 7.884 7.716 0.168 1
1 988 . 1 1 1 A 87 87 GLU HA H 87 4.064 4.087 -0.023 1
1 993 . 1 1 1 A 87 87 GLU C C 87 178.785 179.447 -0.662 1
1 994 . 1 1 1 A 87 87 GLU CA C 87 58.999 59.025 -0.026 1
1 995 . 1 1 1 A 87 87 GLU CB C 87 29.872 29.714 0.158 1
1 997 . 1 1 1 A 87 87 GLU N N 87 118.124 118.661 -0.537 1
1 998 . 1 1 1 A 88 88 ILE H H 88 8.715 8.040 0.675 1
1 999 . 1 1 1 A 88 88 ILE HA H 88 3.305 3.526 -0.221 1
1 1009 . 1 1 1 A 88 88 ILE C C 88 177.261 178.022 -0.761 1
1 1010 . 1 1 1 A 88 88 ILE CA C 88 65.822 65.831 -0.009 1
1 1011 . 1 1 1 A 88 88 ILE CB C 88 37.370 37.257 0.113 1
1 1015 . 1 1 1 A 88 88 ILE N N 88 122.929 120.475 2.454 1
1 1016 . 1 1 1 A 89 89 LEU H H 89 8.486 8.599 -0.113 1
1 1017 . 1 1 1 A 89 89 LEU HA H 89 3.932 3.878 0.054 1
1 1023 . 1 1 1 A 89 89 LEU C C 89 177.919 179.140 -1.221 1
1 1024 . 1 1 1 A 89 89 LEU CA C 89 59.060 58.269 0.791 1
1 1025 . 1 1 1 A 89 89 LEU CB C 89 41.129 41.685 -0.556 1
1 1028 . 1 1 1 A 89 89 LEU N N 89 122.696 120.490 2.206 1
1 1029 . 1 1 1 A 90 90 LYS H H 90 7.790 7.982 -0.192 1
1 1030 . 1 1 1 A 90 90 LYS HA H 90 4.061 3.930 0.131 1
1 1035 . 1 1 1 A 90 90 LYS C C 90 178.432 178.727 -0.295 1
1 1036 . 1 1 1 A 90 90 LYS CA C 90 59.840 59.052 0.788 1
1 1037 . 1 1 1 A 90 90 LYS CB C 90 32.582 32.309 0.273 1
1 1039 . 1 1 1 A 90 90 LYS N N 90 118.640 119.907 -1.267 1
1 1040 . 1 1 1 A 91 91 ALA H H 91 8.113 8.166 -0.053 1
1 1041 . 1 1 1 A 91 91 ALA HA H 91 4.151 4.079 0.072 1
1 1045 . 1 1 1 A 91 91 ALA C C 91 179.147 179.591 -0.444 1
1 1046 . 1 1 1 A 91 91 ALA CA C 91 54.942 55.212 -0.270 1
1 1047 . 1 1 1 A 91 91 ALA CB C 91 18.242 18.406 -0.164 1
1 1048 . 1 1 1 A 91 91 ALA N N 91 122.939 121.927 1.012 1
1 1049 . 1 1 1 A 92 92 SER H H 92 8.858 8.235 0.623 1
1 1050 . 1 1 1 A 92 92 SER HA H 92 4.898 4.188 0.710 1
1 1052 . 1 1 1 A 92 92 SER C C 92 172.440 176.916 -4.476 1
1 1053 . 1 1 1 A 92 92 SER CA C 92 61.913 61.128 0.785 1
1 1054 . 1 1 1 A 92 92 SER CB C 92 63.081 62.852 0.229 1
1 1055 . 1 1 1 A 92 92 SER N N 92 114.526 113.533 0.993 1
1 1056 . 1 1 1 A 93 93 ARG H H 93 7.704 8.245 -0.541 1
1 1057 . 1 1 1 A 93 93 ARG HA H 93 4.162 4.158 0.004 1
1 1059 . 1 1 1 A 93 93 ARG C C 93 177.757 178.857 -1.100 1
1 1060 . 1 1 1 A 93 93 ARG CA C 93 59.544 59.048 0.496 1
1 1061 . 1 1 1 A 93 93 ARG CB C 93 30.343 29.878 0.465 1
1 1062 . 1 1 1 A 93 93 ARG N N 93 121.505 122.003 -0.498 1
1 1063 . 1 1 1 A 94 94 LYS H H 94 7.456 7.969 -0.513 1
1 1064 . 1 1 1 A 94 94 LYS HA H 94 4.174 4.091 0.083 1
1 1071 . 1 1 1 A 94 94 LYS C C 94 178.861 178.893 -0.032 1
1 1072 . 1 1 1 A 94 94 LYS CA C 94 59.030 58.995 0.035 1
1 1073 . 1 1 1 A 94 94 LYS CB C 94 32.239 31.901 0.338 1
1 1077 . 1 1 1 A 94 94 LYS N N 94 119.072 118.864 0.208 1
1 1078 . 1 1 1 A 95 95 LEU H H 95 8.148 7.708 0.440 1
1 1079 . 1 1 1 A 95 95 LEU HA H 95 4.129 4.080 0.049 1
1 1088 . 1 1 1 A 95 95 LEU C C 95 177.274 178.138 -0.864 1
1 1089 . 1 1 1 A 95 95 LEU CA C 95 57.136 57.836 -0.700 1
1 1090 . 1 1 1 A 95 95 LEU CB C 95 41.908 41.658 0.250 1
1 1093 . 1 1 1 A 95 95 LEU N N 95 119.717 121.291 -1.574 1
1 1094 . 1 1 1 A 96 96 GLN H H 96 7.807 7.718 0.089 1
1 1095 . 1 1 1 A 96 96 GLN HA H 96 4.242 4.380 -0.138 1
1 1102 . 1 1 1 A 96 96 GLN C C 96 175.371 176.233 -0.862 1
1 1103 . 1 1 1 A 96 96 GLN CA C 96 56.397 55.369 1.028 1
1 1104 . 1 1 1 A 96 96 GLN CB C 96 29.123 29.096 0.027 1
1 1106 . 1 1 1 A 96 96 GLN N N 96 114.581 115.417 -0.836 1
1 1108 . 1 1 1 A 97 97 GLY H H 97 7.802 8.314 -0.512 1
1 1109 . 1 1 1 A 97 97 GLY HA2 H 97 3.839 3.908 -0.069 1
1 1110 . 1 1 1 A 97 97 GLY HA3 H 97 4.096 3.908 0.188 1
1 1111 . 1 1 1 A 97 97 GLY C C 97 172.636 173.705 -1.069 1
1 1112 . 1 1 1 A 97 97 GLY CA C 97 46.372 46.683 -0.311 1
1 1113 . 1 1 1 A 97 97 GLY N N 97 106.959 109.432 -2.473 1
1 1114 . 1 1 1 A 98 98 ASP H H 98 8.156 8.149 0.007 1
1 1115 . 1 1 1 A 98 98 ASP HA H 98 4.754 5.049 -0.295 1
1 1118 . 1 1 1 A 98 98 ASP CA C 98 52.882 50.432 2.450 1
1 1119 . 1 1 1 A 98 98 ASP CB C 98 41.603 43.099 -1.496 1
1 1120 . 1 1 1 A 98 98 ASP N N 98 118.447 119.788 -1.341 1
1 1121 . 1 1 1 A 99 99 PRO HA H 99 4.470 4.509 -0.039 1
1 1126 . 1 1 1 A 99 99 PRO C C 99 175.500 176.667 -1.167 1
1 1127 . 1 1 1 A 99 99 PRO CA C 99 63.601 64.038 -0.437 1
1 1128 . 1 1 1 A 99 99 PRO CB C 99 32.423 32.214 0.209 1
1 1130 . 1 1 1 A 100 100 ASP H H 100 8.527 8.800 -0.273 1
1 1131 . 1 1 1 A 100 100 ASP HA H 100 4.778 4.853 -0.075 1
1 1134 . 1 1 1 A 100 100 ASP C C 100 174.931 175.940 -1.009 1
1 1135 . 1 1 1 A 100 100 ASP CA C 100 53.915 53.524 0.391 1
1 1136 . 1 1 1 A 100 100 ASP CB C 100 40.665 42.602 -1.937 1
1 1137 . 1 1 1 A 100 100 ASP N N 100 119.340 116.081 3.259 1
1 1138 . 1 1 1 A 101 101 LEU H H 101 7.379 8.061 -0.682 1
1 1139 . 1 1 1 A 101 101 LEU HA H 101 4.682 4.521 0.161 1
1 1148 . 1 1 1 A 101 101 LEU CA C 101 52.956 53.322 -0.366 1
1 1149 . 1 1 1 A 101 101 LEU CB C 101 43.393 42.628 0.765 1
1 1152 . 1 1 1 A 101 101 LEU N N 101 122.107 122.774 -0.667 1
1 1153 . 1 1 1 A 102 102 PRO HA H 102 4.487 4.837 -0.350 1
1 1158 . 1 1 1 A 102 102 PRO C C 102 175.697 175.649 0.048 1
1 1159 . 1 1 1 A 102 102 PRO CA C 102 63.113 62.551 0.562 1
1 1160 . 1 1 1 A 102 102 PRO CB C 102 32.138 31.812 0.326 1
1 1163 . 1 1 1 A 103 103 MET H H 103 9.011 8.814 0.197 1
1 1164 . 1 1 1 A 103 103 MET HA H 103 4.769 5.159 -0.390 1
1 1171 . 1 1 1 A 103 103 MET C C 103 174.080 174.100 -0.020 1
1 1172 . 1 1 1 A 103 103 MET CA C 103 54.737 53.721 1.016 1
1 1173 . 1 1 1 A 103 103 MET CB C 103 34.857 35.586 -0.729 1
1 1176 . 1 1 1 A 103 103 MET N N 103 123.334 123.093 0.241 1
1 1177 . 1 1 1 A 104 104 SER H H 104 8.239 8.659 -0.420 1
1 1178 . 1 1 1 A 104 104 SER HA H 104 5.079 5.373 -0.294 1
1 1181 . 1 1 1 A 104 104 SER C C 104 171.795 173.119 -1.324 1
1 1182 . 1 1 1 A 104 104 SER CA C 104 57.641 57.141 0.500 1
1 1183 . 1 1 1 A 104 104 SER CB C 104 66.282 66.739 -0.457 1
1 1184 . 1 1 1 A 104 104 SER N N 104 114.434 114.498 -0.064 1
1 1185 . 1 1 1 A 105 105 PHE H H 105 9.003 8.357 0.646 1
1 1186 . 1 1 1 A 105 105 PHE HA H 105 5.209 5.297 -0.088 1
1 1193 . 1 1 1 A 105 105 PHE C C 105 170.688 172.172 -1.484 1
1 1194 . 1 1 1 A 105 105 PHE CA C 105 56.917 55.781 1.136 1
1 1195 . 1 1 1 A 105 105 PHE CB C 105 41.350 41.556 -0.206 1
1 1196 . 1 1 1 A 105 105 PHE N N 105 116.224 117.506 -1.282 1
1 1197 . 1 1 1 A 106 106 THR H H 106 9.074 8.915 0.159 1
1 1198 . 1 1 1 A 106 106 THR HA H 106 4.664 4.727 -0.063 1
1 1203 . 1 1 1 A 106 106 THR C C 106 171.767 174.328 -2.561 1
1 1204 . 1 1 1 A 106 106 THR CA C 106 62.162 62.338 -0.176 1
1 1205 . 1 1 1 A 106 106 THR CB C 106 70.072 70.220 -0.148 1
1 1207 . 1 1 1 A 106 106 THR N N 106 117.469 116.189 1.280 1
1 1208 . 1 1 1 A 107 107 LEU H H 107 9.804 9.365 0.439 1
1 1209 . 1 1 1 A 107 107 LEU HA H 107 4.750 5.062 -0.312 1
1 1219 . 1 1 1 A 107 107 LEU C C 107 172.742 175.668 -2.926 1
1 1220 . 1 1 1 A 107 107 LEU CA C 107 54.151 53.609 0.542 1
1 1221 . 1 1 1 A 107 107 LEU CB C 107 44.486 43.285 1.201 1
1 1224 . 1 1 1 A 107 107 LEU N N 107 133.400 126.587 6.813 1
1 1225 . 1 1 1 A 108 108 ALA H H 108 8.435 8.920 -0.485 1
1 1226 . 1 1 1 A 108 108 ALA HA H 108 4.683 4.605 0.078 1
1 1230 . 1 1 1 A 108 108 ALA C C 108 173.052 175.638 -2.586 1
1 1231 . 1 1 1 A 108 108 ALA CA C 108 49.308 50.478 -1.170 1
1 1232 . 1 1 1 A 108 108 ALA CB C 108 22.120 20.102 2.018 1
1 1233 . 1 1 1 A 108 108 ALA N N 108 131.422 126.959 4.463 1
1 1234 . 1 1 1 A 109 109 ILE H H 109 8.909 9.021 -0.112 1
1 1235 . 1 1 1 A 109 109 ILE HA H 109 4.063 5.257 -1.194 1
1 1245 . 1 1 1 A 109 109 ILE CA C 109 60.982 60.321 0.661 1
1 1246 . 1 1 1 A 109 109 ILE CB C 109 39.074 37.924 1.150 1
1 1250 . 1 1 1 A 109 109 ILE N N 109 124.415 123.801 0.614 1
1 1251 . 1 1 1 A 110 110 VAL H H 110 8.706 8.937 -0.231 1
1 1252 . 1 1 1 A 110 110 VAL HA H 110 4.324 5.053 -0.729 1
1 1260 . 1 1 1 A 110 110 VAL C C 110 175.700 174.277 1.423 1
1 1261 . 1 1 1 A 110 110 VAL CA C 110 62.316 59.957 2.359 1
1 1262 . 1 1 1 A 110 110 VAL CB C 110 31.876 34.475 -2.599 1
1 1264 . 1 1 1 A 110 110 VAL N N 110 127.457 128.456 -0.999 1
1 1265 . 1 1 1 A 111 111 GLU H H 111 9.024 9.037 -0.013 1
1 1266 . 1 1 1 A 111 111 GLU HA H 111 4.403 4.356 0.047 1
1 1269 . 1 1 1 A 111 111 GLU C C 111 175.987 177.468 -1.481 1
1 1270 . 1 1 1 A 111 111 GLU CA C 111 56.842 56.378 0.464 1
1 1271 . 1 1 1 A 111 111 GLU CB C 111 31.044 31.134 -0.090 1
1 1272 . 1 1 1 A 111 111 GLU N N 111 129.768 129.832 -0.064 1
1 1273 . 1 1 1 A 112 112 SER H H 112 9.143 9.058 0.085 1
1 1274 . 1 1 1 A 112 112 SER HA H 112 4.394 4.312 0.082 1
1 1276 . 1 1 1 A 112 112 SER C C 112 173.187 174.771 -1.584 1
1 1277 . 1 1 1 A 112 112 SER CA C 112 60.180 60.688 -0.508 1
1 1278 . 1 1 1 A 112 112 SER CB C 112 63.415 63.011 0.404 1
1 1279 . 1 1 1 A 112 112 SER N N 112 115.956 120.912 -4.956 1
1 1280 . 1 1 1 A 113 113 ASP H H 113 8.133 7.835 0.298 1
1 1281 . 1 1 1 A 113 113 ASP HA H 113 4.573 4.788 -0.215 1
1 1284 . 1 1 1 A 113 113 ASP C C 113 175.430 175.038 0.392 1
1 1285 . 1 1 1 A 113 113 ASP CA C 113 54.115 53.739 0.376 1
1 1286 . 1 1 1 A 113 113 ASP CB C 113 40.011 40.905 -0.894 1
1 1287 . 1 1 1 A 113 113 ASP N N 113 118.343 119.347 -1.004 1
1 1288 . 1 1 1 A 114 114 SER H H 114 8.034 8.001 0.033 1
1 1289 . 1 1 1 A 114 114 SER HA H 114 4.057 4.086 -0.029 1
1 1291 . 1 1 1 A 114 114 SER C C 114 172.209 173.574 -1.365 1
1 1292 . 1 1 1 A 114 114 SER CA C 114 60.179 59.534 0.645 1
1 1293 . 1 1 1 A 114 114 SER CB C 114 62.702 61.092 1.610 1
1 1294 . 1 1 1 A 114 114 SER N N 114 109.836 111.582 -1.746 1
1 1295 . 1 1 1 A 115 115 THR H H 115 7.711 7.809 -0.098 1
1 1296 . 1 1 1 A 115 115 THR HA H 115 4.250 4.262 -0.012 1
1 1300 . 1 1 1 A 115 115 THR C C 115 171.500 173.753 -2.253 1
1 1301 . 1 1 1 A 115 115 THR CA C 115 63.547 62.276 1.271 1
1 1302 . 1 1 1 A 115 115 THR CB C 115 69.595 69.100 0.495 1
1 1303 . 1 1 1 A 115 115 THR N N 115 117.407 115.696 1.711 1
1 1304 . 1 1 1 A 116 116 ILE H H 116 8.219 9.079 -0.860 1
1 1305 . 1 1 1 A 116 116 ILE HA H 116 4.769 4.946 -0.177 1
1 1315 . 1 1 1 A 116 116 ILE C C 116 174.434 175.253 -0.819 1
1 1316 . 1 1 1 A 116 116 ILE CA C 116 60.306 60.485 -0.179 1
1 1317 . 1 1 1 A 116 116 ILE CB C 116 40.686 37.778 2.908 1
1 1321 . 1 1 1 A 116 116 ILE N N 116 125.480 128.409 -2.929 1
1 1322 . 1 1 1 A 117 117 VAL H H 117 8.695 9.604 -0.909 1
1 1323 . 1 1 1 A 117 117 VAL HA H 117 4.315 4.512 -0.197 1
1 1328 . 1 1 1 A 117 117 VAL C C 117 172.243 174.588 -2.345 1
1 1329 . 1 1 1 A 117 117 VAL CA C 117 60.621 61.086 -0.465 1
1 1330 . 1 1 1 A 117 117 VAL CB C 117 34.558 33.095 1.463 1
1 1332 . 1 1 1 A 117 117 VAL N N 117 127.887 127.609 0.278 1
1 1333 . 1 1 1 A 118 118 TYR H H 118 8.270 9.015 -0.745 1
1 1334 . 1 1 1 A 118 118 TYR HA H 118 5.327 5.301 0.026 1
1 1342 . 1 1 1 A 118 118 TYR C C 118 174.250 174.639 -0.389 1
1 1343 . 1 1 1 A 118 118 TYR CA C 118 57.283 56.927 0.356 1
1 1344 . 1 1 1 A 118 118 TYR CB C 118 39.262 38.908 0.354 1
1 1345 . 1 1 1 A 118 118 TYR N N 118 124.822 126.956 -2.134 1
1 1346 . 1 1 1 A 119 119 TYR H H 119 9.207 9.337 -0.130 1
1 1347 . 1 1 1 A 119 119 TYR HA H 119 4.821 5.283 -0.462 1
1 1354 . 1 1 1 A 119 119 TYR C C 119 171.994 174.063 -2.069 1
1 1355 . 1 1 1 A 119 119 TYR CA C 119 58.116 56.633 1.483 1
1 1356 . 1 1 1 A 119 119 TYR CB C 119 43.544 41.479 2.065 1
1 1357 . 1 1 1 A 119 119 TYR N N 119 125.153 125.803 -0.650 1
1 1358 . 1 1 1 A 120 120 LYS H H 120 7.700 8.697 -0.997 1
1 1359 . 1 1 1 A 120 120 LYS HA H 120 4.558 4.662 -0.104 1
1 1366 . 1 1 1 A 120 120 LYS C C 120 172.017 174.576 -2.559 1
1 1367 . 1 1 1 A 120 120 LYS CA C 120 57.217 55.621 1.596 1
1 1368 . 1 1 1 A 120 120 LYS CB C 120 33.914 33.376 0.538 1
1 1372 . 1 1 1 A 120 120 LYS N N 120 129.442 129.573 -0.131 1
1 1373 . 1 1 1 A 121 121 LEU H H 121 8.112 8.611 -0.499 1
1 1374 . 1 1 1 A 121 121 LEU HA H 121 5.323 4.864 0.459 1
1 1384 . 1 1 1 A 121 121 LEU C C 121 175.733 174.570 1.163 1
1 1385 . 1 1 1 A 121 121 LEU CA C 121 52.716 52.903 -0.187 1
1 1386 . 1 1 1 A 121 121 LEU CB C 121 44.098 44.564 -0.466 1
1 1389 . 1 1 1 A 121 121 LEU N N 121 123.403 129.021 -5.618 1
1 1390 . 1 1 1 A 122 122 THR H H 122 8.338 9.067 -0.729 1
1 1391 . 1 1 1 A 122 122 THR HA H 122 5.097 4.679 0.418 1
1 1396 . 1 1 1 A 122 122 THR C C 122 173.221 173.896 -0.675 1
1 1397 . 1 1 1 A 122 122 THR CA C 122 60.306 60.778 -0.472 1
1 1398 . 1 1 1 A 122 122 THR CB C 122 72.473 72.114 0.359 1
1 1400 . 1 1 1 A 122 122 THR N N 122 109.081 121.394 -12.313 1
1 7 . 2 1 1 A 2 2 GLU H H 2 8.994 8.431 0.563 1
1 8 . 2 1 1 A 2 2 GLU HA H 2 4.278 4.027 0.251 1
1 13 . 2 1 1 A 2 2 GLU C C 2 175.315 177.999 -2.684 1
1 14 . 2 1 1 A 2 2 GLU CA C 2 57.318 59.095 -1.777 1
1 15 . 2 1 1 A 2 2 GLU CB C 2 29.221 29.015 0.206 1
1 17 . 2 1 1 A 2 2 GLU N N 2 122.259 121.017 1.242 1
1 18 . 2 1 1 A 3 3 ASP H H 3 8.048 8.554 -0.506 1
1 19 . 2 1 1 A 3 3 ASP HA H 3 4.580 4.650 -0.070 1
1 21 . 2 1 1 A 3 3 ASP C C 3 175.636 176.371 -0.735 1
1 22 . 2 1 1 A 3 3 ASP CA C 3 54.579 54.823 -0.244 1
1 23 . 2 1 1 A 3 3 ASP CB C 3 40.984 39.194 1.790 1
1 24 . 2 1 1 A 3 3 ASP N N 3 119.830 117.084 2.746 1
1 25 . 2 1 1 A 4 4 ALA H H 4 8.090 7.617 0.473 1
1 26 . 2 1 1 A 4 4 ALA HA H 4 4.216 4.153 0.063 1
1 30 . 2 1 1 A 4 4 ALA C C 4 177.157 177.809 -0.652 1
1 31 . 2 1 1 A 4 4 ALA CA C 4 53.620 52.719 0.901 1
1 32 . 2 1 1 A 4 4 ALA CB C 4 18.728 17.750 0.978 1
1 33 . 2 1 1 A 4 4 ALA N N 4 123.957 121.661 2.296 1
1 34 . 2 1 1 A 5 5 TRP H H 5 7.941 7.690 0.251 1
1 35 . 2 1 1 A 5 5 TRP HA H 5 4.559 4.384 0.175 1
1 39 . 2 1 1 A 5 5 TRP C C 5 176.072 178.298 -2.226 1
1 40 . 2 1 1 A 5 5 TRP CA C 5 57.744 60.117 -2.373 1
1 41 . 2 1 1 A 5 5 TRP CB C 5 28.906 29.245 -0.339 1
1 42 . 2 1 1 A 5 5 TRP N N 5 118.408 119.131 -0.723 1
1 44 . 2 1 1 A 6 6 MET H H 6 7.679 8.366 -0.687 1
1 45 . 2 1 1 A 6 6 MET HA H 6 3.785 4.488 -0.703 1
1 52 . 2 1 1 A 6 6 MET C C 6 175.174 177.471 -2.297 1
1 53 . 2 1 1 A 6 6 MET CA C 6 57.724 58.502 -0.778 1
1 54 . 2 1 1 A 6 6 MET CB C 6 31.640 33.580 -1.940 1
1 57 . 2 1 1 A 6 6 MET N N 6 121.538 117.986 3.552 1
1 58 . 2 1 1 A 7 7 GLY H H 7 7.247 7.487 -0.240 1
1 59 . 2 1 1 A 7 7 GLY HA2 H 7 3.455 4.190 -0.735 1
1 60 . 2 1 1 A 7 7 GLY HA3 H 7 3.578 4.214 -0.636 1
1 61 . 2 1 1 A 7 7 GLY C C 7 172.852 173.346 -0.494 1
1 62 . 2 1 1 A 7 7 GLY CA C 7 45.896 44.490 1.406 1
1 63 . 2 1 1 A 7 7 GLY N N 7 104.055 109.400 -5.345 1
1 64 . 2 1 1 A 8 8 THR H H 8 7.436 8.578 -1.142 1
1 65 . 2 1 1 A 8 8 THR HA H 8 4.428 4.350 0.078 1
1 70 . 2 1 1 A 8 8 THR C C 8 172.973 173.893 -0.920 1
1 71 . 2 1 1 A 8 8 THR CA C 8 60.751 62.138 -1.387 1
1 72 . 2 1 1 A 8 8 THR CB C 8 69.637 69.708 -0.071 1
1 74 . 2 1 1 A 8 8 THR N N 8 107.669 115.039 -7.370 1
1 75 . 2 1 1 A 9 9 HIS H H 9 8.048 7.989 0.059 1
1 76 . 2 1 1 A 9 9 HIS HA H 9 4.654 4.886 -0.232 1
1 79 . 2 1 1 A 9 9 HIS CA C 9 56.163 54.036 2.127 1
1 80 . 2 1 1 A 9 9 HIS CB C 9 32.619 31.144 1.475 1
1 81 . 2 1 1 A 9 9 HIS N N 9 127.281 118.511 8.770 1
1 82 . 2 1 1 A 10 10 PRO HA H 10 4.257 4.255 0.002 1
1 88 . 2 1 1 A 10 10 PRO C C 10 178.779 179.111 -0.332 1
1 89 . 2 1 1 A 10 10 PRO CA C 10 65.565 66.098 -0.533 1
1 90 . 2 1 1 A 10 10 PRO CB C 10 32.422 31.992 0.430 1
1 93 . 2 1 1 A 11 11 LYS H H 11 10.994 8.577 2.417 1
1 94 . 2 1 1 A 11 11 LYS HA H 11 4.282 4.206 0.076 1
1 100 . 2 1 1 A 11 11 LYS C C 11 177.279 178.709 -1.430 1
1 101 . 2 1 1 A 11 11 LYS CA C 11 56.859 59.202 -2.343 1
1 102 . 2 1 1 A 11 11 LYS CB C 11 31.279 32.617 -1.338 1
1 104 . 2 1 1 A 11 11 LYS N N 11 121.398 118.256 3.142 1
1 105 . 2 1 1 A 12 12 TYR H H 12 7.146 8.076 -0.930 1
1 106 . 2 1 1 A 12 12 TYR HA H 12 3.722 4.246 -0.524 1
1 113 . 2 1 1 A 12 12 TYR C C 12 176.265 177.463 -1.198 1
1 114 . 2 1 1 A 12 12 TYR CA C 12 61.189 61.286 -0.097 1
1 115 . 2 1 1 A 12 12 TYR CB C 12 37.796 38.199 -0.403 1
1 116 . 2 1 1 A 12 12 TYR N N 12 121.579 122.853 -1.274 1
1 117 . 2 1 1 A 13 13 LEU H H 13 7.778 8.731 -0.953 1
1 118 . 2 1 1 A 13 13 LEU HA H 13 3.773 4.001 -0.228 1
1 127 . 2 1 1 A 13 13 LEU C C 13 178.462 178.566 -0.104 1
1 128 . 2 1 1 A 13 13 LEU CA C 13 57.942 58.233 -0.291 1
1 129 . 2 1 1 A 13 13 LEU CB C 13 41.064 41.636 -0.572 1
1 132 . 2 1 1 A 13 13 LEU N N 13 117.518 120.923 -3.405 1
1 133 . 2 1 1 A 14 14 GLU H H 14 7.867 8.509 -0.642 1
1 134 . 2 1 1 A 14 14 GLU HA H 14 3.935 4.090 -0.155 1
1 139 . 2 1 1 A 14 14 GLU C C 14 178.326 178.755 -0.429 1
1 140 . 2 1 1 A 14 14 GLU CA C 14 59.368 59.717 -0.349 1
1 141 . 2 1 1 A 14 14 GLU CB C 14 30.147 29.205 0.942 1
1 143 . 2 1 1 A 14 14 GLU N N 14 119.135 118.969 0.166 1
1 144 . 2 1 1 A 15 15 MET H H 15 7.773 7.682 0.091 1
1 145 . 2 1 1 A 15 15 MET HA H 15 3.936 4.150 -0.214 1
1 152 . 2 1 1 A 15 15 MET C C 15 177.886 177.702 0.184 1
1 153 . 2 1 1 A 15 15 MET CA C 15 59.465 58.110 1.355 1
1 154 . 2 1 1 A 15 15 MET CB C 15 33.987 32.226 1.761 1
1 157 . 2 1 1 A 15 15 MET N N 15 117.884 119.221 -1.337 1
1 158 . 2 1 1 A 16 16 MET H H 16 8.145 8.058 0.087 1
1 159 . 2 1 1 A 16 16 MET HA H 16 4.159 4.151 0.008 1
1 166 . 2 1 1 A 16 16 MET C C 16 177.835 178.351 -0.516 1
1 167 . 2 1 1 A 16 16 MET CA C 16 57.397 57.768 -0.371 1
1 168 . 2 1 1 A 16 16 MET CB C 16 31.867 32.348 -0.481 1
1 171 . 2 1 1 A 16 16 MET N N 16 119.555 117.119 2.436 1
1 172 . 2 1 1 A 17 17 GLU H H 17 7.761 8.053 -0.292 1
1 173 . 2 1 1 A 17 17 GLU HA H 17 4.117 4.235 -0.118 1
1 176 . 2 1 1 A 17 17 GLU C C 17 175.994 176.695 -0.701 1
1 177 . 2 1 1 A 17 17 GLU CA C 17 57.392 58.454 -1.062 1
1 178 . 2 1 1 A 17 17 GLU CB C 17 29.432 29.851 -0.419 1
1 180 . 2 1 1 A 17 17 GLU N N 17 118.216 118.035 0.181 1
1 181 . 2 1 1 A 18 18 LEU H H 18 7.201 7.253 -0.052 1
1 182 . 2 1 1 A 18 18 LEU HA H 18 4.111 4.394 -0.283 1
1 191 . 2 1 1 A 18 18 LEU C C 18 175.781 176.379 -0.598 1
1 192 . 2 1 1 A 18 18 LEU CA C 18 56.366 54.393 1.973 1
1 193 . 2 1 1 A 18 18 LEU CB C 18 42.030 42.162 -0.132 1
1 196 . 2 1 1 A 18 18 LEU N N 18 117.448 117.045 0.403 1
1 197 . 2 1 1 A 19 19 ASP H H 19 7.789 9.025 -1.236 1
1 198 . 2 1 1 A 19 19 ASP HA H 19 4.360 4.221 0.139 1
1 201 . 2 1 1 A 19 19 ASP C C 19 173.765 175.523 -1.758 1
1 202 . 2 1 1 A 19 19 ASP CA C 19 54.851 55.959 -1.108 1
1 203 . 2 1 1 A 19 19 ASP CB C 19 39.115 39.072 0.043 1
1 204 . 2 1 1 A 19 19 ASP N N 19 115.844 118.090 -2.246 1
1 205 . 2 1 1 A 20 20 ILE H H 20 8.142 8.349 -0.207 1
1 206 . 2 1 1 A 20 20 ILE HA H 20 4.128 4.312 -0.184 1
1 216 . 2 1 1 A 20 20 ILE C C 20 174.710 176.700 -1.990 1
1 217 . 2 1 1 A 20 20 ILE CA C 20 60.465 62.496 -2.031 1
1 218 . 2 1 1 A 20 20 ILE CB C 20 40.407 40.074 0.333 1
1 222 . 2 1 1 A 20 20 ILE N N 20 117.287 116.362 0.925 1
1 223 . 2 1 1 A 21 21 GLY H H 21 8.207 8.046 0.161 1
1 224 . 2 1 1 A 21 21 GLY HA2 H 21 3.889 3.881 0.008 1
1 225 . 2 1 1 A 21 21 GLY HA3 H 21 3.924 3.896 0.028 1
1 226 . 2 1 1 A 21 21 GLY C C 21 172.162 174.447 -2.285 1
1 227 . 2 1 1 A 21 21 GLY CA C 21 45.017 46.629 -1.612 1
1 228 . 2 1 1 A 21 21 GLY N N 21 110.656 110.138 0.518 1
1 229 . 2 1 1 A 22 22 ASP H H 22 7.727 8.044 -0.317 1
1 230 . 2 1 1 A 22 22 ASP HA H 22 4.794 4.845 -0.051 1
1 233 . 2 1 1 A 22 22 ASP C C 22 174.884 176.695 -1.811 1
1 234 . 2 1 1 A 22 22 ASP CA C 22 52.471 53.717 -1.246 1
1 235 . 2 1 1 A 22 22 ASP CB C 22 42.069 42.114 -0.045 1
1 236 . 2 1 1 A 22 22 ASP N N 22 119.305 119.732 -0.427 1
1 237 . 2 1 1 A 23 23 ALA H H 23 8.644 8.989 -0.345 1
1 238 . 2 1 1 A 23 23 ALA HA H 23 4.120 3.995 0.125 1
1 242 . 2 1 1 A 23 23 ALA C C 23 179.546 179.855 -0.309 1
1 243 . 2 1 1 A 23 23 ALA CA C 23 55.609 55.675 -0.066 1
1 244 . 2 1 1 A 23 23 ALA CB C 23 18.573 18.356 0.217 1
1 245 . 2 1 1 A 23 23 ALA N N 23 122.468 129.493 -7.025 1
1 246 . 2 1 1 A 24 24 THR H H 24 8.238 7.465 0.773 1
1 247 . 2 1 1 A 24 24 THR HA H 24 4.184 4.083 0.101 1
1 252 . 2 1 1 A 24 24 THR C C 24 174.841 176.823 -1.982 1
1 253 . 2 1 1 A 24 24 THR CA C 24 66.241 66.581 -0.340 1
1 254 . 2 1 1 A 24 24 THR CB C 24 68.376 68.467 -0.091 1
1 256 . 2 1 1 A 24 24 THR N N 24 114.824 113.578 1.246 1
1 257 . 2 1 1 A 25 25 GLN H H 25 8.037 8.386 -0.349 1
1 258 . 2 1 1 A 25 25 GLN HA H 25 4.095 4.033 0.062 1
1 265 . 2 1 1 A 25 25 GLN C C 25 177.603 178.644 -1.041 1
1 266 . 2 1 1 A 25 25 GLN CA C 25 59.261 58.792 0.469 1
1 267 . 2 1 1 A 25 25 GLN CB C 25 28.437 28.295 0.142 1
1 269 . 2 1 1 A 25 25 GLN N N 25 122.518 120.132 2.386 1
1 271 . 2 1 1 A 26 26 VAL H H 26 7.994 8.899 -0.905 1
1 272 . 2 1 1 A 26 26 VAL HA H 26 3.469 3.779 -0.310 1
1 280 . 2 1 1 A 26 26 VAL C C 26 175.552 178.362 -2.810 1
1 281 . 2 1 1 A 26 26 VAL CA C 26 66.909 66.268 0.641 1
1 282 . 2 1 1 A 26 26 VAL CB C 26 31.582 31.427 0.155 1
1 285 . 2 1 1 A 26 26 VAL N N 26 119.112 120.929 -1.817 1
1 286 . 2 1 1 A 27 27 TYR H H 27 8.003 8.441 -0.438 1
1 287 . 2 1 1 A 27 27 TYR HA H 27 4.357 4.541 -0.184 1
1 294 . 2 1 1 A 27 27 TYR C C 27 175.856 177.091 -1.235 1
1 295 . 2 1 1 A 27 27 TYR CA C 27 62.197 61.749 0.448 1
1 296 . 2 1 1 A 27 27 TYR CB C 27 38.394 38.877 -0.483 1
1 297 . 2 1 1 A 27 27 TYR N N 27 119.170 120.944 -1.774 1
1 298 . 2 1 1 A 28 28 VAL H H 28 8.087 8.312 -0.225 1
1 299 . 2 1 1 A 28 28 VAL HA H 28 3.652 3.460 0.192 1
1 307 . 2 1 1 A 28 28 VAL C C 28 176.134 178.085 -1.951 1
1 308 . 2 1 1 A 28 28 VAL CA C 28 66.247 66.270 -0.023 1
1 309 . 2 1 1 A 28 28 VAL CB C 28 31.241 31.274 -0.033 1
1 312 . 2 1 1 A 28 28 VAL N N 28 113.112 119.355 -6.243 1
1 313 . 2 1 1 A 29 29 ALA H H 29 7.853 8.772 -0.919 1
1 314 . 2 1 1 A 29 29 ALA HA H 29 3.913 4.104 -0.191 1
1 318 . 2 1 1 A 29 29 ALA C C 29 177.850 179.245 -1.395 1
1 319 . 2 1 1 A 29 29 ALA CA C 29 55.274 54.829 0.445 1
1 320 . 2 1 1 A 29 29 ALA CB C 29 17.876 18.405 -0.529 1
1 321 . 2 1 1 A 29 29 ALA N N 29 121.350 122.769 -1.419 1
1 322 . 2 1 1 A 30 30 PHE H H 30 8.724 8.477 0.247 1
1 323 . 2 1 1 A 30 30 PHE HA H 30 4.098 4.325 -0.227 1
1 327 . 2 1 1 A 30 30 PHE C C 30 175.035 177.027 -1.992 1
1 328 . 2 1 1 A 30 30 PHE CA C 30 61.264 61.692 -0.428 1
1 329 . 2 1 1 A 30 30 PHE CB C 30 38.926 39.459 -0.533 1
1 330 . 2 1 1 A 30 30 PHE N N 30 120.478 120.339 0.139 1
1 331 . 2 1 1 A 31 31 LEU H H 31 8.146 7.933 0.213 1
1 332 . 2 1 1 A 31 31 LEU HA H 31 3.597 3.687 -0.090 1
1 341 . 2 1 1 A 31 31 LEU C C 31 179.508 179.208 0.300 1
1 342 . 2 1 1 A 31 31 LEU CA C 31 57.884 58.020 -0.136 1
1 343 . 2 1 1 A 31 31 LEU CB C 31 41.829 41.974 -0.145 1
1 346 . 2 1 1 A 31 31 LEU N N 31 118.427 120.676 -2.249 1
1 347 . 2 1 1 A 32 32 VAL H H 32 7.627 7.701 -0.074 1
1 348 . 2 1 1 A 32 32 VAL HA H 32 3.464 3.884 -0.420 1
1 356 . 2 1 1 A 32 32 VAL C C 32 174.956 177.771 -2.815 1
1 357 . 2 1 1 A 32 32 VAL CA C 32 66.373 65.723 0.650 1
1 358 . 2 1 1 A 32 32 VAL CB C 32 31.121 31.538 -0.417 1
1 361 . 2 1 1 A 32 32 VAL N N 32 119.497 114.701 4.796 1
1 362 . 2 1 1 A 33 33 TYR H H 33 8.366 8.769 -0.403 1
1 363 . 2 1 1 A 33 33 TYR HA H 33 3.485 4.084 -0.599 1
1 370 . 2 1 1 A 33 33 TYR C C 33 174.883 177.049 -2.166 1
1 371 . 2 1 1 A 33 33 TYR CA C 33 62.866 61.449 1.417 1
1 372 . 2 1 1 A 33 33 TYR CB C 33 37.778 38.369 -0.591 1
1 373 . 2 1 1 A 33 33 TYR N N 33 121.842 124.283 -2.441 1
1 374 . 2 1 1 A 34 34 LEU H H 34 8.000 8.474 -0.474 1
1 375 . 2 1 1 A 34 34 LEU HA H 34 3.495 3.587 -0.092 1
1 385 . 2 1 1 A 34 34 LEU C C 34 178.240 179.017 -0.777 1
1 386 . 2 1 1 A 34 34 LEU CA C 34 57.453 57.091 0.362 1
1 387 . 2 1 1 A 34 34 LEU CB C 34 41.828 40.752 1.076 1
1 390 . 2 1 1 A 34 34 LEU N N 34 116.692 119.230 -2.538 1
1 391 . 2 1 1 A 35 35 ASP H H 35 7.688 7.927 -0.239 1
1 392 . 2 1 1 A 35 35 ASP HA H 35 4.302 4.327 -0.025 1
1 395 . 2 1 1 A 35 35 ASP C C 35 177.507 178.405 -0.898 1
1 396 . 2 1 1 A 35 35 ASP CA C 35 58.196 57.563 0.633 1
1 397 . 2 1 1 A 35 35 ASP CB C 35 43.070 41.097 1.973 1
1 398 . 2 1 1 A 35 35 ASP N N 35 120.507 119.977 0.530 1
1 399 . 2 1 1 A 36 36 LEU H H 36 8.482 8.611 -0.129 1
1 400 . 2 1 1 A 36 36 LEU HA H 36 3.328 3.754 -0.426 1
1 410 . 2 1 1 A 36 36 LEU C C 36 176.774 179.260 -2.486 1
1 411 . 2 1 1 A 36 36 LEU CA C 36 57.461 57.901 -0.440 1
1 412 . 2 1 1 A 36 36 LEU CB C 36 41.344 41.639 -0.295 1
1 416 . 2 1 1 A 36 36 LEU N N 36 117.671 120.279 -2.608 1
1 417 . 2 1 1 A 37 37 MET H H 37 7.822 7.887 -0.065 1
1 418 . 2 1 1 A 37 37 MET HA H 37 4.401 4.134 0.267 1
1 425 . 2 1 1 A 37 37 MET C C 37 177.862 178.031 -0.169 1
1 426 . 2 1 1 A 37 37 MET CA C 37 56.434 57.805 -1.371 1
1 427 . 2 1 1 A 37 37 MET CB C 37 31.573 32.172 -0.599 1
1 430 . 2 1 1 A 37 37 MET N N 37 112.952 118.540 -5.588 1
1 431 . 2 1 1 A 38 38 GLU H H 38 8.667 7.909 0.758 1
1 432 . 2 1 1 A 38 38 GLU HA H 38 4.457 4.170 0.287 1
1 436 . 2 1 1 A 38 38 GLU C C 38 176.582 177.006 -0.424 1
1 437 . 2 1 1 A 38 38 GLU CA C 38 57.659 57.979 -0.320 1
1 438 . 2 1 1 A 38 38 GLU CB C 38 29.936 30.430 -0.494 1
1 440 . 2 1 1 A 38 38 GLU N N 38 116.463 118.645 -2.182 1
1 441 . 2 1 1 A 39 39 SER H H 39 7.657 8.175 -0.518 1
1 442 . 2 1 1 A 39 39 SER HA H 39 4.658 4.448 0.210 1
1 445 . 2 1 1 A 39 39 SER C C 39 175.661 175.220 0.441 1
1 446 . 2 1 1 A 39 39 SER CA C 39 60.449 60.505 -0.056 1
1 447 . 2 1 1 A 39 39 SER CB C 39 63.341 64.416 -1.075 1
1 448 . 2 1 1 A 39 39 SER N N 39 113.870 113.481 0.389 1
1 449 . 2 1 1 A 40 40 LYS H H 40 8.165 7.562 0.603 1
1 450 . 2 1 1 A 40 40 LYS HA H 40 4.454 3.804 0.650 1
1 458 . 2 1 1 A 40 40 LYS C C 40 174.970 175.385 -0.415 1
1 459 . 2 1 1 A 40 40 LYS CA C 40 55.753 55.986 -0.233 1
1 460 . 2 1 1 A 40 40 LYS CB C 40 32.337 32.178 0.159 1
1 464 . 2 1 1 A 40 40 LYS N N 40 116.671 120.434 -3.763 1
1 465 . 2 1 1 A 41 41 SER H H 41 7.017 7.784 -0.767 1
1 466 . 2 1 1 A 41 41 SER HA H 41 4.209 4.143 0.066 1
1 469 . 2 1 1 A 41 41 SER C C 41 173.770 173.418 0.352 1
1 470 . 2 1 1 A 41 41 SER CA C 41 58.435 59.141 -0.706 1
1 471 . 2 1 1 A 41 41 SER CB C 41 61.700 60.782 0.918 1
1 472 . 2 1 1 A 41 41 SER N N 41 109.989 112.374 -2.385 1
1 473 . 2 1 1 A 42 42 TRP H H 42 8.876 7.515 1.361 1
1 474 . 2 1 1 A 42 42 TRP HA H 42 4.698 4.487 0.211 1
1 478 . 2 1 1 A 42 42 TRP C C 42 174.477 177.177 -2.700 1
1 479 . 2 1 1 A 42 42 TRP CA C 42 59.443 57.690 1.753 1
1 480 . 2 1 1 A 42 42 TRP CB C 42 28.203 29.605 -1.402 1
1 481 . 2 1 1 A 42 42 TRP N N 42 121.116 121.002 0.114 1
1 483 . 2 1 1 A 43 43 HIS H H 43 8.132 8.623 -0.491 1
1 484 . 2 1 1 A 43 43 HIS HA H 43 4.445 4.463 -0.018 1
1 488 . 2 1 1 A 43 43 HIS C C 43 174.405 174.587 -0.182 1
1 489 . 2 1 1 A 43 43 HIS CA C 43 58.556 59.273 -0.717 1
1 490 . 2 1 1 A 43 43 HIS CB C 43 29.430 30.847 -1.417 1
1 491 . 2 1 1 A 43 43 HIS N N 43 119.397 122.570 -3.173 1
1 492 . 2 1 1 A 44 44 GLU H H 44 8.140 7.576 0.564 1
1 493 . 2 1 1 A 44 44 GLU HA H 44 4.432 4.705 -0.273 1
1 497 . 2 1 1 A 44 44 GLU C C 44 173.010 174.424 -1.414 1
1 498 . 2 1 1 A 44 44 GLU CA C 44 56.421 55.268 1.153 1
1 499 . 2 1 1 A 44 44 GLU CB C 44 33.285 32.352 0.933 1
1 501 . 2 1 1 A 44 44 GLU N N 44 116.181 116.327 -0.146 1
1 502 . 2 1 1 A 45 45 VAL H H 45 8.428 8.714 -0.286 1
1 503 . 2 1 1 A 45 45 VAL HA H 45 4.492 4.883 -0.391 1
1 511 . 2 1 1 A 45 45 VAL C C 45 172.339 173.329 -0.990 1
1 512 . 2 1 1 A 45 45 VAL CA C 45 63.071 60.042 3.029 1
1 513 . 2 1 1 A 45 45 VAL CB C 45 35.145 35.392 -0.247 1
1 516 . 2 1 1 A 45 45 VAL N N 45 123.272 122.190 1.082 1
1 517 . 2 1 1 A 46 46 ASN H H 46 9.050 8.710 0.340 1
1 518 . 2 1 1 A 46 46 ASN HA H 46 5.261 5.329 -0.068 1
1 523 . 2 1 1 A 46 46 ASN C C 46 172.845 173.394 -0.549 1
1 524 . 2 1 1 A 46 46 ASN CA C 46 51.895 51.634 0.261 1
1 525 . 2 1 1 A 46 46 ASN CB C 46 42.322 42.809 -0.487 1
1 526 . 2 1 1 A 46 46 ASN N N 46 123.901 125.343 -1.442 1
1 528 . 2 1 1 A 47 47 CYS H H 47 9.039 8.563 0.476 1
1 529 . 2 1 1 A 47 47 CYS HA H 47 5.160 5.198 -0.038 1
1 532 . 2 1 1 A 47 47 CYS C C 47 172.454 173.910 -1.456 1
1 533 . 2 1 1 A 47 47 CYS CA C 47 56.473 56.998 -0.525 1
1 534 . 2 1 1 A 47 47 CYS CB C 47 29.297 28.871 0.426 1
1 535 . 2 1 1 A 47 47 CYS N N 47 119.663 119.423 0.240 1
1 536 . 2 1 1 A 48 48 VAL H H 48 9.083 9.106 -0.023 1
1 537 . 2 1 1 A 48 48 VAL HA H 48 4.344 4.708 -0.364 1
1 542 . 2 1 1 A 48 48 VAL C C 48 173.307 174.750 -1.443 1
1 543 . 2 1 1 A 48 48 VAL CA C 48 61.368 60.680 0.688 1
1 544 . 2 1 1 A 48 48 VAL CB C 48 35.345 35.696 -0.351 1
1 546 . 2 1 1 A 48 48 VAL N N 48 124.672 125.380 -0.708 1
1 547 . 2 1 1 A 49 49 GLY H H 49 9.019 9.060 -0.041 1
1 548 . 2 1 1 A 49 49 GLY HA2 H 49 3.460 4.186 -0.726 1
1 549 . 2 1 1 A 49 49 GLY HA3 H 49 4.539 4.187 0.352 1
1 550 . 2 1 1 A 49 49 GLY C C 49 171.278 172.076 -0.798 1
1 551 . 2 1 1 A 49 49 GLY CA C 49 45.075 44.537 0.538 1
1 552 . 2 1 1 A 49 49 GLY N N 49 113.131 115.402 -2.271 1
1 553 . 2 1 1 A 50 50 LEU H H 50 8.747 9.411 -0.664 1
1 554 . 2 1 1 A 50 50 LEU HA H 50 5.102 4.942 0.160 1
1 564 . 2 1 1 A 50 50 LEU CA C 50 51.417 51.291 0.126 1
1 565 . 2 1 1 A 50 50 LEU CB C 50 41.754 43.038 -1.284 1
1 569 . 2 1 1 A 50 50 LEU N N 50 124.471 126.630 -2.159 1
1 570 . 2 1 1 A 51 51 PRO HA H 51 4.106 4.289 -0.183 1
1 577 . 2 1 1 A 51 51 PRO C C 51 178.422 177.582 0.840 1
1 578 . 2 1 1 A 51 51 PRO CA C 51 65.680 64.673 1.007 1
1 579 . 2 1 1 A 51 51 PRO CB C 51 31.939 32.143 -0.204 1
1 582 . 2 1 1 A 52 52 GLU H H 52 9.721 8.390 1.331 1
1 583 . 2 1 1 A 52 52 GLU HA H 52 4.176 4.102 0.074 1
1 588 . 2 1 1 A 52 52 GLU C C 52 176.146 177.898 -1.752 1
1 589 . 2 1 1 A 52 52 GLU CA C 52 59.158 59.420 -0.262 1
1 590 . 2 1 1 A 52 52 GLU CB C 52 28.442 29.572 -1.130 1
1 592 . 2 1 1 A 52 52 GLU N N 52 118.552 118.182 0.370 1
1 593 . 2 1 1 A 53 53 LEU H H 53 7.089 7.432 -0.343 1
1 594 . 2 1 1 A 53 53 LEU HA H 53 4.511 4.371 0.140 1
1 603 . 2 1 1 A 53 53 LEU C C 53 174.027 176.475 -2.448 1
1 604 . 2 1 1 A 53 53 LEU CA C 53 53.825 54.452 -0.627 1
1 605 . 2 1 1 A 53 53 LEU CB C 53 43.825 42.220 1.605 1
1 608 . 2 1 1 A 53 53 LEU N N 53 116.763 118.187 -1.424 1
1 609 . 2 1 1 A 54 54 GLN H H 54 7.964 7.812 0.152 1
1 610 . 2 1 1 A 54 54 GLN HA H 54 3.591 3.882 -0.291 1
1 616 . 2 1 1 A 54 54 GLN C C 54 172.604 174.494 -1.890 1
1 617 . 2 1 1 A 54 54 GLN CA C 54 56.961 57.240 -0.279 1
1 618 . 2 1 1 A 54 54 GLN CB C 54 26.545 27.895 -1.350 1
1 620 . 2 1 1 A 54 54 GLN N N 54 115.489 118.598 -3.109 1
1 622 . 2 1 1 A 55 55 LEU H H 55 7.139 7.521 -0.382 1
1 623 . 2 1 1 A 55 55 LEU HA H 55 4.750 4.977 -0.227 1
1 629 . 2 1 1 A 55 55 LEU C C 55 173.475 175.666 -2.191 1
1 630 . 2 1 1 A 55 55 LEU CA C 55 53.698 52.431 1.267 1
1 631 . 2 1 1 A 55 55 LEU CB C 55 47.859 45.609 2.250 1
1 633 . 2 1 1 A 55 55 LEU N N 55 116.422 114.857 1.565 1
1 634 . 2 1 1 A 56 56 ILE H H 56 8.223 8.398 -0.175 1
1 635 . 2 1 1 A 56 56 ILE HA H 56 4.540 5.360 -0.820 1
1 643 . 2 1 1 A 56 56 ILE C C 56 173.938 174.350 -0.412 1
1 644 . 2 1 1 A 56 56 ILE CA C 56 61.020 59.584 1.436 1
1 645 . 2 1 1 A 56 56 ILE CB C 56 39.403 40.864 -1.461 1
1 648 . 2 1 1 A 56 56 ILE N N 56 122.792 119.362 3.430 1
1 649 . 2 1 1 A 57 57 CYS H H 57 8.995 9.262 -0.267 1
1 650 . 2 1 1 A 57 57 CYS HA H 57 5.036 5.159 -0.123 1
1 653 . 2 1 1 A 57 57 CYS C C 57 170.483 172.775 -2.292 1
1 654 . 2 1 1 A 57 57 CYS CA C 57 56.484 56.694 -0.210 1
1 655 . 2 1 1 A 57 57 CYS CB C 57 30.545 31.445 -0.900 1
1 656 . 2 1 1 A 57 57 CYS N N 57 121.575 122.929 -1.354 1
1 657 . 2 1 1 A 58 58 LEU H H 58 9.076 8.836 0.240 1
1 658 . 2 1 1 A 58 58 LEU HA H 58 5.472 5.599 -0.127 1
1 668 . 2 1 1 A 58 58 LEU C C 58 174.009 176.080 -2.071 1
1 669 . 2 1 1 A 58 58 LEU CA C 58 52.851 53.776 -0.925 1
1 670 . 2 1 1 A 58 58 LEU CB C 58 42.177 42.784 -0.607 1
1 674 . 2 1 1 A 58 58 LEU N N 58 121.895 122.586 -0.691 1
1 675 . 2 1 1 A 59 59 VAL H H 59 8.966 8.604 0.362 1
1 676 . 2 1 1 A 59 59 VAL HA H 59 5.488 5.044 0.444 1
1 681 . 2 1 1 A 59 59 VAL C C 59 176.034 175.752 0.282 1
1 682 . 2 1 1 A 59 59 VAL CA C 59 59.820 60.707 -0.887 1
1 683 . 2 1 1 A 59 59 VAL CB C 59 34.786 34.904 -0.118 1
1 685 . 2 1 1 A 59 59 VAL N N 59 121.702 124.189 -2.487 1
1 686 . 2 1 1 A 60 60 GLY H H 60 9.258 8.342 0.916 1
1 687 . 2 1 1 A 60 60 GLY HA2 H 60 4.673 4.354 0.319 1
1 688 . 2 1 1 A 60 60 GLY HA3 H 60 4.804 4.366 0.438 1
1 689 . 2 1 1 A 60 60 GLY C C 60 169.831 171.559 -1.728 1
1 690 . 2 1 1 A 60 60 GLY CA C 60 46.399 46.141 0.258 1
1 691 . 2 1 1 A 60 60 GLY N N 60 114.126 112.749 1.377 1
1 692 . 2 1 1 A 61 61 THR H H 61 8.834 8.579 0.255 1
1 693 . 2 1 1 A 61 61 THR HA H 61 4.418 4.831 -0.413 1
1 698 . 2 1 1 A 61 61 THR C C 61 171.985 174.300 -2.315 1
1 699 . 2 1 1 A 61 61 THR CA C 61 60.634 61.206 -0.572 1
1 700 . 2 1 1 A 61 61 THR CB C 61 70.983 70.246 0.737 1
1 702 . 2 1 1 A 61 61 THR N N 61 114.856 116.292 -1.436 1
1 703 . 2 1 1 A 62 62 GLU H H 62 8.502 8.678 -0.176 1
1 704 . 2 1 1 A 62 62 GLU HA H 62 2.867 3.422 -0.555 1
1 709 . 2 1 1 A 62 62 GLU C C 62 174.650 176.891 -2.241 1
1 710 . 2 1 1 A 62 62 GLU CA C 62 58.785 58.890 -0.105 1
1 711 . 2 1 1 A 62 62 GLU CB C 62 28.981 29.511 -0.530 1
1 713 . 2 1 1 A 62 62 GLU N N 62 129.915 126.052 3.863 1
1 714 . 2 1 1 A 63 63 ILE H H 63 6.928 7.840 -0.912 1
1 715 . 2 1 1 A 63 63 ILE HA H 63 4.038 4.558 -0.520 1
1 725 . 2 1 1 A 63 63 ILE C C 63 173.482 175.361 -1.879 1
1 726 . 2 1 1 A 63 63 ILE CA C 63 58.664 59.980 -1.316 1
1 727 . 2 1 1 A 63 63 ILE CB C 63 40.009 41.434 -1.425 1
1 731 . 2 1 1 A 63 63 ILE N N 63 117.075 119.182 -2.107 1
1 732 . 2 1 1 A 64 64 GLU H H 64 8.585 8.711 -0.126 1
1 733 . 2 1 1 A 64 64 GLU HA H 64 3.427 3.757 -0.330 1
1 738 . 2 1 1 A 64 64 GLU C C 64 175.186 177.306 -2.120 1
1 739 . 2 1 1 A 64 64 GLU CA C 64 58.703 58.848 -0.145 1
1 740 . 2 1 1 A 64 64 GLU CB C 64 28.999 29.351 -0.352 1
1 742 . 2 1 1 A 64 64 GLU N N 64 126.422 126.896 -0.474 1
1 743 . 2 1 1 A 65 65 GLY H H 65 8.754 8.839 -0.085 1
1 744 . 2 1 1 A 65 65 GLY HA2 H 65 3.631 3.968 -0.337 1
1 745 . 2 1 1 A 65 65 GLY HA3 H 65 4.287 3.973 0.314 1
1 746 . 2 1 1 A 65 65 GLY C C 65 174.005 174.824 -0.819 1
1 747 . 2 1 1 A 65 65 GLY CA C 65 44.954 45.056 -0.102 1
1 748 . 2 1 1 A 65 65 GLY N N 65 114.614 112.590 2.024 1
1 749 . 2 1 1 A 66 66 GLU H H 66 7.760 8.093 -0.333 1
1 750 . 2 1 1 A 66 66 GLU HA H 66 4.462 4.727 -0.265 1
1 754 . 2 1 1 A 66 66 GLU C C 66 175.255 176.067 -0.812 1
1 755 . 2 1 1 A 66 66 GLU CA C 66 55.582 55.623 -0.041 1
1 756 . 2 1 1 A 66 66 GLU CB C 66 30.654 31.583 -0.929 1
1 758 . 2 1 1 A 66 66 GLU N N 66 119.292 120.423 -1.131 1
1 759 . 2 1 1 A 67 67 GLY H H 67 8.262 8.034 0.228 1
1 760 . 2 1 1 A 67 67 GLY HA2 H 67 3.875 4.119 -0.244 1
1 761 . 2 1 1 A 67 67 GLY HA3 H 67 4.088 4.139 -0.051 1
1 762 . 2 1 1 A 67 67 GLY C C 67 172.197 173.879 -1.682 1
1 763 . 2 1 1 A 67 67 GLY CA C 67 44.845 45.291 -0.446 1
1 764 . 2 1 1 A 67 67 GLY N N 67 106.161 108.966 -2.805 1
1 765 . 2 1 1 A 68 68 LEU H H 68 8.142 8.026 0.116 1
1 766 . 2 1 1 A 68 68 LEU HA H 68 4.491 4.763 -0.272 1
1 775 . 2 1 1 A 68 68 LEU C C 68 176.194 174.812 1.382 1
1 776 . 2 1 1 A 68 68 LEU CA C 68 55.123 54.209 0.914 1
1 777 . 2 1 1 A 68 68 LEU CB C 68 44.527 42.336 2.191 1
1 780 . 2 1 1 A 68 68 LEU N N 68 120.269 121.299 -1.030 1
1 781 . 2 1 1 A 69 69 GLN H H 69 9.253 8.207 1.046 1
1 782 . 2 1 1 A 69 69 GLN HA H 69 4.770 4.682 0.088 1
1 788 . 2 1 1 A 69 69 GLN C C 69 173.607 173.862 -0.255 1
1 789 . 2 1 1 A 69 69 GLN CA C 69 54.736 56.013 -1.277 1
1 790 . 2 1 1 A 69 69 GLN CB C 69 33.782 31.715 2.067 1
1 792 . 2 1 1 A 69 69 GLN N N 69 119.336 124.670 -5.334 1
1 794 . 2 1 1 A 70 70 THR H H 70 8.803 8.993 -0.190 1
1 795 . 2 1 1 A 70 70 THR HA H 70 5.033 5.025 0.008 1
1 800 . 2 1 1 A 70 70 THR C C 70 172.596 173.562 -0.966 1
1 801 . 2 1 1 A 70 70 THR CA C 70 62.768 61.987 0.781 1
1 802 . 2 1 1 A 70 70 THR CB C 70 69.990 70.455 -0.465 1
1 804 . 2 1 1 A 70 70 THR N N 70 118.372 121.657 -3.285 1
1 805 . 2 1 1 A 71 71 VAL H H 71 9.882 9.531 0.351 1
1 806 . 2 1 1 A 71 71 VAL HA H 71 5.239 5.288 -0.049 1
1 811 . 2 1 1 A 71 71 VAL C C 71 174.015 174.477 -0.462 1
1 812 . 2 1 1 A 71 71 VAL CA C 71 60.577 61.112 -0.535 1
1 813 . 2 1 1 A 71 71 VAL CB C 71 34.149 33.634 0.515 1
1 815 . 2 1 1 A 71 71 VAL N N 71 129.063 127.836 1.227 1
1 816 . 2 1 1 A 72 72 VAL H H 72 9.491 8.786 0.705 1
1 817 . 2 1 1 A 72 72 VAL HA H 72 4.672 4.757 -0.085 1
1 825 . 2 1 1 A 72 72 VAL CA C 72 59.568 57.967 1.601 1
1 826 . 2 1 1 A 72 72 VAL CB C 72 34.057 34.954 -0.897 1
1 829 . 2 1 1 A 72 72 VAL N N 72 128.521 125.990 2.531 1
1 830 . 2 1 1 A 73 73 PRO HA H 73 5.368 4.548 0.820 1
1 836 . 2 1 1 A 73 73 PRO C C 73 175.079 176.007 -0.928 1
1 837 . 2 1 1 A 73 73 PRO CA C 73 61.324 63.078 -1.754 1
1 838 . 2 1 1 A 73 73 PRO CB C 73 33.089 32.080 1.009 1
1 841 . 2 1 1 A 74 74 THR H H 74 9.103 8.770 0.333 1
1 842 . 2 1 1 A 74 74 THR HA H 74 5.191 4.854 0.337 1
1 847 . 2 1 1 A 74 74 THR CA C 74 57.986 59.183 -1.197 1
1 848 . 2 1 1 A 74 74 THR CB C 74 72.212 72.125 0.087 1
1 850 . 2 1 1 A 74 74 THR N N 74 118.075 118.520 -0.445 1
1 851 . 2 1 1 A 75 75 PRO HA H 75 5.015 4.613 0.402 1
1 858 . 2 1 1 A 75 75 PRO C C 75 178.704 177.706 0.998 1
1 859 . 2 1 1 A 75 75 PRO CA C 75 63.038 62.695 0.343 1
1 860 . 2 1 1 A 75 75 PRO CB C 75 32.529 32.739 -0.210 1
1 863 . 2 1 1 A 76 76 ILE H H 76 8.221 9.000 -0.779 1
1 864 . 2 1 1 A 76 76 ILE HA H 76 4.218 3.996 0.222 1
1 873 . 2 1 1 A 76 76 ILE C C 76 172.375 176.903 -4.528 1
1 874 . 2 1 1 A 76 76 ILE CA C 76 63.509 63.277 0.232 1
1 875 . 2 1 1 A 76 76 ILE CB C 76 39.322 38.101 1.221 1
1 879 . 2 1 1 A 76 76 ILE N N 76 122.273 123.521 -1.248 1
1 880 . 2 1 1 A 77 77 THR H H 77 6.984 7.754 -0.770 1
1 881 . 2 1 1 A 77 77 THR HA H 77 4.227 4.462 -0.235 1
1 886 . 2 1 1 A 77 77 THR C C 77 173.531 173.946 -0.415 1
1 887 . 2 1 1 A 77 77 THR CA C 77 61.435 61.553 -0.118 1
1 888 . 2 1 1 A 77 77 THR CB C 77 68.944 69.474 -0.530 1
1 890 . 2 1 1 A 77 77 THR N N 77 105.803 114.755 -8.952 1
1 891 . 2 1 1 A 78 78 ALA H H 78 7.647 7.543 0.104 1
1 892 . 2 1 1 A 78 78 ALA HA H 78 4.757 4.356 0.401 1
1 896 . 2 1 1 A 78 78 ALA C C 78 173.520 176.888 -3.368 1
1 897 . 2 1 1 A 78 78 ALA CA C 78 51.164 51.870 -0.706 1
1 898 . 2 1 1 A 78 78 ALA CB C 78 20.011 20.688 -0.677 1
1 899 . 2 1 1 A 78 78 ALA N N 78 126.635 124.202 2.433 1
1 900 . 2 1 1 A 79 79 SER H H 79 7.884 8.555 -0.671 1
1 901 . 2 1 1 A 79 79 SER HA H 79 4.386 5.250 -0.864 1
1 903 . 2 1 1 A 79 79 SER C C 79 176.077 173.013 3.064 1
1 904 . 2 1 1 A 79 79 SER CA C 79 57.465 56.633 0.832 1
1 905 . 2 1 1 A 79 79 SER CB C 79 65.285 64.447 0.838 1
1 906 . 2 1 1 A 79 79 SER N N 79 115.272 113.093 2.179 1
1 907 . 2 1 1 A 80 80 LEU H H 80 7.700 8.873 -1.173 1
1 908 . 2 1 1 A 80 80 LEU HA H 80 4.912 4.919 -0.007 1
1 915 . 2 1 1 A 80 80 LEU C C 80 173.927 175.206 -1.279 1
1 916 . 2 1 1 A 80 80 LEU CA C 80 53.829 54.379 -0.550 1
1 917 . 2 1 1 A 80 80 LEU CB C 80 45.990 43.872 2.118 1
1 920 . 2 1 1 A 80 80 LEU N N 80 121.507 127.625 -6.118 1
1 921 . 2 1 1 A 81 81 SER H H 81 7.885 8.890 -1.005 1
1 922 . 2 1 1 A 81 81 SER HA H 81 5.269 4.818 0.451 1
1 925 . 2 1 1 A 81 81 SER C C 81 175.756 174.869 0.887 1
1 926 . 2 1 1 A 81 81 SER CA C 81 55.507 57.128 -1.621 1
1 927 . 2 1 1 A 81 81 SER CB C 81 65.966 65.841 0.125 1
1 928 . 2 1 1 A 81 81 SER N N 81 118.323 118.514 -0.191 1
1 929 . 2 1 1 A 82 82 HIS H H 82 8.935 8.718 0.217 1
1 930 . 2 1 1 A 82 82 HIS HA H 82 4.407 4.421 -0.014 1
1 932 . 2 1 1 A 82 82 HIS C C 82 176.550 177.020 -0.470 1
1 933 . 2 1 1 A 82 82 HIS CA C 82 60.960 58.635 2.325 1
1 934 . 2 1 1 A 82 82 HIS CB C 82 30.755 29.144 1.611 1
1 935 . 2 1 1 A 82 82 HIS N N 82 124.042 119.178 4.864 1
1 936 . 2 1 1 A 83 83 ASN H H 83 8.435 8.339 0.096 1
1 937 . 2 1 1 A 83 83 ASN HA H 83 4.439 4.369 0.070 1
1 941 . 2 1 1 A 83 83 ASN C C 83 174.769 177.483 -2.714 1
1 942 . 2 1 1 A 83 83 ASN CA C 83 56.575 56.740 -0.165 1
1 943 . 2 1 1 A 83 83 ASN CB C 83 38.731 39.136 -0.405 1
1 944 . 2 1 1 A 83 83 ASN N N 83 118.543 119.499 -0.956 1
1 946 . 2 1 1 A 84 84 ARG H H 84 7.716 8.139 -0.423 1
1 947 . 2 1 1 A 84 84 ARG HA H 84 4.183 4.126 0.057 1
1 953 . 2 1 1 A 84 84 ARG C C 84 177.399 178.580 -1.181 1
1 954 . 2 1 1 A 84 84 ARG CA C 84 59.045 59.017 0.028 1
1 955 . 2 1 1 A 84 84 ARG CB C 84 29.992 29.954 0.038 1
1 957 . 2 1 1 A 84 84 ARG N N 84 121.312 119.264 2.048 1
1 958 . 2 1 1 A 85 85 ILE H H 85 8.354 7.851 0.503 1
1 959 . 2 1 1 A 85 85 ILE HA H 85 3.650 4.400 -0.750 1
1 967 . 2 1 1 A 85 85 ILE C C 85 176.098 178.059 -1.961 1
1 968 . 2 1 1 A 85 85 ILE CA C 85 66.704 63.912 2.792 1
1 969 . 2 1 1 A 85 85 ILE CB C 85 38.017 37.897 0.120 1
1 972 . 2 1 1 A 85 85 ILE N N 85 119.321 120.533 -1.212 1
1 973 . 2 1 1 A 86 86 ARG H H 86 7.690 7.885 -0.195 1
1 974 . 2 1 1 A 86 86 ARG HA H 86 3.704 3.943 -0.239 1
1 981 . 2 1 1 A 86 86 ARG C C 86 177.524 178.493 -0.969 1
1 982 . 2 1 1 A 86 86 ARG CA C 86 59.881 60.009 -0.128 1
1 983 . 2 1 1 A 86 86 ARG CB C 86 29.248 29.896 -0.648 1
1 986 . 2 1 1 A 86 86 ARG N N 86 118.362 121.873 -3.511 1
1 987 . 2 1 1 A 87 87 GLU H H 87 7.884 8.161 -0.277 1
1 988 . 2 1 1 A 87 87 GLU HA H 87 4.064 4.107 -0.043 1
1 993 . 2 1 1 A 87 87 GLU C C 87 178.785 179.123 -0.338 1
1 994 . 2 1 1 A 87 87 GLU CA C 87 58.999 59.304 -0.305 1
1 995 . 2 1 1 A 87 87 GLU CB C 87 29.872 29.203 0.669 1
1 997 . 2 1 1 A 87 87 GLU N N 87 118.124 117.399 0.725 1
1 998 . 2 1 1 A 88 88 ILE H H 88 8.715 7.775 0.940 1
1 999 . 2 1 1 A 88 88 ILE HA H 88 3.305 3.545 -0.240 1
1 1009 . 2 1 1 A 88 88 ILE C C 88 177.261 178.496 -1.235 1
1 1010 . 2 1 1 A 88 88 ILE CA C 88 65.822 64.891 0.931 1
1 1011 . 2 1 1 A 88 88 ILE CB C 88 37.370 36.923 0.447 1
1 1015 . 2 1 1 A 88 88 ILE N N 88 122.929 121.575 1.354 1
1 1016 . 2 1 1 A 89 89 LEU H H 89 8.486 8.745 -0.259 1
1 1017 . 2 1 1 A 89 89 LEU HA H 89 3.932 3.886 0.046 1
1 1023 . 2 1 1 A 89 89 LEU C C 89 177.919 179.026 -1.107 1
1 1024 . 2 1 1 A 89 89 LEU CA C 89 59.060 58.280 0.780 1
1 1025 . 2 1 1 A 89 89 LEU CB C 89 41.129 41.797 -0.668 1
1 1028 . 2 1 1 A 89 89 LEU N N 89 122.696 121.280 1.416 1
1 1029 . 2 1 1 A 90 90 LYS H H 90 7.790 7.955 -0.165 1
1 1030 . 2 1 1 A 90 90 LYS HA H 90 4.061 3.909 0.152 1
1 1035 . 2 1 1 A 90 90 LYS C C 90 178.432 178.677 -0.245 1
1 1036 . 2 1 1 A 90 90 LYS CA C 90 59.840 59.174 0.666 1
1 1037 . 2 1 1 A 90 90 LYS CB C 90 32.582 32.244 0.338 1
1 1039 . 2 1 1 A 90 90 LYS N N 90 118.640 119.266 -0.626 1
1 1040 . 2 1 1 A 91 91 ALA H H 91 8.113 7.846 0.267 1
1 1041 . 2 1 1 A 91 91 ALA HA H 91 4.151 4.115 0.036 1
1 1045 . 2 1 1 A 91 91 ALA C C 91 179.147 179.653 -0.506 1
1 1046 . 2 1 1 A 91 91 ALA CA C 91 54.942 55.247 -0.305 1
1 1047 . 2 1 1 A 91 91 ALA CB C 91 18.242 18.203 0.039 1
1 1048 . 2 1 1 A 91 91 ALA N N 91 122.939 121.902 1.037 1
1 1049 . 2 1 1 A 92 92 SER H H 92 8.858 8.485 0.373 1
1 1050 . 2 1 1 A 92 92 SER HA H 92 4.898 4.193 0.705 1
1 1052 . 2 1 1 A 92 92 SER C C 92 172.440 176.821 -4.381 1
1 1053 . 2 1 1 A 92 92 SER CA C 92 61.913 60.684 1.229 1
1 1054 . 2 1 1 A 92 92 SER CB C 92 63.081 62.925 0.156 1
1 1055 . 2 1 1 A 92 92 SER N N 92 114.526 113.403 1.123 1
1 1056 . 2 1 1 A 93 93 ARG H H 93 7.704 8.401 -0.697 1
1 1057 . 2 1 1 A 93 93 ARG HA H 93 4.162 4.176 -0.014 1
1 1059 . 2 1 1 A 93 93 ARG C C 93 177.757 178.535 -0.778 1
1 1060 . 2 1 1 A 93 93 ARG CA C 93 59.544 58.335 1.209 1
1 1061 . 2 1 1 A 93 93 ARG CB C 93 30.343 30.244 0.099 1
1 1062 . 2 1 1 A 93 93 ARG N N 93 121.505 121.448 0.057 1
1 1063 . 2 1 1 A 94 94 LYS H H 94 7.456 7.505 -0.049 1
1 1064 . 2 1 1 A 94 94 LYS HA H 94 4.174 4.103 0.071 1
1 1071 . 2 1 1 A 94 94 LYS C C 94 178.861 178.633 0.228 1
1 1072 . 2 1 1 A 94 94 LYS CA C 94 59.030 59.303 -0.273 1
1 1073 . 2 1 1 A 94 94 LYS CB C 94 32.239 32.296 -0.057 1
1 1077 . 2 1 1 A 94 94 LYS N N 94 119.072 120.711 -1.639 1
1 1078 . 2 1 1 A 95 95 LEU H H 95 8.148 7.650 0.498 1
1 1079 . 2 1 1 A 95 95 LEU HA H 95 4.129 4.124 0.005 1
1 1088 . 2 1 1 A 95 95 LEU C C 95 177.274 178.388 -1.114 1
1 1089 . 2 1 1 A 95 95 LEU CA C 95 57.136 56.994 0.142 1
1 1090 . 2 1 1 A 95 95 LEU CB C 95 41.908 42.297 -0.389 1
1 1093 . 2 1 1 A 95 95 LEU N N 95 119.717 120.697 -0.980 1
1 1094 . 2 1 1 A 96 96 GLN H H 96 7.807 8.290 -0.483 1
1 1095 . 2 1 1 A 96 96 GLN HA H 96 4.242 4.363 -0.121 1
1 1102 . 2 1 1 A 96 96 GLN C C 96 175.371 176.410 -1.039 1
1 1103 . 2 1 1 A 96 96 GLN CA C 96 56.397 55.565 0.832 1
1 1104 . 2 1 1 A 96 96 GLN CB C 96 29.123 29.415 -0.292 1
1 1106 . 2 1 1 A 96 96 GLN N N 96 114.581 115.654 -1.073 1
1 1108 . 2 1 1 A 97 97 GLY H H 97 7.802 7.917 -0.115 1
1 1109 . 2 1 1 A 97 97 GLY HA2 H 97 3.839 3.887 -0.048 1
1 1110 . 2 1 1 A 97 97 GLY HA3 H 97 4.096 3.887 0.209 1
1 1111 . 2 1 1 A 97 97 GLY C C 97 172.636 174.095 -1.459 1
1 1112 . 2 1 1 A 97 97 GLY CA C 97 46.372 46.999 -0.627 1
1 1113 . 2 1 1 A 97 97 GLY N N 97 106.959 109.610 -2.651 1
1 1114 . 2 1 1 A 98 98 ASP H H 98 8.156 8.302 -0.146 1
1 1115 . 2 1 1 A 98 98 ASP HA H 98 4.754 4.786 -0.032 1
1 1118 . 2 1 1 A 98 98 ASP CA C 98 52.882 50.796 2.086 1
1 1119 . 2 1 1 A 98 98 ASP CB C 98 41.603 40.886 0.717 1
1 1120 . 2 1 1 A 98 98 ASP N N 98 118.447 121.362 -2.915 1
1 1121 . 2 1 1 A 99 99 PRO HA H 99 4.470 4.428 0.042 1
1 1126 . 2 1 1 A 99 99 PRO C C 99 175.500 176.595 -1.095 1
1 1127 . 2 1 1 A 99 99 PRO CA C 99 63.601 63.287 0.314 1
1 1128 . 2 1 1 A 99 99 PRO CB C 99 32.423 31.400 1.023 1
1 1130 . 2 1 1 A 100 100 ASP H H 100 8.527 8.713 -0.186 1
1 1131 . 2 1 1 A 100 100 ASP HA H 100 4.778 4.259 0.519 1
1 1134 . 2 1 1 A 100 100 ASP C C 100 174.931 174.776 0.155 1
1 1135 . 2 1 1 A 100 100 ASP CA C 100 53.915 54.679 -0.764 1
1 1136 . 2 1 1 A 100 100 ASP CB C 100 40.665 39.369 1.296 1
1 1137 . 2 1 1 A 100 100 ASP N N 100 119.340 117.398 1.942 1
1 1138 . 2 1 1 A 101 101 LEU H H 101 7.379 7.847 -0.468 1
1 1139 . 2 1 1 A 101 101 LEU HA H 101 4.682 4.638 0.044 1
1 1148 . 2 1 1 A 101 101 LEU CA C 101 52.956 51.523 1.433 1
1 1149 . 2 1 1 A 101 101 LEU CB C 101 43.393 45.694 -2.301 1
1 1152 . 2 1 1 A 101 101 LEU N N 101 122.107 122.716 -0.609 1
1 1153 . 2 1 1 A 102 102 PRO HA H 102 4.487 4.495 -0.008 1
1 1158 . 2 1 1 A 102 102 PRO C C 102 175.697 175.574 0.123 1
1 1159 . 2 1 1 A 102 102 PRO CA C 102 63.113 63.057 0.056 1
1 1160 . 2 1 1 A 102 102 PRO CB C 102 32.138 31.817 0.321 1
1 1163 . 2 1 1 A 103 103 MET H H 103 9.011 8.693 0.318 1
1 1164 . 2 1 1 A 103 103 MET HA H 103 4.769 5.231 -0.462 1
1 1171 . 2 1 1 A 103 103 MET C C 103 174.080 174.506 -0.426 1
1 1172 . 2 1 1 A 103 103 MET CA C 103 54.737 54.187 0.550 1
1 1173 . 2 1 1 A 103 103 MET CB C 103 34.857 36.076 -1.219 1
1 1176 . 2 1 1 A 103 103 MET N N 103 123.334 123.095 0.239 1
1 1177 . 2 1 1 A 104 104 SER H H 104 8.239 8.764 -0.525 1
1 1178 . 2 1 1 A 104 104 SER HA H 104 5.079 4.991 0.088 1
1 1181 . 2 1 1 A 104 104 SER C C 104 171.795 172.723 -0.928 1
1 1182 . 2 1 1 A 104 104 SER CA C 104 57.641 57.525 0.116 1
1 1183 . 2 1 1 A 104 104 SER CB C 104 66.282 67.388 -1.106 1
1 1184 . 2 1 1 A 104 104 SER N N 104 114.434 117.496 -3.062 1
1 1185 . 2 1 1 A 105 105 PHE H H 105 9.003 8.068 0.935 1
1 1186 . 2 1 1 A 105 105 PHE HA H 105 5.209 5.346 -0.137 1
1 1193 . 2 1 1 A 105 105 PHE C C 105 170.688 172.417 -1.729 1
1 1194 . 2 1 1 A 105 105 PHE CA C 105 56.917 55.822 1.095 1
1 1195 . 2 1 1 A 105 105 PHE CB C 105 41.350 41.630 -0.280 1
1 1196 . 2 1 1 A 105 105 PHE N N 105 116.224 118.892 -2.668 1
1 1197 . 2 1 1 A 106 106 THR H H 106 9.074 8.912 0.162 1
1 1198 . 2 1 1 A 106 106 THR HA H 106 4.664 4.714 -0.050 1
1 1203 . 2 1 1 A 106 106 THR C C 106 171.767 174.637 -2.870 1
1 1204 . 2 1 1 A 106 106 THR CA C 106 62.162 62.616 -0.454 1
1 1205 . 2 1 1 A 106 106 THR CB C 106 70.072 69.784 0.288 1
1 1207 . 2 1 1 A 106 106 THR N N 106 117.469 116.582 0.887 1
1 1208 . 2 1 1 A 107 107 LEU H H 107 9.804 9.302 0.502 1
1 1209 . 2 1 1 A 107 107 LEU HA H 107 4.750 4.851 -0.101 1
1 1219 . 2 1 1 A 107 107 LEU C C 107 172.742 176.095 -3.353 1
1 1220 . 2 1 1 A 107 107 LEU CA C 107 54.151 54.294 -0.143 1
1 1221 . 2 1 1 A 107 107 LEU CB C 107 44.486 43.192 1.294 1
1 1224 . 2 1 1 A 107 107 LEU N N 107 133.400 128.681 4.719 1
1 1225 . 2 1 1 A 108 108 ALA H H 108 8.435 8.801 -0.366 1
1 1226 . 2 1 1 A 108 108 ALA HA H 108 4.683 4.541 0.142 1
1 1230 . 2 1 1 A 108 108 ALA C C 108 173.052 175.426 -2.374 1
1 1231 . 2 1 1 A 108 108 ALA CA C 108 49.308 50.215 -0.907 1
1 1232 . 2 1 1 A 108 108 ALA CB C 108 22.120 20.035 2.085 1
1 1233 . 2 1 1 A 108 108 ALA N N 108 131.422 126.991 4.431 1
1 1234 . 2 1 1 A 109 109 ILE H H 109 8.909 8.969 -0.060 1
1 1235 . 2 1 1 A 109 109 ILE HA H 109 4.063 5.235 -1.172 1
1 1245 . 2 1 1 A 109 109 ILE CA C 109 60.982 60.555 0.427 1
1 1246 . 2 1 1 A 109 109 ILE CB C 109 39.074 38.099 0.975 1
1 1250 . 2 1 1 A 109 109 ILE N N 109 124.415 123.777 0.638 1
1 1251 . 2 1 1 A 110 110 VAL H H 110 8.706 8.926 -0.220 1
1 1252 . 2 1 1 A 110 110 VAL HA H 110 4.324 4.934 -0.610 1
1 1260 . 2 1 1 A 110 110 VAL C C 110 175.700 173.591 2.109 1
1 1261 . 2 1 1 A 110 110 VAL CA C 110 62.316 59.728 2.588 1
1 1262 . 2 1 1 A 110 110 VAL CB C 110 31.876 34.069 -2.193 1
1 1264 . 2 1 1 A 110 110 VAL N N 110 127.457 128.175 -0.718 1
1 1265 . 2 1 1 A 111 111 GLU H H 111 9.024 9.007 0.017 1
1 1266 . 2 1 1 A 111 111 GLU HA H 111 4.403 4.449 -0.046 1
1 1269 . 2 1 1 A 111 111 GLU C C 111 175.987 177.603 -1.616 1
1 1270 . 2 1 1 A 111 111 GLU CA C 111 56.842 56.309 0.533 1
1 1271 . 2 1 1 A 111 111 GLU CB C 111 31.044 31.968 -0.924 1
1 1272 . 2 1 1 A 111 111 GLU N N 111 129.768 129.439 0.329 1
1 1273 . 2 1 1 A 112 112 SER H H 112 9.143 8.962 0.181 1
1 1274 . 2 1 1 A 112 112 SER HA H 112 4.394 4.137 0.257 1
1 1276 . 2 1 1 A 112 112 SER C C 112 173.187 176.258 -3.071 1
1 1277 . 2 1 1 A 112 112 SER CA C 112 60.180 61.921 -1.741 1
1 1278 . 2 1 1 A 112 112 SER CB C 112 63.415 62.958 0.457 1
1 1279 . 2 1 1 A 112 112 SER N N 112 115.956 121.345 -5.389 1
1 1280 . 2 1 1 A 113 113 ASP H H 113 8.133 8.243 -0.110 1
1 1281 . 2 1 1 A 113 113 ASP HA H 113 4.573 4.471 0.102 1
1 1284 . 2 1 1 A 113 113 ASP C C 113 175.430 176.544 -1.114 1
1 1285 . 2 1 1 A 113 113 ASP CA C 113 54.115 56.581 -2.466 1
1 1286 . 2 1 1 A 113 113 ASP CB C 113 40.011 41.798 -1.787 1
1 1287 . 2 1 1 A 113 113 ASP N N 113 118.343 121.727 -3.384 1
1 1288 . 2 1 1 A 114 114 SER H H 114 8.034 7.653 0.381 1
1 1289 . 2 1 1 A 114 114 SER HA H 114 4.057 4.626 -0.569 1
1 1291 . 2 1 1 A 114 114 SER C C 114 172.209 173.981 -1.772 1
1 1292 . 2 1 1 A 114 114 SER CA C 114 60.179 58.819 1.360 1
1 1293 . 2 1 1 A 114 114 SER CB C 114 62.702 65.927 -3.225 1
1 1294 . 2 1 1 A 114 114 SER N N 114 109.836 111.875 -2.039 1
1 1295 . 2 1 1 A 115 115 THR H H 115 7.711 7.368 0.343 1
1 1296 . 2 1 1 A 115 115 THR HA H 115 4.250 4.102 0.148 1
1 1300 . 2 1 1 A 115 115 THR C C 115 171.500 174.016 -2.516 1
1 1301 . 2 1 1 A 115 115 THR CA C 115 63.547 64.426 -0.879 1
1 1302 . 2 1 1 A 115 115 THR CB C 115 69.595 69.155 0.440 1
1 1303 . 2 1 1 A 115 115 THR N N 115 117.407 115.824 1.583 1
1 1304 . 2 1 1 A 116 116 ILE H H 116 8.219 9.082 -0.863 1
1 1305 . 2 1 1 A 116 116 ILE HA H 116 4.769 5.092 -0.323 1
1 1315 . 2 1 1 A 116 116 ILE C C 116 174.434 175.278 -0.844 1
1 1316 . 2 1 1 A 116 116 ILE CA C 116 60.306 59.789 0.517 1
1 1317 . 2 1 1 A 116 116 ILE CB C 116 40.686 38.557 2.129 1
1 1321 . 2 1 1 A 116 116 ILE N N 116 125.480 128.458 -2.978 1
1 1322 . 2 1 1 A 117 117 VAL H H 117 8.695 9.485 -0.790 1
1 1323 . 2 1 1 A 117 117 VAL HA H 117 4.315 4.684 -0.369 1
1 1328 . 2 1 1 A 117 117 VAL C C 117 172.243 174.664 -2.421 1
1 1329 . 2 1 1 A 117 117 VAL CA C 117 60.621 61.123 -0.502 1
1 1330 . 2 1 1 A 117 117 VAL CB C 117 34.558 34.424 0.134 1
1 1332 . 2 1 1 A 117 117 VAL N N 117 127.887 127.291 0.596 1
1 1333 . 2 1 1 A 118 118 TYR H H 118 8.270 8.849 -0.579 1
1 1334 . 2 1 1 A 118 118 TYR HA H 118 5.327 5.240 0.087 1
1 1342 . 2 1 1 A 118 118 TYR C C 118 174.250 175.136 -0.886 1
1 1343 . 2 1 1 A 118 118 TYR CA C 118 57.283 57.925 -0.642 1
1 1344 . 2 1 1 A 118 118 TYR CB C 118 39.262 40.181 -0.919 1
1 1345 . 2 1 1 A 118 118 TYR N N 118 124.822 126.893 -2.071 1
1 1346 . 2 1 1 A 119 119 TYR H H 119 9.207 9.380 -0.173 1
1 1347 . 2 1 1 A 119 119 TYR HA H 119 4.821 5.208 -0.387 1
1 1354 . 2 1 1 A 119 119 TYR C C 119 171.994 173.315 -1.321 1
1 1355 . 2 1 1 A 119 119 TYR CA C 119 58.116 57.423 0.693 1
1 1356 . 2 1 1 A 119 119 TYR CB C 119 43.544 42.126 1.418 1
1 1357 . 2 1 1 A 119 119 TYR N N 119 125.153 123.701 1.452 1
1 1358 . 2 1 1 A 120 120 LYS H H 120 7.700 8.670 -0.970 1
1 1359 . 2 1 1 A 120 120 LYS HA H 120 4.558 4.769 -0.211 1
1 1366 . 2 1 1 A 120 120 LYS C C 120 172.017 174.911 -2.894 1
1 1367 . 2 1 1 A 120 120 LYS CA C 120 57.217 55.105 2.112 1
1 1368 . 2 1 1 A 120 120 LYS CB C 120 33.914 34.302 -0.388 1
1 1372 . 2 1 1 A 120 120 LYS N N 120 129.442 129.160 0.282 1
1 1373 . 2 1 1 A 121 121 LEU H H 121 8.112 8.410 -0.298 1
1 1374 . 2 1 1 A 121 121 LEU HA H 121 5.323 4.708 0.615 1
1 1384 . 2 1 1 A 121 121 LEU C C 121 175.733 174.696 1.037 1
1 1385 . 2 1 1 A 121 121 LEU CA C 121 52.716 53.317 -0.601 1
1 1386 . 2 1 1 A 121 121 LEU CB C 121 44.098 44.242 -0.144 1
1 1389 . 2 1 1 A 121 121 LEU N N 121 123.403 128.939 -5.536 1
1 1390 . 2 1 1 A 122 122 THR H H 122 8.338 8.738 -0.400 1
1 1391 . 2 1 1 A 122 122 THR HA H 122 5.097 5.410 -0.313 1
1 1396 . 2 1 1 A 122 122 THR C C 122 173.221 172.946 0.275 1
1 1397 . 2 1 1 A 122 122 THR CA C 122 60.306 60.591 -0.285 1
1 1398 . 2 1 1 A 122 122 THR CB C 122 72.473 73.102 -0.629 1
1 1400 . 2 1 1 A 122 122 THR N N 122 109.081 122.530 -13.449 1
1 7 . 3 1 1 A 2 2 GLU H H 2 8.994 8.125 0.869 1
1 8 . 3 1 1 A 2 2 GLU HA H 2 4.278 4.208 0.070 1
1 13 . 3 1 1 A 2 2 GLU C C 2 175.315 177.664 -2.349 1
1 14 . 3 1 1 A 2 2 GLU CA C 2 57.318 57.206 0.112 1
1 15 . 3 1 1 A 2 2 GLU CB C 2 29.221 31.726 -2.505 1
1 17 . 3 1 1 A 2 2 GLU N N 2 122.259 118.199 4.060 1
1 18 . 3 1 1 A 3 3 ASP H H 3 8.048 8.518 -0.470 1
1 19 . 3 1 1 A 3 3 ASP HA H 3 4.580 4.505 0.075 1
1 21 . 3 1 1 A 3 3 ASP C C 3 175.636 176.161 -0.525 1
1 22 . 3 1 1 A 3 3 ASP CA C 3 54.579 54.895 -0.316 1
1 23 . 3 1 1 A 3 3 ASP CB C 3 40.984 39.153 1.831 1
1 24 . 3 1 1 A 3 3 ASP N N 3 119.830 118.610 1.220 1
1 25 . 3 1 1 A 4 4 ALA H H 4 8.090 8.064 0.026 1
1 26 . 3 1 1 A 4 4 ALA HA H 4 4.216 4.908 -0.692 1
1 30 . 3 1 1 A 4 4 ALA C C 4 177.157 177.890 -0.733 1
1 31 . 3 1 1 A 4 4 ALA CA C 4 53.620 51.055 2.565 1
1 32 . 3 1 1 A 4 4 ALA CB C 4 18.728 19.597 -0.869 1
1 33 . 3 1 1 A 4 4 ALA N N 4 123.957 120.622 3.335 1
1 34 . 3 1 1 A 5 5 TRP H H 5 7.941 7.511 0.430 1
1 35 . 3 1 1 A 5 5 TRP HA H 5 4.559 4.391 0.168 1
1 39 . 3 1 1 A 5 5 TRP C C 5 176.072 178.108 -2.036 1
1 40 . 3 1 1 A 5 5 TRP CA C 5 57.744 60.039 -2.295 1
1 41 . 3 1 1 A 5 5 TRP CB C 5 28.906 28.602 0.304 1
1 42 . 3 1 1 A 5 5 TRP N N 5 118.408 119.454 -1.046 1
1 44 . 3 1 1 A 6 6 MET H H 6 7.679 8.125 -0.446 1
1 45 . 3 1 1 A 6 6 MET HA H 6 3.785 4.644 -0.859 1
1 52 . 3 1 1 A 6 6 MET C C 6 175.174 177.137 -1.963 1
1 53 . 3 1 1 A 6 6 MET CA C 6 57.724 57.179 0.545 1
1 54 . 3 1 1 A 6 6 MET CB C 6 31.640 34.510 -2.870 1
1 57 . 3 1 1 A 6 6 MET N N 6 121.538 117.765 3.773 1
1 58 . 3 1 1 A 7 7 GLY H H 7 7.247 7.989 -0.742 1
1 59 . 3 1 1 A 7 7 GLY HA2 H 7 3.455 4.180 -0.725 1
1 60 . 3 1 1 A 7 7 GLY HA3 H 7 3.578 4.273 -0.695 1
1 61 . 3 1 1 A 7 7 GLY C C 7 172.852 173.649 -0.797 1
1 62 . 3 1 1 A 7 7 GLY CA C 7 45.896 44.421 1.475 1
1 63 . 3 1 1 A 7 7 GLY N N 7 104.055 109.088 -5.033 1
1 64 . 3 1 1 A 8 8 THR H H 8 7.436 8.506 -1.070 1
1 65 . 3 1 1 A 8 8 THR HA H 8 4.428 4.775 -0.347 1
1 70 . 3 1 1 A 8 8 THR C C 8 172.973 173.777 -0.804 1
1 71 . 3 1 1 A 8 8 THR CA C 8 60.751 61.487 -0.736 1
1 72 . 3 1 1 A 8 8 THR CB C 8 69.637 71.521 -1.884 1
1 74 . 3 1 1 A 8 8 THR N N 8 107.669 115.035 -7.366 1
1 75 . 3 1 1 A 9 9 HIS H H 9 8.048 7.861 0.187 1
1 76 . 3 1 1 A 9 9 HIS HA H 9 4.654 4.964 -0.310 1
1 79 . 3 1 1 A 9 9 HIS CA C 9 56.163 53.547 2.616 1
1 80 . 3 1 1 A 9 9 HIS CB C 9 32.619 31.237 1.382 1
1 81 . 3 1 1 A 9 9 HIS N N 9 127.281 120.869 6.412 1
1 82 . 3 1 1 A 10 10 PRO HA H 10 4.257 4.267 -0.010 1
1 88 . 3 1 1 A 10 10 PRO C C 10 178.779 179.131 -0.352 1
1 89 . 3 1 1 A 10 10 PRO CA C 10 65.565 65.636 -0.071 1
1 90 . 3 1 1 A 10 10 PRO CB C 10 32.422 31.836 0.586 1
1 93 . 3 1 1 A 11 11 LYS H H 11 10.994 8.520 2.474 1
1 94 . 3 1 1 A 11 11 LYS HA H 11 4.282 4.127 0.155 1
1 100 . 3 1 1 A 11 11 LYS C C 11 177.279 178.590 -1.311 1
1 101 . 3 1 1 A 11 11 LYS CA C 11 56.859 59.189 -2.330 1
1 102 . 3 1 1 A 11 11 LYS CB C 11 31.279 32.797 -1.518 1
1 104 . 3 1 1 A 11 11 LYS N N 11 121.398 118.173 3.225 1
1 105 . 3 1 1 A 12 12 TYR H H 12 7.146 8.373 -1.227 1
1 106 . 3 1 1 A 12 12 TYR HA H 12 3.722 4.331 -0.609 1
1 113 . 3 1 1 A 12 12 TYR C C 12 176.265 177.493 -1.228 1
1 114 . 3 1 1 A 12 12 TYR CA C 12 61.189 61.436 -0.247 1
1 115 . 3 1 1 A 12 12 TYR CB C 12 37.796 38.533 -0.737 1
1 116 . 3 1 1 A 12 12 TYR N N 12 121.579 122.446 -0.867 1
1 117 . 3 1 1 A 13 13 LEU H H 13 7.778 8.902 -1.124 1
1 118 . 3 1 1 A 13 13 LEU HA H 13 3.773 3.975 -0.202 1
1 127 . 3 1 1 A 13 13 LEU C C 13 178.462 178.470 -0.008 1
1 128 . 3 1 1 A 13 13 LEU CA C 13 57.942 58.145 -0.203 1
1 129 . 3 1 1 A 13 13 LEU CB C 13 41.064 41.567 -0.503 1
1 132 . 3 1 1 A 13 13 LEU N N 13 117.518 120.924 -3.406 1
1 133 . 3 1 1 A 14 14 GLU H H 14 7.867 8.629 -0.762 1
1 134 . 3 1 1 A 14 14 GLU HA H 14 3.935 4.135 -0.200 1
1 139 . 3 1 1 A 14 14 GLU C C 14 178.326 178.726 -0.400 1
1 140 . 3 1 1 A 14 14 GLU CA C 14 59.368 59.723 -0.355 1
1 141 . 3 1 1 A 14 14 GLU CB C 14 30.147 29.113 1.034 1
1 143 . 3 1 1 A 14 14 GLU N N 14 119.135 119.277 -0.142 1
1 144 . 3 1 1 A 15 15 MET H H 15 7.773 7.693 0.080 1
1 145 . 3 1 1 A 15 15 MET HA H 15 3.936 4.140 -0.204 1
1 152 . 3 1 1 A 15 15 MET C C 15 177.886 178.098 -0.212 1
1 153 . 3 1 1 A 15 15 MET CA C 15 59.465 58.113 1.352 1
1 154 . 3 1 1 A 15 15 MET CB C 15 33.987 32.330 1.657 1
1 157 . 3 1 1 A 15 15 MET N N 15 117.884 119.345 -1.461 1
1 158 . 3 1 1 A 16 16 MET H H 16 8.145 8.084 0.061 1
1 159 . 3 1 1 A 16 16 MET HA H 16 4.159 4.008 0.151 1
1 166 . 3 1 1 A 16 16 MET C C 16 177.835 178.102 -0.267 1
1 167 . 3 1 1 A 16 16 MET CA C 16 57.397 57.846 -0.449 1
1 168 . 3 1 1 A 16 16 MET CB C 16 31.867 32.057 -0.190 1
1 171 . 3 1 1 A 16 16 MET N N 16 119.555 119.004 0.551 1
1 172 . 3 1 1 A 17 17 GLU H H 17 7.761 7.841 -0.080 1
1 173 . 3 1 1 A 17 17 GLU HA H 17 4.117 4.256 -0.139 1
1 176 . 3 1 1 A 17 17 GLU C C 17 175.994 177.516 -1.522 1
1 177 . 3 1 1 A 17 17 GLU CA C 17 57.392 58.230 -0.838 1
1 178 . 3 1 1 A 17 17 GLU CB C 17 29.432 29.565 -0.133 1
1 180 . 3 1 1 A 17 17 GLU N N 17 118.216 116.994 1.222 1
1 181 . 3 1 1 A 18 18 LEU H H 18 7.201 7.248 -0.047 1
1 182 . 3 1 1 A 18 18 LEU HA H 18 4.111 4.191 -0.080 1
1 191 . 3 1 1 A 18 18 LEU C C 18 175.781 177.220 -1.439 1
1 192 . 3 1 1 A 18 18 LEU CA C 18 56.366 55.309 1.057 1
1 193 . 3 1 1 A 18 18 LEU CB C 18 42.030 42.303 -0.273 1
1 196 . 3 1 1 A 18 18 LEU N N 18 117.448 122.156 -4.708 1
1 197 . 3 1 1 A 19 19 ASP H H 19 7.789 8.830 -1.041 1
1 198 . 3 1 1 A 19 19 ASP HA H 19 4.360 4.681 -0.321 1
1 201 . 3 1 1 A 19 19 ASP C C 19 173.765 176.424 -2.659 1
1 202 . 3 1 1 A 19 19 ASP CA C 19 54.851 54.515 0.336 1
1 203 . 3 1 1 A 19 19 ASP CB C 19 39.115 39.675 -0.560 1
1 204 . 3 1 1 A 19 19 ASP N N 19 115.844 121.964 -6.120 1
1 205 . 3 1 1 A 20 20 ILE H H 20 8.142 7.759 0.383 1
1 206 . 3 1 1 A 20 20 ILE HA H 20 4.128 4.250 -0.122 1
1 216 . 3 1 1 A 20 20 ILE C C 20 174.710 176.904 -2.194 1
1 217 . 3 1 1 A 20 20 ILE CA C 20 60.465 61.914 -1.449 1
1 218 . 3 1 1 A 20 20 ILE CB C 20 40.407 39.552 0.855 1
1 222 . 3 1 1 A 20 20 ILE N N 20 117.287 115.502 1.785 1
1 223 . 3 1 1 A 21 21 GLY H H 21 8.207 8.109 0.098 1
1 224 . 3 1 1 A 21 21 GLY HA2 H 21 3.889 3.880 0.009 1
1 225 . 3 1 1 A 21 21 GLY HA3 H 21 3.924 3.891 0.033 1
1 226 . 3 1 1 A 21 21 GLY C C 21 172.162 174.238 -2.076 1
1 227 . 3 1 1 A 21 21 GLY CA C 21 45.017 46.737 -1.720 1
1 228 . 3 1 1 A 21 21 GLY N N 21 110.656 111.845 -1.189 1
1 229 . 3 1 1 A 22 22 ASP H H 22 7.727 8.072 -0.345 1
1 230 . 3 1 1 A 22 22 ASP HA H 22 4.794 4.895 -0.101 1
1 233 . 3 1 1 A 22 22 ASP C C 22 174.884 176.587 -1.703 1
1 234 . 3 1 1 A 22 22 ASP CA C 22 52.471 52.636 -0.165 1
1 235 . 3 1 1 A 22 22 ASP CB C 22 42.069 41.398 0.671 1
1 236 . 3 1 1 A 22 22 ASP N N 22 119.305 120.447 -1.142 1
1 237 . 3 1 1 A 23 23 ALA H H 23 8.644 8.929 -0.285 1
1 238 . 3 1 1 A 23 23 ALA HA H 23 4.120 3.966 0.154 1
1 242 . 3 1 1 A 23 23 ALA C C 23 179.546 179.866 -0.320 1
1 243 . 3 1 1 A 23 23 ALA CA C 23 55.609 55.445 0.164 1
1 244 . 3 1 1 A 23 23 ALA CB C 23 18.573 18.397 0.176 1
1 245 . 3 1 1 A 23 23 ALA N N 23 122.468 129.490 -7.022 1
1 246 . 3 1 1 A 24 24 THR H H 24 8.238 7.720 0.518 1
1 247 . 3 1 1 A 24 24 THR HA H 24 4.184 4.059 0.125 1
1 252 . 3 1 1 A 24 24 THR C C 24 174.841 176.844 -2.003 1
1 253 . 3 1 1 A 24 24 THR CA C 24 66.241 66.602 -0.361 1
1 254 . 3 1 1 A 24 24 THR CB C 24 68.376 68.347 0.029 1
1 256 . 3 1 1 A 24 24 THR N N 24 114.824 113.663 1.161 1
1 257 . 3 1 1 A 25 25 GLN H H 25 8.037 8.384 -0.347 1
1 258 . 3 1 1 A 25 25 GLN HA H 25 4.095 4.055 0.040 1
1 265 . 3 1 1 A 25 25 GLN C C 25 177.603 178.758 -1.155 1
1 266 . 3 1 1 A 25 25 GLN CA C 25 59.261 58.737 0.524 1
1 267 . 3 1 1 A 25 25 GLN CB C 25 28.437 28.282 0.155 1
1 269 . 3 1 1 A 25 25 GLN N N 25 122.518 120.131 2.387 1
1 271 . 3 1 1 A 26 26 VAL H H 26 7.994 8.950 -0.956 1
1 272 . 3 1 1 A 26 26 VAL HA H 26 3.469 3.644 -0.175 1
1 280 . 3 1 1 A 26 26 VAL C C 26 175.552 178.047 -2.495 1
1 281 . 3 1 1 A 26 26 VAL CA C 26 66.909 66.310 0.599 1
1 282 . 3 1 1 A 26 26 VAL CB C 26 31.582 31.334 0.248 1
1 285 . 3 1 1 A 26 26 VAL N N 26 119.112 120.793 -1.681 1
1 286 . 3 1 1 A 27 27 TYR H H 27 8.003 8.482 -0.479 1
1 287 . 3 1 1 A 27 27 TYR HA H 27 4.357 4.314 0.043 1
1 294 . 3 1 1 A 27 27 TYR C C 27 175.856 177.079 -1.223 1
1 295 . 3 1 1 A 27 27 TYR CA C 27 62.197 61.773 0.424 1
1 296 . 3 1 1 A 27 27 TYR CB C 27 38.394 38.908 -0.514 1
1 297 . 3 1 1 A 27 27 TYR N N 27 119.170 121.027 -1.857 1
1 298 . 3 1 1 A 28 28 VAL H H 28 8.087 8.274 -0.187 1
1 299 . 3 1 1 A 28 28 VAL HA H 28 3.652 3.417 0.235 1
1 307 . 3 1 1 A 28 28 VAL C C 28 176.134 177.917 -1.783 1
1 308 . 3 1 1 A 28 28 VAL CA C 28 66.247 66.221 0.026 1
1 309 . 3 1 1 A 28 28 VAL CB C 28 31.241 31.315 -0.074 1
1 312 . 3 1 1 A 28 28 VAL N N 28 113.112 119.277 -6.165 1
1 313 . 3 1 1 A 29 29 ALA H H 29 7.853 9.111 -1.258 1
1 314 . 3 1 1 A 29 29 ALA HA H 29 3.913 4.056 -0.143 1
1 318 . 3 1 1 A 29 29 ALA C C 29 177.850 179.383 -1.533 1
1 319 . 3 1 1 A 29 29 ALA CA C 29 55.274 54.964 0.310 1
1 320 . 3 1 1 A 29 29 ALA CB C 29 17.876 18.412 -0.536 1
1 321 . 3 1 1 A 29 29 ALA N N 29 121.350 122.909 -1.559 1
1 322 . 3 1 1 A 30 30 PHE H H 30 8.724 8.285 0.439 1
1 323 . 3 1 1 A 30 30 PHE HA H 30 4.098 4.408 -0.310 1
1 327 . 3 1 1 A 30 30 PHE C C 30 175.035 177.367 -2.332 1
1 328 . 3 1 1 A 30 30 PHE CA C 30 61.264 61.617 -0.353 1
1 329 . 3 1 1 A 30 30 PHE CB C 30 38.926 39.345 -0.419 1
1 330 . 3 1 1 A 30 30 PHE N N 30 120.478 120.150 0.328 1
1 331 . 3 1 1 A 31 31 LEU H H 31 8.146 8.208 -0.062 1
1 332 . 3 1 1 A 31 31 LEU HA H 31 3.597 3.551 0.046 1
1 341 . 3 1 1 A 31 31 LEU C C 31 179.508 179.227 0.281 1
1 342 . 3 1 1 A 31 31 LEU CA C 31 57.884 58.117 -0.233 1
1 343 . 3 1 1 A 31 31 LEU CB C 31 41.829 42.188 -0.359 1
1 346 . 3 1 1 A 31 31 LEU N N 31 118.427 120.206 -1.779 1
1 347 . 3 1 1 A 32 32 VAL H H 32 7.627 7.736 -0.109 1
1 348 . 3 1 1 A 32 32 VAL HA H 32 3.464 3.769 -0.305 1
1 356 . 3 1 1 A 32 32 VAL C C 32 174.956 177.581 -2.625 1
1 357 . 3 1 1 A 32 32 VAL CA C 32 66.373 65.591 0.782 1
1 358 . 3 1 1 A 32 32 VAL CB C 32 31.121 31.415 -0.294 1
1 361 . 3 1 1 A 32 32 VAL N N 32 119.497 113.666 5.831 1
1 362 . 3 1 1 A 33 33 TYR H H 33 8.366 8.612 -0.246 1
1 363 . 3 1 1 A 33 33 TYR HA H 33 3.485 3.957 -0.472 1
1 370 . 3 1 1 A 33 33 TYR C C 33 174.883 176.843 -1.960 1
1 371 . 3 1 1 A 33 33 TYR CA C 33 62.866 61.375 1.491 1
1 372 . 3 1 1 A 33 33 TYR CB C 33 37.778 38.301 -0.523 1
1 373 . 3 1 1 A 33 33 TYR N N 33 121.842 124.265 -2.423 1
1 374 . 3 1 1 A 34 34 LEU H H 34 8.000 8.396 -0.396 1
1 375 . 3 1 1 A 34 34 LEU HA H 34 3.495 3.615 -0.120 1
1 385 . 3 1 1 A 34 34 LEU C C 34 178.240 179.015 -0.775 1
1 386 . 3 1 1 A 34 34 LEU CA C 34 57.453 57.177 0.276 1
1 387 . 3 1 1 A 34 34 LEU CB C 34 41.828 41.061 0.767 1
1 390 . 3 1 1 A 34 34 LEU N N 34 116.692 119.612 -2.920 1
1 391 . 3 1 1 A 35 35 ASP H H 35 7.688 7.872 -0.184 1
1 392 . 3 1 1 A 35 35 ASP HA H 35 4.302 4.301 0.001 1
1 395 . 3 1 1 A 35 35 ASP C C 35 177.507 178.389 -0.882 1
1 396 . 3 1 1 A 35 35 ASP CA C 35 58.196 57.596 0.600 1
1 397 . 3 1 1 A 35 35 ASP CB C 35 43.070 41.074 1.996 1
1 398 . 3 1 1 A 35 35 ASP N N 35 120.507 119.891 0.616 1
1 399 . 3 1 1 A 36 36 LEU H H 36 8.482 8.440 0.042 1
1 400 . 3 1 1 A 36 36 LEU HA H 36 3.328 3.602 -0.274 1
1 410 . 3 1 1 A 36 36 LEU C C 36 176.774 178.911 -2.137 1
1 411 . 3 1 1 A 36 36 LEU CA C 36 57.461 57.686 -0.225 1
1 412 . 3 1 1 A 36 36 LEU CB C 36 41.344 40.992 0.352 1
1 416 . 3 1 1 A 36 36 LEU N N 36 117.671 120.171 -2.500 1
1 417 . 3 1 1 A 37 37 MET H H 37 7.822 7.823 -0.001 1
1 418 . 3 1 1 A 37 37 MET HA H 37 4.401 3.844 0.557 1
1 425 . 3 1 1 A 37 37 MET C C 37 177.862 177.591 0.271 1
1 426 . 3 1 1 A 37 37 MET CA C 37 56.434 58.851 -2.417 1
1 427 . 3 1 1 A 37 37 MET CB C 37 31.573 32.945 -1.372 1
1 430 . 3 1 1 A 37 37 MET N N 37 112.952 116.856 -3.904 1
1 431 . 3 1 1 A 38 38 GLU H H 38 8.667 7.905 0.762 1
1 432 . 3 1 1 A 38 38 GLU HA H 38 4.457 4.192 0.265 1
1 436 . 3 1 1 A 38 38 GLU C C 38 176.582 176.990 -0.408 1
1 437 . 3 1 1 A 38 38 GLU CA C 38 57.659 57.619 0.040 1
1 438 . 3 1 1 A 38 38 GLU CB C 38 29.936 30.429 -0.493 1
1 440 . 3 1 1 A 38 38 GLU N N 38 116.463 118.200 -1.737 1
1 441 . 3 1 1 A 39 39 SER H H 39 7.657 8.269 -0.612 1
1 442 . 3 1 1 A 39 39 SER HA H 39 4.658 4.491 0.167 1
1 445 . 3 1 1 A 39 39 SER C C 39 175.661 175.469 0.192 1
1 446 . 3 1 1 A 39 39 SER CA C 39 60.449 60.588 -0.139 1
1 447 . 3 1 1 A 39 39 SER CB C 39 63.341 64.496 -1.155 1
1 448 . 3 1 1 A 39 39 SER N N 39 113.870 113.783 0.087 1
1 449 . 3 1 1 A 40 40 LYS H H 40 8.165 7.630 0.535 1
1 450 . 3 1 1 A 40 40 LYS HA H 40 4.454 4.021 0.433 1
1 458 . 3 1 1 A 40 40 LYS C C 40 174.970 175.930 -0.960 1
1 459 . 3 1 1 A 40 40 LYS CA C 40 55.753 59.157 -3.404 1
1 460 . 3 1 1 A 40 40 LYS CB C 40 32.337 31.817 0.520 1
1 464 . 3 1 1 A 40 40 LYS N N 40 116.671 122.435 -5.764 1
1 465 . 3 1 1 A 41 41 SER H H 41 7.017 7.694 -0.677 1
1 466 . 3 1 1 A 41 41 SER HA H 41 4.209 4.144 0.065 1
1 469 . 3 1 1 A 41 41 SER C C 41 173.770 173.960 -0.190 1
1 470 . 3 1 1 A 41 41 SER CA C 41 58.435 59.013 -0.578 1
1 471 . 3 1 1 A 41 41 SER CB C 41 61.700 61.775 -0.075 1
1 472 . 3 1 1 A 41 41 SER N N 41 109.989 113.031 -3.042 1
1 473 . 3 1 1 A 42 42 TRP H H 42 8.876 7.751 1.125 1
1 474 . 3 1 1 A 42 42 TRP HA H 42 4.698 4.734 -0.036 1
1 478 . 3 1 1 A 42 42 TRP C C 42 174.477 177.628 -3.151 1
1 479 . 3 1 1 A 42 42 TRP CA C 42 59.443 57.414 2.029 1
1 480 . 3 1 1 A 42 42 TRP CB C 42 28.203 30.593 -2.390 1
1 481 . 3 1 1 A 42 42 TRP N N 42 121.116 120.497 0.619 1
1 483 . 3 1 1 A 43 43 HIS H H 43 8.132 8.763 -0.631 1
1 484 . 3 1 1 A 43 43 HIS HA H 43 4.445 4.463 -0.018 1
1 488 . 3 1 1 A 43 43 HIS C C 43 174.405 174.380 0.025 1
1 489 . 3 1 1 A 43 43 HIS CA C 43 58.556 58.957 -0.401 1
1 490 . 3 1 1 A 43 43 HIS CB C 43 29.430 30.718 -1.288 1
1 491 . 3 1 1 A 43 43 HIS N N 43 119.397 121.679 -2.282 1
1 492 . 3 1 1 A 44 44 GLU H H 44 8.140 7.583 0.557 1
1 493 . 3 1 1 A 44 44 GLU HA H 44 4.432 4.622 -0.190 1
1 497 . 3 1 1 A 44 44 GLU C C 44 173.010 174.405 -1.395 1
1 498 . 3 1 1 A 44 44 GLU CA C 44 56.421 56.229 0.192 1
1 499 . 3 1 1 A 44 44 GLU CB C 44 33.285 33.456 -0.171 1
1 501 . 3 1 1 A 44 44 GLU N N 44 116.181 118.030 -1.849 1
1 502 . 3 1 1 A 45 45 VAL H H 45 8.428 8.788 -0.360 1
1 503 . 3 1 1 A 45 45 VAL HA H 45 4.492 5.324 -0.832 1
1 511 . 3 1 1 A 45 45 VAL C C 45 172.339 174.798 -2.459 1
1 512 . 3 1 1 A 45 45 VAL CA C 45 63.071 61.217 1.854 1
1 513 . 3 1 1 A 45 45 VAL CB C 45 35.145 34.862 0.283 1
1 516 . 3 1 1 A 45 45 VAL N N 45 123.272 126.007 -2.735 1
1 517 . 3 1 1 A 46 46 ASN H H 46 9.050 8.883 0.167 1
1 518 . 3 1 1 A 46 46 ASN HA H 46 5.261 5.389 -0.128 1
1 523 . 3 1 1 A 46 46 ASN C C 46 172.845 173.675 -0.830 1
1 524 . 3 1 1 A 46 46 ASN CA C 46 51.895 51.718 0.177 1
1 525 . 3 1 1 A 46 46 ASN CB C 46 42.322 42.438 -0.116 1
1 526 . 3 1 1 A 46 46 ASN N N 46 123.901 124.314 -0.413 1
1 528 . 3 1 1 A 47 47 CYS H H 47 9.039 8.998 0.041 1
1 529 . 3 1 1 A 47 47 CYS HA H 47 5.160 5.508 -0.348 1
1 532 . 3 1 1 A 47 47 CYS C C 47 172.454 173.796 -1.342 1
1 533 . 3 1 1 A 47 47 CYS CA C 47 56.473 57.169 -0.696 1
1 534 . 3 1 1 A 47 47 CYS CB C 47 29.297 29.529 -0.232 1
1 535 . 3 1 1 A 47 47 CYS N N 47 119.663 118.821 0.842 1
1 536 . 3 1 1 A 48 48 VAL H H 48 9.083 9.082 0.001 1
1 537 . 3 1 1 A 48 48 VAL HA H 48 4.344 4.732 -0.388 1
1 542 . 3 1 1 A 48 48 VAL C C 48 173.307 174.879 -1.572 1
1 543 . 3 1 1 A 48 48 VAL CA C 48 61.368 60.801 0.567 1
1 544 . 3 1 1 A 48 48 VAL CB C 48 35.345 34.958 0.387 1
1 546 . 3 1 1 A 48 48 VAL N N 48 124.672 124.098 0.574 1
1 547 . 3 1 1 A 49 49 GLY H H 49 9.019 9.115 -0.096 1
1 548 . 3 1 1 A 49 49 GLY HA2 H 49 3.460 4.194 -0.734 1
1 549 . 3 1 1 A 49 49 GLY HA3 H 49 4.539 4.198 0.341 1
1 550 . 3 1 1 A 49 49 GLY C C 49 171.278 172.314 -1.036 1
1 551 . 3 1 1 A 49 49 GLY CA C 49 45.075 44.553 0.522 1
1 552 . 3 1 1 A 49 49 GLY N N 49 113.131 116.213 -3.082 1
1 553 . 3 1 1 A 50 50 LEU H H 50 8.747 9.164 -0.417 1
1 554 . 3 1 1 A 50 50 LEU HA H 50 5.102 4.961 0.141 1
1 564 . 3 1 1 A 50 50 LEU CA C 50 51.417 51.307 0.110 1
1 565 . 3 1 1 A 50 50 LEU CB C 50 41.754 42.271 -0.517 1
1 569 . 3 1 1 A 50 50 LEU N N 50 124.471 126.791 -2.320 1
1 570 . 3 1 1 A 51 51 PRO HA H 51 4.106 4.204 -0.098 1
1 577 . 3 1 1 A 51 51 PRO C C 51 178.422 178.593 -0.171 1
1 578 . 3 1 1 A 51 51 PRO CA C 51 65.680 65.199 0.481 1
1 579 . 3 1 1 A 51 51 PRO CB C 51 31.939 31.891 0.048 1
1 582 . 3 1 1 A 52 52 GLU H H 52 9.721 8.571 1.150 1
1 583 . 3 1 1 A 52 52 GLU HA H 52 4.176 4.088 0.088 1
1 588 . 3 1 1 A 52 52 GLU C C 52 176.146 178.499 -2.353 1
1 589 . 3 1 1 A 52 52 GLU CA C 52 59.158 58.524 0.634 1
1 590 . 3 1 1 A 52 52 GLU CB C 52 28.442 29.262 -0.820 1
1 592 . 3 1 1 A 52 52 GLU N N 52 118.552 117.560 0.992 1
1 593 . 3 1 1 A 53 53 LEU H H 53 7.089 7.732 -0.643 1
1 594 . 3 1 1 A 53 53 LEU HA H 53 4.511 4.387 0.124 1
1 603 . 3 1 1 A 53 53 LEU C C 53 174.027 176.566 -2.539 1
1 604 . 3 1 1 A 53 53 LEU CA C 53 53.825 55.616 -1.791 1
1 605 . 3 1 1 A 53 53 LEU CB C 53 43.825 42.950 0.875 1
1 608 . 3 1 1 A 53 53 LEU N N 53 116.763 120.439 -3.676 1
1 609 . 3 1 1 A 54 54 GLN H H 54 7.964 7.784 0.180 1
1 610 . 3 1 1 A 54 54 GLN HA H 54 3.591 3.897 -0.306 1
1 616 . 3 1 1 A 54 54 GLN C C 54 172.604 174.848 -2.244 1
1 617 . 3 1 1 A 54 54 GLN CA C 54 56.961 57.258 -0.297 1
1 618 . 3 1 1 A 54 54 GLN CB C 54 26.545 28.010 -1.465 1
1 620 . 3 1 1 A 54 54 GLN N N 54 115.489 119.305 -3.816 1
1 622 . 3 1 1 A 55 55 LEU H H 55 7.139 7.450 -0.311 1
1 623 . 3 1 1 A 55 55 LEU HA H 55 4.750 4.853 -0.103 1
1 629 . 3 1 1 A 55 55 LEU C C 55 173.475 174.833 -1.358 1
1 630 . 3 1 1 A 55 55 LEU CA C 55 53.698 53.495 0.203 1
1 631 . 3 1 1 A 55 55 LEU CB C 55 47.859 45.082 2.777 1
1 633 . 3 1 1 A 55 55 LEU N N 55 116.422 119.858 -3.436 1
1 634 . 3 1 1 A 56 56 ILE H H 56 8.223 8.958 -0.735 1
1 635 . 3 1 1 A 56 56 ILE HA H 56 4.540 4.954 -0.414 1
1 643 . 3 1 1 A 56 56 ILE C C 56 173.938 174.899 -0.961 1
1 644 . 3 1 1 A 56 56 ILE CA C 56 61.020 60.068 0.952 1
1 645 . 3 1 1 A 56 56 ILE CB C 56 39.403 40.220 -0.817 1
1 648 . 3 1 1 A 56 56 ILE N N 56 122.792 126.090 -3.298 1
1 649 . 3 1 1 A 57 57 CYS H H 57 8.995 8.907 0.088 1
1 650 . 3 1 1 A 57 57 CYS HA H 57 5.036 5.064 -0.028 1
1 653 . 3 1 1 A 57 57 CYS C C 57 170.483 173.265 -2.782 1
1 654 . 3 1 1 A 57 57 CYS CA C 57 56.484 58.049 -1.565 1
1 655 . 3 1 1 A 57 57 CYS CB C 57 30.545 31.533 -0.988 1
1 656 . 3 1 1 A 57 57 CYS N N 57 121.575 125.665 -4.090 1
1 657 . 3 1 1 A 58 58 LEU H H 58 9.076 9.020 0.056 1
1 658 . 3 1 1 A 58 58 LEU HA H 58 5.472 5.661 -0.189 1
1 668 . 3 1 1 A 58 58 LEU C C 58 174.009 176.179 -2.170 1
1 669 . 3 1 1 A 58 58 LEU CA C 58 52.851 53.838 -0.987 1
1 670 . 3 1 1 A 58 58 LEU CB C 58 42.177 43.389 -1.212 1
1 674 . 3 1 1 A 58 58 LEU N N 58 121.895 125.788 -3.893 1
1 675 . 3 1 1 A 59 59 VAL H H 59 8.966 8.631 0.335 1
1 676 . 3 1 1 A 59 59 VAL HA H 59 5.488 5.025 0.463 1
1 681 . 3 1 1 A 59 59 VAL C C 59 176.034 175.437 0.597 1
1 682 . 3 1 1 A 59 59 VAL CA C 59 59.820 60.861 -1.041 1
1 683 . 3 1 1 A 59 59 VAL CB C 59 34.786 34.866 -0.080 1
1 685 . 3 1 1 A 59 59 VAL N N 59 121.702 124.110 -2.408 1
1 686 . 3 1 1 A 60 60 GLY H H 60 9.258 8.748 0.510 1
1 687 . 3 1 1 A 60 60 GLY HA2 H 60 4.673 4.339 0.334 1
1 688 . 3 1 1 A 60 60 GLY HA3 H 60 4.804 4.419 0.385 1
1 689 . 3 1 1 A 60 60 GLY C C 60 169.831 172.774 -2.943 1
1 690 . 3 1 1 A 60 60 GLY CA C 60 46.399 45.348 1.051 1
1 691 . 3 1 1 A 60 60 GLY N N 60 114.126 113.388 0.738 1
1 692 . 3 1 1 A 61 61 THR H H 61 8.834 8.346 0.488 1
1 693 . 3 1 1 A 61 61 THR HA H 61 4.418 5.016 -0.598 1
1 698 . 3 1 1 A 61 61 THR C C 61 171.985 174.915 -2.930 1
1 699 . 3 1 1 A 61 61 THR CA C 61 60.634 60.469 0.165 1
1 700 . 3 1 1 A 61 61 THR CB C 61 70.983 70.376 0.607 1
1 702 . 3 1 1 A 61 61 THR N N 61 114.856 110.823 4.033 1
1 703 . 3 1 1 A 62 62 GLU H H 62 8.502 8.727 -0.225 1
1 704 . 3 1 1 A 62 62 GLU HA H 62 2.867 3.787 -0.920 1
1 709 . 3 1 1 A 62 62 GLU C C 62 174.650 176.169 -1.519 1
1 710 . 3 1 1 A 62 62 GLU CA C 62 58.785 58.387 0.398 1
1 711 . 3 1 1 A 62 62 GLU CB C 62 28.981 29.917 -0.936 1
1 713 . 3 1 1 A 62 62 GLU N N 62 129.915 123.970 5.945 1
1 714 . 3 1 1 A 63 63 ILE H H 63 6.928 7.871 -0.943 1
1 715 . 3 1 1 A 63 63 ILE HA H 63 4.038 4.293 -0.255 1
1 725 . 3 1 1 A 63 63 ILE C C 63 173.482 174.802 -1.320 1
1 726 . 3 1 1 A 63 63 ILE CA C 63 58.664 60.699 -2.035 1
1 727 . 3 1 1 A 63 63 ILE CB C 63 40.009 39.911 0.098 1
1 731 . 3 1 1 A 63 63 ILE N N 63 117.075 118.100 -1.025 1
1 732 . 3 1 1 A 64 64 GLU H H 64 8.585 8.501 0.084 1
1 733 . 3 1 1 A 64 64 GLU HA H 64 3.427 3.846 -0.419 1
1 738 . 3 1 1 A 64 64 GLU C C 64 175.186 177.260 -2.074 1
1 739 . 3 1 1 A 64 64 GLU CA C 64 58.703 58.185 0.518 1
1 740 . 3 1 1 A 64 64 GLU CB C 64 28.999 29.339 -0.340 1
1 742 . 3 1 1 A 64 64 GLU N N 64 126.422 128.214 -1.792 1
1 743 . 3 1 1 A 65 65 GLY H H 65 8.754 8.929 -0.175 1
1 744 . 3 1 1 A 65 65 GLY HA2 H 65 3.631 3.923 -0.292 1
1 745 . 3 1 1 A 65 65 GLY HA3 H 65 4.287 3.940 0.347 1
1 746 . 3 1 1 A 65 65 GLY C C 65 174.005 174.822 -0.817 1
1 747 . 3 1 1 A 65 65 GLY CA C 65 44.954 45.394 -0.440 1
1 748 . 3 1 1 A 65 65 GLY N N 65 114.614 115.163 -0.549 1
1 749 . 3 1 1 A 66 66 GLU H H 66 7.760 8.065 -0.305 1
1 750 . 3 1 1 A 66 66 GLU HA H 66 4.462 4.392 0.070 1
1 754 . 3 1 1 A 66 66 GLU C C 66 175.255 176.643 -1.388 1
1 755 . 3 1 1 A 66 66 GLU CA C 66 55.582 56.150 -0.568 1
1 756 . 3 1 1 A 66 66 GLU CB C 66 30.654 29.877 0.777 1
1 758 . 3 1 1 A 66 66 GLU N N 66 119.292 120.035 -0.743 1
1 759 . 3 1 1 A 67 67 GLY H H 67 8.262 7.961 0.301 1
1 760 . 3 1 1 A 67 67 GLY HA2 H 67 3.875 3.796 0.079 1
1 761 . 3 1 1 A 67 67 GLY HA3 H 67 4.088 3.828 0.260 1
1 762 . 3 1 1 A 67 67 GLY C C 67 172.197 173.590 -1.393 1
1 763 . 3 1 1 A 67 67 GLY CA C 67 44.845 46.266 -1.421 1
1 764 . 3 1 1 A 67 67 GLY N N 67 106.161 108.743 -2.582 1
1 765 . 3 1 1 A 68 68 LEU H H 68 8.142 8.229 -0.087 1
1 766 . 3 1 1 A 68 68 LEU HA H 68 4.491 4.713 -0.222 1
1 775 . 3 1 1 A 68 68 LEU C C 68 176.194 174.753 1.441 1
1 776 . 3 1 1 A 68 68 LEU CA C 68 55.123 54.626 0.497 1
1 777 . 3 1 1 A 68 68 LEU CB C 68 44.527 43.365 1.162 1
1 780 . 3 1 1 A 68 68 LEU N N 68 120.269 125.898 -5.629 1
1 781 . 3 1 1 A 69 69 GLN H H 69 9.253 8.369 0.884 1
1 782 . 3 1 1 A 69 69 GLN HA H 69 4.770 4.631 0.139 1
1 788 . 3 1 1 A 69 69 GLN C C 69 173.607 173.842 -0.235 1
1 789 . 3 1 1 A 69 69 GLN CA C 69 54.736 55.793 -1.057 1
1 790 . 3 1 1 A 69 69 GLN CB C 69 33.782 31.618 2.164 1
1 792 . 3 1 1 A 69 69 GLN N N 69 119.336 124.263 -4.927 1
1 794 . 3 1 1 A 70 70 THR H H 70 8.803 8.875 -0.072 1
1 795 . 3 1 1 A 70 70 THR HA H 70 5.033 5.172 -0.139 1
1 800 . 3 1 1 A 70 70 THR C C 70 172.596 174.016 -1.420 1
1 801 . 3 1 1 A 70 70 THR CA C 70 62.768 61.687 1.081 1
1 802 . 3 1 1 A 70 70 THR CB C 70 69.990 71.609 -1.619 1
1 804 . 3 1 1 A 70 70 THR N N 70 118.372 121.059 -2.687 1
1 805 . 3 1 1 A 71 71 VAL H H 71 9.882 9.415 0.467 1
1 806 . 3 1 1 A 71 71 VAL HA H 71 5.239 5.771 -0.532 1
1 811 . 3 1 1 A 71 71 VAL C C 71 174.015 174.439 -0.424 1
1 812 . 3 1 1 A 71 71 VAL CA C 71 60.577 59.826 0.751 1
1 813 . 3 1 1 A 71 71 VAL CB C 71 34.149 34.611 -0.462 1
1 815 . 3 1 1 A 71 71 VAL N N 71 129.063 121.386 7.677 1
1 816 . 3 1 1 A 72 72 VAL H H 72 9.491 8.652 0.839 1
1 817 . 3 1 1 A 72 72 VAL HA H 72 4.672 4.878 -0.206 1
1 825 . 3 1 1 A 72 72 VAL CA C 72 59.568 58.166 1.402 1
1 826 . 3 1 1 A 72 72 VAL CB C 72 34.057 34.845 -0.788 1
1 829 . 3 1 1 A 72 72 VAL N N 72 128.521 124.100 4.421 1
1 830 . 3 1 1 A 73 73 PRO HA H 73 5.368 4.561 0.807 1
1 836 . 3 1 1 A 73 73 PRO C C 73 175.079 176.195 -1.116 1
1 837 . 3 1 1 A 73 73 PRO CA C 73 61.324 63.005 -1.681 1
1 838 . 3 1 1 A 73 73 PRO CB C 73 33.089 32.338 0.751 1
1 841 . 3 1 1 A 74 74 THR H H 74 9.103 8.692 0.411 1
1 842 . 3 1 1 A 74 74 THR HA H 74 5.191 4.844 0.347 1
1 847 . 3 1 1 A 74 74 THR CA C 74 57.986 59.333 -1.347 1
1 848 . 3 1 1 A 74 74 THR CB C 74 72.212 72.655 -0.443 1
1 850 . 3 1 1 A 74 74 THR N N 74 118.075 118.055 0.020 1
1 851 . 3 1 1 A 75 75 PRO HA H 75 5.015 4.678 0.337 1
1 858 . 3 1 1 A 75 75 PRO C C 75 178.704 177.605 1.099 1
1 859 . 3 1 1 A 75 75 PRO CA C 75 63.038 62.614 0.424 1
1 860 . 3 1 1 A 75 75 PRO CB C 75 32.529 32.698 -0.169 1
1 863 . 3 1 1 A 76 76 ILE H H 76 8.221 8.780 -0.559 1
1 864 . 3 1 1 A 76 76 ILE HA H 76 4.218 4.024 0.194 1
1 873 . 3 1 1 A 76 76 ILE C C 76 172.375 176.944 -4.569 1
1 874 . 3 1 1 A 76 76 ILE CA C 76 63.509 63.198 0.311 1
1 875 . 3 1 1 A 76 76 ILE CB C 76 39.322 38.227 1.095 1
1 879 . 3 1 1 A 76 76 ILE N N 76 122.273 123.678 -1.405 1
1 880 . 3 1 1 A 77 77 THR H H 77 6.984 7.666 -0.682 1
1 881 . 3 1 1 A 77 77 THR HA H 77 4.227 4.432 -0.205 1
1 886 . 3 1 1 A 77 77 THR C C 77 173.531 174.133 -0.602 1
1 887 . 3 1 1 A 77 77 THR CA C 77 61.435 62.360 -0.925 1
1 888 . 3 1 1 A 77 77 THR CB C 77 68.944 69.164 -0.220 1
1 890 . 3 1 1 A 77 77 THR N N 77 105.803 114.689 -8.886 1
1 891 . 3 1 1 A 78 78 ALA H H 78 7.647 7.261 0.386 1
1 892 . 3 1 1 A 78 78 ALA HA H 78 4.757 4.681 0.076 1
1 896 . 3 1 1 A 78 78 ALA C C 78 173.520 176.417 -2.897 1
1 897 . 3 1 1 A 78 78 ALA CA C 78 51.164 50.809 0.355 1
1 898 . 3 1 1 A 78 78 ALA CB C 78 20.011 22.034 -2.023 1
1 899 . 3 1 1 A 78 78 ALA N N 78 126.635 124.152 2.483 1
1 900 . 3 1 1 A 79 79 SER H H 79 7.884 8.857 -0.973 1
1 901 . 3 1 1 A 79 79 SER HA H 79 4.386 5.441 -1.055 1
1 903 . 3 1 1 A 79 79 SER C C 79 176.077 172.573 3.504 1
1 904 . 3 1 1 A 79 79 SER CA C 79 57.465 56.313 1.152 1
1 905 . 3 1 1 A 79 79 SER CB C 79 65.285 65.711 -0.426 1
1 906 . 3 1 1 A 79 79 SER N N 79 115.272 113.148 2.124 1
1 907 . 3 1 1 A 80 80 LEU H H 80 7.700 8.599 -0.899 1
1 908 . 3 1 1 A 80 80 LEU HA H 80 4.912 4.696 0.216 1
1 915 . 3 1 1 A 80 80 LEU C C 80 173.927 175.174 -1.247 1
1 916 . 3 1 1 A 80 80 LEU CA C 80 53.829 54.519 -0.690 1
1 917 . 3 1 1 A 80 80 LEU CB C 80 45.990 43.893 2.097 1
1 920 . 3 1 1 A 80 80 LEU N N 80 121.507 126.981 -5.474 1
1 921 . 3 1 1 A 81 81 SER H H 81 7.885 8.765 -0.880 1
1 922 . 3 1 1 A 81 81 SER HA H 81 5.269 4.844 0.425 1
1 925 . 3 1 1 A 81 81 SER C C 81 175.756 174.592 1.164 1
1 926 . 3 1 1 A 81 81 SER CA C 81 55.507 57.072 -1.565 1
1 927 . 3 1 1 A 81 81 SER CB C 81 65.966 65.471 0.495 1
1 928 . 3 1 1 A 81 81 SER N N 81 118.323 117.288 1.035 1
1 929 . 3 1 1 A 82 82 HIS H H 82 8.935 9.037 -0.102 1
1 930 . 3 1 1 A 82 82 HIS HA H 82 4.407 4.169 0.238 1
1 932 . 3 1 1 A 82 82 HIS C C 82 176.550 176.643 -0.093 1
1 933 . 3 1 1 A 82 82 HIS CA C 82 60.960 60.763 0.197 1
1 934 . 3 1 1 A 82 82 HIS CB C 82 30.755 30.205 0.550 1
1 935 . 3 1 1 A 82 82 HIS N N 82 124.042 121.626 2.416 1
1 936 . 3 1 1 A 83 83 ASN H H 83 8.435 8.618 -0.183 1
1 937 . 3 1 1 A 83 83 ASN HA H 83 4.439 4.130 0.309 1
1 941 . 3 1 1 A 83 83 ASN C C 83 174.769 177.375 -2.606 1
1 942 . 3 1 1 A 83 83 ASN CA C 83 56.575 56.590 -0.015 1
1 943 . 3 1 1 A 83 83 ASN CB C 83 38.731 39.136 -0.405 1
1 944 . 3 1 1 A 83 83 ASN N N 83 118.543 116.793 1.750 1
1 946 . 3 1 1 A 84 84 ARG H H 84 7.716 7.916 -0.200 1
1 947 . 3 1 1 A 84 84 ARG HA H 84 4.183 4.050 0.133 1
1 953 . 3 1 1 A 84 84 ARG C C 84 177.399 178.116 -0.717 1
1 954 . 3 1 1 A 84 84 ARG CA C 84 59.045 58.877 0.168 1
1 955 . 3 1 1 A 84 84 ARG CB C 84 29.992 29.830 0.162 1
1 957 . 3 1 1 A 84 84 ARG N N 84 121.312 117.799 3.513 1
1 958 . 3 1 1 A 85 85 ILE H H 85 8.354 7.899 0.455 1
1 959 . 3 1 1 A 85 85 ILE HA H 85 3.650 3.774 -0.124 1
1 967 . 3 1 1 A 85 85 ILE C C 85 176.098 177.991 -1.893 1
1 968 . 3 1 1 A 85 85 ILE CA C 85 66.704 64.379 2.325 1
1 969 . 3 1 1 A 85 85 ILE CB C 85 38.017 37.733 0.284 1
1 972 . 3 1 1 A 85 85 ILE N N 85 119.321 116.826 2.495 1
1 973 . 3 1 1 A 86 86 ARG H H 86 7.690 7.862 -0.172 1
1 974 . 3 1 1 A 86 86 ARG HA H 86 3.704 3.819 -0.115 1
1 981 . 3 1 1 A 86 86 ARG C C 86 177.524 178.520 -0.996 1
1 982 . 3 1 1 A 86 86 ARG CA C 86 59.881 59.663 0.218 1
1 983 . 3 1 1 A 86 86 ARG CB C 86 29.248 29.766 -0.518 1
1 986 . 3 1 1 A 86 86 ARG N N 86 118.362 121.782 -3.420 1
1 987 . 3 1 1 A 87 87 GLU H H 87 7.884 7.993 -0.109 1
1 988 . 3 1 1 A 87 87 GLU HA H 87 4.064 4.073 -0.009 1
1 993 . 3 1 1 A 87 87 GLU C C 87 178.785 178.523 0.262 1
1 994 . 3 1 1 A 87 87 GLU CA C 87 58.999 58.898 0.101 1
1 995 . 3 1 1 A 87 87 GLU CB C 87 29.872 29.247 0.625 1
1 997 . 3 1 1 A 87 87 GLU N N 87 118.124 116.990 1.134 1
1 998 . 3 1 1 A 88 88 ILE H H 88 8.715 7.749 0.966 1
1 999 . 3 1 1 A 88 88 ILE HA H 88 3.305 3.474 -0.169 1
1 1009 . 3 1 1 A 88 88 ILE C C 88 177.261 177.785 -0.524 1
1 1010 . 3 1 1 A 88 88 ILE CA C 88 65.822 65.539 0.283 1
1 1011 . 3 1 1 A 88 88 ILE CB C 88 37.370 37.257 0.113 1
1 1015 . 3 1 1 A 88 88 ILE N N 88 122.929 121.367 1.562 1
1 1016 . 3 1 1 A 89 89 LEU H H 89 8.486 8.339 0.147 1
1 1017 . 3 1 1 A 89 89 LEU HA H 89 3.932 3.801 0.131 1
1 1023 . 3 1 1 A 89 89 LEU C C 89 177.919 178.891 -0.972 1
1 1024 . 3 1 1 A 89 89 LEU CA C 89 59.060 58.057 1.003 1
1 1025 . 3 1 1 A 89 89 LEU CB C 89 41.129 41.325 -0.196 1
1 1028 . 3 1 1 A 89 89 LEU N N 89 122.696 120.014 2.682 1
1 1029 . 3 1 1 A 90 90 LYS H H 90 7.790 7.776 0.014 1
1 1030 . 3 1 1 A 90 90 LYS HA H 90 4.061 3.925 0.136 1
1 1035 . 3 1 1 A 90 90 LYS C C 90 178.432 178.679 -0.247 1
1 1036 . 3 1 1 A 90 90 LYS CA C 90 59.840 59.389 0.451 1
1 1037 . 3 1 1 A 90 90 LYS CB C 90 32.582 32.158 0.424 1
1 1039 . 3 1 1 A 90 90 LYS N N 90 118.640 120.139 -1.499 1
1 1040 . 3 1 1 A 91 91 ALA H H 91 8.113 8.155 -0.042 1
1 1041 . 3 1 1 A 91 91 ALA HA H 91 4.151 4.102 0.049 1
1 1045 . 3 1 1 A 91 91 ALA C C 91 179.147 179.699 -0.552 1
1 1046 . 3 1 1 A 91 91 ALA CA C 91 54.942 55.247 -0.305 1
1 1047 . 3 1 1 A 91 91 ALA CB C 91 18.242 18.442 -0.200 1
1 1048 . 3 1 1 A 91 91 ALA N N 91 122.939 121.622 1.317 1
1 1049 . 3 1 1 A 92 92 SER H H 92 8.858 8.388 0.470 1
1 1050 . 3 1 1 A 92 92 SER HA H 92 4.898 4.101 0.797 1
1 1052 . 3 1 1 A 92 92 SER C C 92 172.440 176.563 -4.123 1
1 1053 . 3 1 1 A 92 92 SER CA C 92 61.913 61.820 0.093 1
1 1054 . 3 1 1 A 92 92 SER CB C 92 63.081 62.774 0.307 1
1 1055 . 3 1 1 A 92 92 SER N N 92 114.526 113.558 0.968 1
1 1056 . 3 1 1 A 93 93 ARG H H 93 7.704 8.609 -0.905 1
1 1057 . 3 1 1 A 93 93 ARG HA H 93 4.162 4.053 0.109 1
1 1059 . 3 1 1 A 93 93 ARG C C 93 177.757 178.577 -0.820 1
1 1060 . 3 1 1 A 93 93 ARG CA C 93 59.544 58.981 0.563 1
1 1061 . 3 1 1 A 93 93 ARG CB C 93 30.343 29.998 0.345 1
1 1062 . 3 1 1 A 93 93 ARG N N 93 121.505 119.930 1.575 1
1 1063 . 3 1 1 A 94 94 LYS H H 94 7.456 7.671 -0.215 1
1 1064 . 3 1 1 A 94 94 LYS HA H 94 4.174 4.080 0.094 1
1 1071 . 3 1 1 A 94 94 LYS C C 94 178.861 179.078 -0.217 1
1 1072 . 3 1 1 A 94 94 LYS CA C 94 59.030 59.355 -0.325 1
1 1073 . 3 1 1 A 94 94 LYS CB C 94 32.239 32.038 0.201 1
1 1077 . 3 1 1 A 94 94 LYS N N 94 119.072 119.403 -0.331 1
1 1078 . 3 1 1 A 95 95 LEU H H 95 8.148 7.751 0.397 1
1 1079 . 3 1 1 A 95 95 LEU HA H 95 4.129 4.127 0.002 1
1 1088 . 3 1 1 A 95 95 LEU C C 95 177.274 178.175 -0.901 1
1 1089 . 3 1 1 A 95 95 LEU CA C 95 57.136 56.924 0.212 1
1 1090 . 3 1 1 A 95 95 LEU CB C 95 41.908 41.521 0.387 1
1 1093 . 3 1 1 A 95 95 LEU N N 95 119.717 116.895 2.822 1
1 1094 . 3 1 1 A 96 96 GLN H H 96 7.807 7.937 -0.130 1
1 1095 . 3 1 1 A 96 96 GLN HA H 96 4.242 4.282 -0.040 1
1 1102 . 3 1 1 A 96 96 GLN C C 96 175.371 176.901 -1.530 1
1 1103 . 3 1 1 A 96 96 GLN CA C 96 56.397 54.907 1.490 1
1 1104 . 3 1 1 A 96 96 GLN CB C 96 29.123 28.336 0.787 1
1 1106 . 3 1 1 A 96 96 GLN N N 96 114.581 116.308 -1.727 1
1 1108 . 3 1 1 A 97 97 GLY H H 97 7.802 8.080 -0.278 1
1 1109 . 3 1 1 A 97 97 GLY HA2 H 97 3.839 3.910 -0.071 1
1 1110 . 3 1 1 A 97 97 GLY HA3 H 97 4.096 3.910 0.186 1
1 1111 . 3 1 1 A 97 97 GLY C C 97 172.636 173.857 -1.221 1
1 1112 . 3 1 1 A 97 97 GLY CA C 97 46.372 46.120 0.252 1
1 1113 . 3 1 1 A 97 97 GLY N N 97 106.959 111.151 -4.192 1
1 1114 . 3 1 1 A 98 98 ASP H H 98 8.156 7.899 0.257 1
1 1115 . 3 1 1 A 98 98 ASP HA H 98 4.754 5.052 -0.298 1
1 1118 . 3 1 1 A 98 98 ASP CA C 98 52.882 50.745 2.137 1
1 1119 . 3 1 1 A 98 98 ASP CB C 98 41.603 41.660 -0.057 1
1 1120 . 3 1 1 A 98 98 ASP N N 98 118.447 121.082 -2.635 1
1 1121 . 3 1 1 A 99 99 PRO HA H 99 4.470 4.546 -0.076 1
1 1126 . 3 1 1 A 99 99 PRO C C 99 175.500 176.727 -1.227 1
1 1127 . 3 1 1 A 99 99 PRO CA C 99 63.601 62.279 1.322 1
1 1128 . 3 1 1 A 99 99 PRO CB C 99 32.423 33.004 -0.581 1
1 1130 . 3 1 1 A 100 100 ASP H H 100 8.527 8.838 -0.311 1
1 1131 . 3 1 1 A 100 100 ASP HA H 100 4.778 4.594 0.184 1
1 1134 . 3 1 1 A 100 100 ASP C C 100 174.931 175.043 -0.112 1
1 1135 . 3 1 1 A 100 100 ASP CA C 100 53.915 54.850 -0.935 1
1 1136 . 3 1 1 A 100 100 ASP CB C 100 40.665 39.984 0.681 1
1 1137 . 3 1 1 A 100 100 ASP N N 100 119.340 120.367 -1.027 1
1 1138 . 3 1 1 A 101 101 LEU H H 101 7.379 8.183 -0.804 1
1 1139 . 3 1 1 A 101 101 LEU HA H 101 4.682 4.822 -0.140 1
1 1148 . 3 1 1 A 101 101 LEU CA C 101 52.956 52.214 0.742 1
1 1149 . 3 1 1 A 101 101 LEU CB C 101 43.393 42.422 0.971 1
1 1152 . 3 1 1 A 101 101 LEU N N 101 122.107 115.513 6.594 1
1 1153 . 3 1 1 A 102 102 PRO HA H 102 4.487 4.762 -0.275 1
1 1158 . 3 1 1 A 102 102 PRO C C 102 175.697 176.019 -0.322 1
1 1159 . 3 1 1 A 102 102 PRO CA C 102 63.113 62.575 0.538 1
1 1160 . 3 1 1 A 102 102 PRO CB C 102 32.138 31.790 0.348 1
1 1163 . 3 1 1 A 103 103 MET H H 103 9.011 8.830 0.181 1
1 1164 . 3 1 1 A 103 103 MET HA H 103 4.769 4.904 -0.135 1
1 1171 . 3 1 1 A 103 103 MET C C 103 174.080 173.873 0.207 1
1 1172 . 3 1 1 A 103 103 MET CA C 103 54.737 53.290 1.447 1
1 1173 . 3 1 1 A 103 103 MET CB C 103 34.857 35.161 -0.304 1
1 1176 . 3 1 1 A 103 103 MET N N 103 123.334 122.720 0.614 1
1 1177 . 3 1 1 A 104 104 SER H H 104 8.239 8.952 -0.713 1
1 1178 . 3 1 1 A 104 104 SER HA H 104 5.079 5.294 -0.215 1
1 1181 . 3 1 1 A 104 104 SER C C 104 171.795 172.332 -0.537 1
1 1182 . 3 1 1 A 104 104 SER CA C 104 57.641 56.468 1.173 1
1 1183 . 3 1 1 A 104 104 SER CB C 104 66.282 66.155 0.127 1
1 1184 . 3 1 1 A 104 104 SER N N 104 114.434 116.481 -2.047 1
1 1185 . 3 1 1 A 105 105 PHE H H 105 9.003 8.524 0.479 1
1 1186 . 3 1 1 A 105 105 PHE HA H 105 5.209 5.329 -0.120 1
1 1193 . 3 1 1 A 105 105 PHE C C 105 170.688 172.129 -1.441 1
1 1194 . 3 1 1 A 105 105 PHE CA C 105 56.917 55.964 0.953 1
1 1195 . 3 1 1 A 105 105 PHE CB C 105 41.350 41.099 0.251 1
1 1196 . 3 1 1 A 105 105 PHE N N 105 116.224 119.037 -2.813 1
1 1197 . 3 1 1 A 106 106 THR H H 106 9.074 9.282 -0.208 1
1 1198 . 3 1 1 A 106 106 THR HA H 106 4.664 4.894 -0.230 1
1 1203 . 3 1 1 A 106 106 THR C C 106 171.767 174.445 -2.678 1
1 1204 . 3 1 1 A 106 106 THR CA C 106 62.162 61.570 0.592 1
1 1205 . 3 1 1 A 106 106 THR CB C 106 70.072 70.104 -0.032 1
1 1207 . 3 1 1 A 106 106 THR N N 106 117.469 116.036 1.433 1
1 1208 . 3 1 1 A 107 107 LEU H H 107 9.804 9.168 0.636 1
1 1209 . 3 1 1 A 107 107 LEU HA H 107 4.750 4.798 -0.048 1
1 1219 . 3 1 1 A 107 107 LEU C C 107 172.742 176.567 -3.825 1
1 1220 . 3 1 1 A 107 107 LEU CA C 107 54.151 54.571 -0.420 1
1 1221 . 3 1 1 A 107 107 LEU CB C 107 44.486 42.673 1.813 1
1 1224 . 3 1 1 A 107 107 LEU N N 107 133.400 128.566 4.834 1
1 1225 . 3 1 1 A 108 108 ALA H H 108 8.435 8.688 -0.253 1
1 1226 . 3 1 1 A 108 108 ALA HA H 108 4.683 4.936 -0.253 1
1 1230 . 3 1 1 A 108 108 ALA C C 108 173.052 175.317 -2.265 1
1 1231 . 3 1 1 A 108 108 ALA CA C 108 49.308 50.252 -0.944 1
1 1232 . 3 1 1 A 108 108 ALA CB C 108 22.120 20.182 1.938 1
1 1233 . 3 1 1 A 108 108 ALA N N 108 131.422 124.845 6.577 1
1 1234 . 3 1 1 A 109 109 ILE H H 109 8.909 9.409 -0.500 1
1 1235 . 3 1 1 A 109 109 ILE HA H 109 4.063 5.445 -1.382 1
1 1245 . 3 1 1 A 109 109 ILE CA C 109 60.982 60.005 0.977 1
1 1246 . 3 1 1 A 109 109 ILE CB C 109 39.074 39.346 -0.272 1
1 1250 . 3 1 1 A 109 109 ILE N N 109 124.415 123.740 0.675 1
1 1251 . 3 1 1 A 110 110 VAL H H 110 8.706 9.049 -0.343 1
1 1252 . 3 1 1 A 110 110 VAL HA H 110 4.324 5.145 -0.821 1
1 1260 . 3 1 1 A 110 110 VAL C C 110 175.700 174.649 1.051 1
1 1261 . 3 1 1 A 110 110 VAL CA C 110 62.316 60.533 1.783 1
1 1262 . 3 1 1 A 110 110 VAL CB C 110 31.876 33.675 -1.799 1
1 1264 . 3 1 1 A 110 110 VAL N N 110 127.457 123.960 3.497 1
1 1265 . 3 1 1 A 111 111 GLU H H 111 9.024 8.936 0.088 1
1 1266 . 3 1 1 A 111 111 GLU HA H 111 4.403 4.369 0.034 1
1 1269 . 3 1 1 A 111 111 GLU C C 111 175.987 177.654 -1.667 1
1 1270 . 3 1 1 A 111 111 GLU CA C 111 56.842 56.413 0.429 1
1 1271 . 3 1 1 A 111 111 GLU CB C 111 31.044 31.383 -0.339 1
1 1272 . 3 1 1 A 111 111 GLU N N 111 129.768 127.413 2.355 1
1 1273 . 3 1 1 A 112 112 SER H H 112 9.143 8.818 0.325 1
1 1274 . 3 1 1 A 112 112 SER HA H 112 4.394 4.133 0.261 1
1 1276 . 3 1 1 A 112 112 SER C C 112 173.187 176.244 -3.057 1
1 1277 . 3 1 1 A 112 112 SER CA C 112 60.180 61.697 -1.517 1
1 1278 . 3 1 1 A 112 112 SER CB C 112 63.415 62.995 0.420 1
1 1279 . 3 1 1 A 112 112 SER N N 112 115.956 119.952 -3.996 1
1 1280 . 3 1 1 A 113 113 ASP H H 113 8.133 8.123 0.010 1
1 1281 . 3 1 1 A 113 113 ASP HA H 113 4.573 4.447 0.126 1
1 1284 . 3 1 1 A 113 113 ASP C C 113 175.430 176.170 -0.740 1
1 1285 . 3 1 1 A 113 113 ASP CA C 113 54.115 56.693 -2.578 1
1 1286 . 3 1 1 A 113 113 ASP CB C 113 40.011 41.545 -1.534 1
1 1287 . 3 1 1 A 113 113 ASP N N 113 118.343 122.436 -4.093 1
1 1288 . 3 1 1 A 114 114 SER H H 114 8.034 7.622 0.412 1
1 1289 . 3 1 1 A 114 114 SER HA H 114 4.057 4.664 -0.607 1
1 1291 . 3 1 1 A 114 114 SER C C 114 172.209 173.729 -1.520 1
1 1292 . 3 1 1 A 114 114 SER CA C 114 60.179 57.603 2.576 1
1 1293 . 3 1 1 A 114 114 SER CB C 114 62.702 64.665 -1.963 1
1 1294 . 3 1 1 A 114 114 SER N N 114 109.836 113.608 -3.772 1
1 1295 . 3 1 1 A 115 115 THR H H 115 7.711 7.769 -0.058 1
1 1296 . 3 1 1 A 115 115 THR HA H 115 4.250 4.403 -0.153 1
1 1300 . 3 1 1 A 115 115 THR C C 115 171.500 173.882 -2.382 1
1 1301 . 3 1 1 A 115 115 THR CA C 115 63.547 62.239 1.308 1
1 1302 . 3 1 1 A 115 115 THR CB C 115 69.595 69.856 -0.261 1
1 1303 . 3 1 1 A 115 115 THR N N 115 117.407 115.924 1.483 1
1 1304 . 3 1 1 A 116 116 ILE H H 116 8.219 9.034 -0.815 1
1 1305 . 3 1 1 A 116 116 ILE HA H 116 4.769 4.702 0.067 1
1 1315 . 3 1 1 A 116 116 ILE C C 116 174.434 175.022 -0.588 1
1 1316 . 3 1 1 A 116 116 ILE CA C 116 60.306 60.420 -0.114 1
1 1317 . 3 1 1 A 116 116 ILE CB C 116 40.686 38.120 2.566 1
1 1321 . 3 1 1 A 116 116 ILE N N 116 125.480 129.158 -3.678 1
1 1322 . 3 1 1 A 117 117 VAL H H 117 8.695 9.355 -0.660 1
1 1323 . 3 1 1 A 117 117 VAL HA H 117 4.315 4.679 -0.364 1
1 1328 . 3 1 1 A 117 117 VAL C C 117 172.243 174.486 -2.243 1
1 1329 . 3 1 1 A 117 117 VAL CA C 117 60.621 60.797 -0.176 1
1 1330 . 3 1 1 A 117 117 VAL CB C 117 34.558 34.428 0.130 1
1 1332 . 3 1 1 A 117 117 VAL N N 117 127.887 127.378 0.509 1
1 1333 . 3 1 1 A 118 118 TYR H H 118 8.270 8.733 -0.463 1
1 1334 . 3 1 1 A 118 118 TYR HA H 118 5.327 5.241 0.086 1
1 1342 . 3 1 1 A 118 118 TYR C C 118 174.250 175.024 -0.774 1
1 1343 . 3 1 1 A 118 118 TYR CA C 118 57.283 57.423 -0.140 1
1 1344 . 3 1 1 A 118 118 TYR CB C 118 39.262 40.157 -0.895 1
1 1345 . 3 1 1 A 118 118 TYR N N 118 124.822 126.859 -2.037 1
1 1346 . 3 1 1 A 119 119 TYR H H 119 9.207 9.412 -0.205 1
1 1347 . 3 1 1 A 119 119 TYR HA H 119 4.821 5.216 -0.395 1
1 1354 . 3 1 1 A 119 119 TYR C C 119 171.994 173.267 -1.273 1
1 1355 . 3 1 1 A 119 119 TYR CA C 119 58.116 57.395 0.721 1
1 1356 . 3 1 1 A 119 119 TYR CB C 119 43.544 41.937 1.607 1
1 1357 . 3 1 1 A 119 119 TYR N N 119 125.153 123.752 1.401 1
1 1358 . 3 1 1 A 120 120 LYS H H 120 7.700 8.584 -0.884 1
1 1359 . 3 1 1 A 120 120 LYS HA H 120 4.558 4.552 0.006 1
1 1366 . 3 1 1 A 120 120 LYS C C 120 172.017 174.856 -2.839 1
1 1367 . 3 1 1 A 120 120 LYS CA C 120 57.217 55.618 1.599 1
1 1368 . 3 1 1 A 120 120 LYS CB C 120 33.914 33.601 0.313 1
1 1372 . 3 1 1 A 120 120 LYS N N 120 129.442 129.163 0.279 1
1 1373 . 3 1 1 A 121 121 LEU H H 121 8.112 8.717 -0.605 1
1 1374 . 3 1 1 A 121 121 LEU HA H 121 5.323 5.055 0.268 1
1 1384 . 3 1 1 A 121 121 LEU C C 121 175.733 174.527 1.206 1
1 1385 . 3 1 1 A 121 121 LEU CA C 121 52.716 52.958 -0.242 1
1 1386 . 3 1 1 A 121 121 LEU CB C 121 44.098 45.031 -0.933 1
1 1389 . 3 1 1 A 121 121 LEU N N 121 123.403 128.009 -4.606 1
1 1390 . 3 1 1 A 122 122 THR H H 122 8.338 9.054 -0.716 1
1 1391 . 3 1 1 A 122 122 THR HA H 122 5.097 4.850 0.247 1
1 1396 . 3 1 1 A 122 122 THR C C 122 173.221 172.208 1.013 1
1 1397 . 3 1 1 A 122 122 THR CA C 122 60.306 62.084 -1.778 1
1 1398 . 3 1 1 A 122 122 THR CB C 122 72.473 70.418 2.055 1
1 1400 . 3 1 1 A 122 122 THR N N 122 109.081 122.723 -13.642 1
1 7 . 4 1 1 A 2 2 GLU H H 2 8.994 8.900 0.094 1
1 8 . 4 1 1 A 2 2 GLU HA H 2 4.278 4.370 -0.092 1
1 13 . 4 1 1 A 2 2 GLU C C 2 175.315 176.253 -0.938 1
1 14 . 4 1 1 A 2 2 GLU CA C 2 57.318 57.972 -0.654 1
1 15 . 4 1 1 A 2 2 GLU CB C 2 29.221 30.892 -1.671 1
1 17 . 4 1 1 A 2 2 GLU N N 2 122.259 122.856 -0.597 1
1 18 . 4 1 1 A 3 3 ASP H H 3 8.048 7.732 0.316 1
1 19 . 4 1 1 A 3 3 ASP HA H 3 4.580 4.710 -0.130 1
1 21 . 4 1 1 A 3 3 ASP C C 3 175.636 175.839 -0.203 1
1 22 . 4 1 1 A 3 3 ASP CA C 3 54.579 53.098 1.481 1
1 23 . 4 1 1 A 3 3 ASP CB C 3 40.984 39.479 1.505 1
1 24 . 4 1 1 A 3 3 ASP N N 3 119.830 119.830 0.000 1
1 25 . 4 1 1 A 4 4 ALA H H 4 8.090 6.895 1.195 1
1 26 . 4 1 1 A 4 4 ALA HA H 4 4.216 4.778 -0.562 1
1 30 . 4 1 1 A 4 4 ALA C C 4 177.157 177.676 -0.519 1
1 31 . 4 1 1 A 4 4 ALA CA C 4 53.620 50.454 3.166 1
1 32 . 4 1 1 A 4 4 ALA CB C 4 18.728 19.254 -0.526 1
1 33 . 4 1 1 A 4 4 ALA N N 4 123.957 126.454 -2.497 1
1 34 . 4 1 1 A 5 5 TRP H H 5 7.941 7.434 0.507 1
1 35 . 4 1 1 A 5 5 TRP HA H 5 4.559 4.519 0.040 1
1 39 . 4 1 1 A 5 5 TRP C C 5 176.072 176.410 -0.338 1
1 40 . 4 1 1 A 5 5 TRP CA C 5 57.744 59.127 -1.383 1
1 41 . 4 1 1 A 5 5 TRP CB C 5 28.906 30.562 -1.656 1
1 42 . 4 1 1 A 5 5 TRP N N 5 118.408 118.607 -0.199 1
1 44 . 4 1 1 A 6 6 MET H H 6 7.679 8.148 -0.469 1
1 45 . 4 1 1 A 6 6 MET HA H 6 3.785 4.768 -0.983 1
1 52 . 4 1 1 A 6 6 MET C C 6 175.174 176.693 -1.519 1
1 53 . 4 1 1 A 6 6 MET CA C 6 57.724 55.053 2.671 1
1 54 . 4 1 1 A 6 6 MET CB C 6 31.640 32.887 -1.247 1
1 57 . 4 1 1 A 6 6 MET N N 6 121.538 113.877 7.661 1
1 58 . 4 1 1 A 7 7 GLY H H 7 7.247 8.400 -1.153 1
1 59 . 4 1 1 A 7 7 GLY HA2 H 7 3.455 4.180 -0.725 1
1 60 . 4 1 1 A 7 7 GLY HA3 H 7 3.578 4.205 -0.627 1
1 61 . 4 1 1 A 7 7 GLY C C 7 172.852 174.879 -2.027 1
1 62 . 4 1 1 A 7 7 GLY CA C 7 45.896 45.887 0.009 1
1 63 . 4 1 1 A 7 7 GLY N N 7 104.055 113.181 -9.126 1
1 64 . 4 1 1 A 8 8 THR H H 8 7.436 8.333 -0.897 1
1 65 . 4 1 1 A 8 8 THR HA H 8 4.428 4.006 0.422 1
1 70 . 4 1 1 A 8 8 THR C C 8 172.973 173.956 -0.983 1
1 71 . 4 1 1 A 8 8 THR CA C 8 60.751 65.113 -4.362 1
1 72 . 4 1 1 A 8 8 THR CB C 8 69.637 66.601 3.036 1
1 74 . 4 1 1 A 8 8 THR N N 8 107.669 110.524 -2.855 1
1 75 . 4 1 1 A 9 9 HIS H H 9 8.048 7.702 0.346 1
1 76 . 4 1 1 A 9 9 HIS HA H 9 4.654 4.778 -0.124 1
1 79 . 4 1 1 A 9 9 HIS CA C 9 56.163 54.646 1.517 1
1 80 . 4 1 1 A 9 9 HIS CB C 9 32.619 29.780 2.839 1
1 81 . 4 1 1 A 9 9 HIS N N 9 127.281 119.521 7.760 1
1 82 . 4 1 1 A 10 10 PRO HA H 10 4.257 4.252 0.005 1
1 88 . 4 1 1 A 10 10 PRO C C 10 178.779 179.107 -0.328 1
1 89 . 4 1 1 A 10 10 PRO CA C 10 65.565 65.943 -0.378 1
1 90 . 4 1 1 A 10 10 PRO CB C 10 32.422 31.961 0.461 1
1 93 . 4 1 1 A 11 11 LYS H H 11 10.994 8.516 2.478 1
1 94 . 4 1 1 A 11 11 LYS HA H 11 4.282 4.107 0.175 1
1 100 . 4 1 1 A 11 11 LYS C C 11 177.279 178.754 -1.475 1
1 101 . 4 1 1 A 11 11 LYS CA C 11 56.859 59.267 -2.408 1
1 102 . 4 1 1 A 11 11 LYS CB C 11 31.279 32.651 -1.372 1
1 104 . 4 1 1 A 11 11 LYS N N 11 121.398 117.856 3.542 1
1 105 . 4 1 1 A 12 12 TYR H H 12 7.146 8.397 -1.251 1
1 106 . 4 1 1 A 12 12 TYR HA H 12 3.722 4.249 -0.527 1
1 113 . 4 1 1 A 12 12 TYR C C 12 176.265 177.583 -1.318 1
1 114 . 4 1 1 A 12 12 TYR CA C 12 61.189 61.430 -0.241 1
1 115 . 4 1 1 A 12 12 TYR CB C 12 37.796 38.625 -0.829 1
1 116 . 4 1 1 A 12 12 TYR N N 12 121.579 122.233 -0.654 1
1 117 . 4 1 1 A 13 13 LEU H H 13 7.778 9.054 -1.276 1
1 118 . 4 1 1 A 13 13 LEU HA H 13 3.773 3.944 -0.171 1
1 127 . 4 1 1 A 13 13 LEU C C 13 178.462 178.506 -0.044 1
1 128 . 4 1 1 A 13 13 LEU CA C 13 57.942 58.062 -0.120 1
1 129 . 4 1 1 A 13 13 LEU CB C 13 41.064 41.467 -0.403 1
1 132 . 4 1 1 A 13 13 LEU N N 13 117.518 120.879 -3.361 1
1 133 . 4 1 1 A 14 14 GLU H H 14 7.867 8.571 -0.704 1
1 134 . 4 1 1 A 14 14 GLU HA H 14 3.935 3.933 0.002 1
1 139 . 4 1 1 A 14 14 GLU C C 14 178.326 178.938 -0.612 1
1 140 . 4 1 1 A 14 14 GLU CA C 14 59.368 59.964 -0.596 1
1 141 . 4 1 1 A 14 14 GLU CB C 14 30.147 29.232 0.915 1
1 143 . 4 1 1 A 14 14 GLU N N 14 119.135 118.361 0.774 1
1 144 . 4 1 1 A 15 15 MET H H 15 7.773 7.577 0.196 1
1 145 . 4 1 1 A 15 15 MET HA H 15 3.936 4.109 -0.173 1
1 152 . 4 1 1 A 15 15 MET C C 15 177.886 177.943 -0.057 1
1 153 . 4 1 1 A 15 15 MET CA C 15 59.465 58.134 1.331 1
1 154 . 4 1 1 A 15 15 MET CB C 15 33.987 32.299 1.688 1
1 157 . 4 1 1 A 15 15 MET N N 15 117.884 119.655 -1.771 1
1 158 . 4 1 1 A 16 16 MET H H 16 8.145 8.378 -0.233 1
1 159 . 4 1 1 A 16 16 MET HA H 16 4.159 3.945 0.214 1
1 166 . 4 1 1 A 16 16 MET C C 16 177.835 178.347 -0.512 1
1 167 . 4 1 1 A 16 16 MET CA C 16 57.397 58.262 -0.865 1
1 168 . 4 1 1 A 16 16 MET CB C 16 31.867 31.745 0.122 1
1 171 . 4 1 1 A 16 16 MET N N 16 119.555 118.058 1.497 1
1 172 . 4 1 1 A 17 17 GLU H H 17 7.761 8.096 -0.335 1
1 173 . 4 1 1 A 17 17 GLU HA H 17 4.117 4.061 0.056 1
1 176 . 4 1 1 A 17 17 GLU C C 17 175.994 177.022 -1.028 1
1 177 . 4 1 1 A 17 17 GLU CA C 17 57.392 58.397 -1.005 1
1 178 . 4 1 1 A 17 17 GLU CB C 17 29.432 29.841 -0.409 1
1 180 . 4 1 1 A 17 17 GLU N N 17 118.216 119.745 -1.529 1
1 181 . 4 1 1 A 18 18 LEU H H 18 7.201 7.393 -0.192 1
1 182 . 4 1 1 A 18 18 LEU HA H 18 4.111 4.259 -0.148 1
1 191 . 4 1 1 A 18 18 LEU C C 18 175.781 177.249 -1.468 1
1 192 . 4 1 1 A 18 18 LEU CA C 18 56.366 55.207 1.159 1
1 193 . 4 1 1 A 18 18 LEU CB C 18 42.030 42.586 -0.556 1
1 196 . 4 1 1 A 18 18 LEU N N 18 117.448 122.708 -5.260 1
1 197 . 4 1 1 A 19 19 ASP H H 19 7.789 8.595 -0.806 1
1 198 . 4 1 1 A 19 19 ASP HA H 19 4.360 4.662 -0.302 1
1 201 . 4 1 1 A 19 19 ASP C C 19 173.765 175.594 -1.829 1
1 202 . 4 1 1 A 19 19 ASP CA C 19 54.851 54.687 0.164 1
1 203 . 4 1 1 A 19 19 ASP CB C 19 39.115 41.064 -1.949 1
1 204 . 4 1 1 A 19 19 ASP N N 19 115.844 120.492 -4.648 1
1 205 . 4 1 1 A 20 20 ILE H H 20 8.142 7.410 0.732 1
1 206 . 4 1 1 A 20 20 ILE HA H 20 4.128 4.551 -0.423 1
1 216 . 4 1 1 A 20 20 ILE C C 20 174.710 175.052 -0.342 1
1 217 . 4 1 1 A 20 20 ILE CA C 20 60.465 60.518 -0.053 1
1 218 . 4 1 1 A 20 20 ILE CB C 20 40.407 39.915 0.492 1
1 222 . 4 1 1 A 20 20 ILE N N 20 117.287 119.956 -2.669 1
1 223 . 4 1 1 A 21 21 GLY H H 21 8.207 9.099 -0.892 1
1 224 . 4 1 1 A 21 21 GLY HA2 H 21 3.889 3.900 -0.011 1
1 225 . 4 1 1 A 21 21 GLY HA3 H 21 3.924 3.915 0.009 1
1 226 . 4 1 1 A 21 21 GLY C C 21 172.162 172.351 -0.189 1
1 227 . 4 1 1 A 21 21 GLY CA C 21 45.017 46.716 -1.699 1
1 228 . 4 1 1 A 21 21 GLY N N 21 110.656 114.949 -4.293 1
1 229 . 4 1 1 A 22 22 ASP H H 22 7.727 8.177 -0.450 1
1 230 . 4 1 1 A 22 22 ASP HA H 22 4.794 4.873 -0.079 1
1 233 . 4 1 1 A 22 22 ASP C C 22 174.884 176.630 -1.746 1
1 234 . 4 1 1 A 22 22 ASP CA C 22 52.471 52.541 -0.070 1
1 235 . 4 1 1 A 22 22 ASP CB C 22 42.069 42.549 -0.480 1
1 236 . 4 1 1 A 22 22 ASP N N 22 119.305 125.249 -5.944 1
1 237 . 4 1 1 A 23 23 ALA H H 23 8.644 9.041 -0.397 1
1 238 . 4 1 1 A 23 23 ALA HA H 23 4.120 4.013 0.107 1
1 242 . 4 1 1 A 23 23 ALA C C 23 179.546 179.675 -0.129 1
1 243 . 4 1 1 A 23 23 ALA CA C 23 55.609 55.431 0.178 1
1 244 . 4 1 1 A 23 23 ALA CB C 23 18.573 18.572 0.001 1
1 245 . 4 1 1 A 23 23 ALA N N 23 122.468 129.213 -6.745 1
1 246 . 4 1 1 A 24 24 THR H H 24 8.238 7.541 0.697 1
1 247 . 4 1 1 A 24 24 THR HA H 24 4.184 4.073 0.111 1
1 252 . 4 1 1 A 24 24 THR C C 24 174.841 176.817 -1.976 1
1 253 . 4 1 1 A 24 24 THR CA C 24 66.241 66.532 -0.291 1
1 254 . 4 1 1 A 24 24 THR CB C 24 68.376 68.461 -0.085 1
1 256 . 4 1 1 A 24 24 THR N N 24 114.824 113.884 0.940 1
1 257 . 4 1 1 A 25 25 GLN H H 25 8.037 8.604 -0.567 1
1 258 . 4 1 1 A 25 25 GLN HA H 25 4.095 4.033 0.062 1
1 265 . 4 1 1 A 25 25 GLN C C 25 177.603 178.796 -1.193 1
1 266 . 4 1 1 A 25 25 GLN CA C 25 59.261 58.724 0.537 1
1 267 . 4 1 1 A 25 25 GLN CB C 25 28.437 28.236 0.201 1
1 269 . 4 1 1 A 25 25 GLN N N 25 122.518 120.166 2.352 1
1 271 . 4 1 1 A 26 26 VAL H H 26 7.994 8.317 -0.323 1
1 272 . 4 1 1 A 26 26 VAL HA H 26 3.469 3.752 -0.283 1
1 280 . 4 1 1 A 26 26 VAL C C 26 175.552 177.914 -2.362 1
1 281 . 4 1 1 A 26 26 VAL CA C 26 66.909 65.863 1.046 1
1 282 . 4 1 1 A 26 26 VAL CB C 26 31.582 31.280 0.302 1
1 285 . 4 1 1 A 26 26 VAL N N 26 119.112 116.951 2.161 1
1 286 . 4 1 1 A 27 27 TYR H H 27 8.003 8.162 -0.159 1
1 287 . 4 1 1 A 27 27 TYR HA H 27 4.357 4.416 -0.059 1
1 294 . 4 1 1 A 27 27 TYR C C 27 175.856 177.108 -1.252 1
1 295 . 4 1 1 A 27 27 TYR CA C 27 62.197 61.744 0.453 1
1 296 . 4 1 1 A 27 27 TYR CB C 27 38.394 38.791 -0.397 1
1 297 . 4 1 1 A 27 27 TYR N N 27 119.170 124.711 -5.541 1
1 298 . 4 1 1 A 28 28 VAL H H 28 8.087 8.687 -0.600 1
1 299 . 4 1 1 A 28 28 VAL HA H 28 3.652 3.371 0.281 1
1 307 . 4 1 1 A 28 28 VAL C C 28 176.134 178.205 -2.071 1
1 308 . 4 1 1 A 28 28 VAL CA C 28 66.247 66.295 -0.048 1
1 309 . 4 1 1 A 28 28 VAL CB C 28 31.241 31.429 -0.188 1
1 312 . 4 1 1 A 28 28 VAL N N 28 113.112 119.241 -6.129 1
1 313 . 4 1 1 A 29 29 ALA H H 29 7.853 8.582 -0.729 1
1 314 . 4 1 1 A 29 29 ALA HA H 29 3.913 4.064 -0.151 1
1 318 . 4 1 1 A 29 29 ALA C C 29 177.850 179.444 -1.594 1
1 319 . 4 1 1 A 29 29 ALA CA C 29 55.274 54.888 0.386 1
1 320 . 4 1 1 A 29 29 ALA CB C 29 17.876 18.399 -0.523 1
1 321 . 4 1 1 A 29 29 ALA N N 29 121.350 122.565 -1.215 1
1 322 . 4 1 1 A 30 30 PHE H H 30 8.724 8.022 0.702 1
1 323 . 4 1 1 A 30 30 PHE HA H 30 4.098 4.227 -0.129 1
1 327 . 4 1 1 A 30 30 PHE C C 30 175.035 177.166 -2.131 1
1 328 . 4 1 1 A 30 30 PHE CA C 30 61.264 61.461 -0.197 1
1 329 . 4 1 1 A 30 30 PHE CB C 30 38.926 39.429 -0.503 1
1 330 . 4 1 1 A 30 30 PHE N N 30 120.478 120.504 -0.026 1
1 331 . 4 1 1 A 31 31 LEU H H 31 8.146 8.143 0.003 1
1 332 . 4 1 1 A 31 31 LEU HA H 31 3.597 3.509 0.088 1
1 341 . 4 1 1 A 31 31 LEU C C 31 179.508 179.177 0.331 1
1 342 . 4 1 1 A 31 31 LEU CA C 31 57.884 58.053 -0.169 1
1 343 . 4 1 1 A 31 31 LEU CB C 31 41.829 42.141 -0.312 1
1 346 . 4 1 1 A 31 31 LEU N N 31 118.427 120.202 -1.775 1
1 347 . 4 1 1 A 32 32 VAL H H 32 7.627 7.585 0.042 1
1 348 . 4 1 1 A 32 32 VAL HA H 32 3.464 3.756 -0.292 1
1 356 . 4 1 1 A 32 32 VAL C C 32 174.956 177.575 -2.619 1
1 357 . 4 1 1 A 32 32 VAL CA C 32 66.373 65.552 0.821 1
1 358 . 4 1 1 A 32 32 VAL CB C 32 31.121 31.366 -0.245 1
1 361 . 4 1 1 A 32 32 VAL N N 32 119.497 114.310 5.187 1
1 362 . 4 1 1 A 33 33 TYR H H 33 8.366 8.505 -0.139 1
1 363 . 4 1 1 A 33 33 TYR HA H 33 3.485 3.938 -0.453 1
1 370 . 4 1 1 A 33 33 TYR C C 33 174.883 176.863 -1.980 1
1 371 . 4 1 1 A 33 33 TYR CA C 33 62.866 61.282 1.584 1
1 372 . 4 1 1 A 33 33 TYR CB C 33 37.778 38.287 -0.509 1
1 373 . 4 1 1 A 33 33 TYR N N 33 121.842 124.205 -2.363 1
1 374 . 4 1 1 A 34 34 LEU H H 34 8.000 8.457 -0.457 1
1 375 . 4 1 1 A 34 34 LEU HA H 34 3.495 3.668 -0.173 1
1 385 . 4 1 1 A 34 34 LEU C C 34 178.240 179.046 -0.806 1
1 386 . 4 1 1 A 34 34 LEU CA C 34 57.453 57.252 0.201 1
1 387 . 4 1 1 A 34 34 LEU CB C 34 41.828 40.821 1.007 1
1 390 . 4 1 1 A 34 34 LEU N N 34 116.692 119.462 -2.770 1
1 391 . 4 1 1 A 35 35 ASP H H 35 7.688 7.891 -0.203 1
1 392 . 4 1 1 A 35 35 ASP HA H 35 4.302 4.352 -0.050 1
1 395 . 4 1 1 A 35 35 ASP C C 35 177.507 178.406 -0.899 1
1 396 . 4 1 1 A 35 35 ASP CA C 35 58.196 57.506 0.690 1
1 397 . 4 1 1 A 35 35 ASP CB C 35 43.070 41.098 1.972 1
1 398 . 4 1 1 A 35 35 ASP N N 35 120.507 120.024 0.483 1
1 399 . 4 1 1 A 36 36 LEU H H 36 8.482 8.484 -0.002 1
1 400 . 4 1 1 A 36 36 LEU HA H 36 3.328 3.715 -0.387 1
1 410 . 4 1 1 A 36 36 LEU C C 36 176.774 179.021 -2.247 1
1 411 . 4 1 1 A 36 36 LEU CA C 36 57.461 57.784 -0.323 1
1 412 . 4 1 1 A 36 36 LEU CB C 36 41.344 40.966 0.378 1
1 416 . 4 1 1 A 36 36 LEU N N 36 117.671 120.076 -2.405 1
1 417 . 4 1 1 A 37 37 MET H H 37 7.822 7.835 -0.013 1
1 418 . 4 1 1 A 37 37 MET HA H 37 4.401 3.983 0.418 1
1 425 . 4 1 1 A 37 37 MET C C 37 177.862 177.539 0.323 1
1 426 . 4 1 1 A 37 37 MET CA C 37 56.434 58.776 -2.342 1
1 427 . 4 1 1 A 37 37 MET CB C 37 31.573 33.034 -1.461 1
1 430 . 4 1 1 A 37 37 MET N N 37 112.952 116.534 -3.582 1
1 431 . 4 1 1 A 38 38 GLU H H 38 8.667 8.211 0.456 1
1 432 . 4 1 1 A 38 38 GLU HA H 38 4.457 4.296 0.161 1
1 436 . 4 1 1 A 38 38 GLU C C 38 176.582 176.988 -0.406 1
1 437 . 4 1 1 A 38 38 GLU CA C 38 57.659 57.313 0.346 1
1 438 . 4 1 1 A 38 38 GLU CB C 38 29.936 30.453 -0.517 1
1 440 . 4 1 1 A 38 38 GLU N N 38 116.463 116.721 -0.258 1
1 441 . 4 1 1 A 39 39 SER H H 39 7.657 8.475 -0.818 1
1 442 . 4 1 1 A 39 39 SER HA H 39 4.658 4.494 0.164 1
1 445 . 4 1 1 A 39 39 SER C C 39 175.661 175.624 0.037 1
1 446 . 4 1 1 A 39 39 SER CA C 39 60.449 60.426 0.023 1
1 447 . 4 1 1 A 39 39 SER CB C 39 63.341 64.570 -1.229 1
1 448 . 4 1 1 A 39 39 SER N N 39 113.870 113.820 0.050 1
1 449 . 4 1 1 A 40 40 LYS H H 40 8.165 8.155 0.010 1
1 450 . 4 1 1 A 40 40 LYS HA H 40 4.454 4.242 0.212 1
1 458 . 4 1 1 A 40 40 LYS C C 40 174.970 176.175 -1.205 1
1 459 . 4 1 1 A 40 40 LYS CA C 40 55.753 58.225 -2.472 1
1 460 . 4 1 1 A 40 40 LYS CB C 40 32.337 33.149 -0.812 1
1 464 . 4 1 1 A 40 40 LYS N N 40 116.671 122.417 -5.746 1
1 465 . 4 1 1 A 41 41 SER H H 41 7.017 8.060 -1.043 1
1 466 . 4 1 1 A 41 41 SER HA H 41 4.209 4.287 -0.078 1
1 469 . 4 1 1 A 41 41 SER C C 41 173.770 173.607 0.163 1
1 470 . 4 1 1 A 41 41 SER CA C 41 58.435 59.216 -0.781 1
1 471 . 4 1 1 A 41 41 SER CB C 41 61.700 60.861 0.839 1
1 472 . 4 1 1 A 41 41 SER N N 41 109.989 113.298 -3.309 1
1 473 . 4 1 1 A 42 42 TRP H H 42 8.876 8.259 0.617 1
1 474 . 4 1 1 A 42 42 TRP HA H 42 4.698 4.564 0.134 1
1 478 . 4 1 1 A 42 42 TRP C C 42 174.477 177.367 -2.890 1
1 479 . 4 1 1 A 42 42 TRP CA C 42 59.443 57.853 1.590 1
1 480 . 4 1 1 A 42 42 TRP CB C 42 28.203 29.473 -1.270 1
1 481 . 4 1 1 A 42 42 TRP N N 42 121.116 120.672 0.444 1
1 483 . 4 1 1 A 43 43 HIS H H 43 8.132 8.376 -0.244 1
1 484 . 4 1 1 A 43 43 HIS HA H 43 4.445 4.380 0.065 1
1 488 . 4 1 1 A 43 43 HIS C C 43 174.405 174.461 -0.056 1
1 489 . 4 1 1 A 43 43 HIS CA C 43 58.556 59.325 -0.769 1
1 490 . 4 1 1 A 43 43 HIS CB C 43 29.430 30.519 -1.089 1
1 491 . 4 1 1 A 43 43 HIS N N 43 119.397 123.480 -4.083 1
1 492 . 4 1 1 A 44 44 GLU H H 44 8.140 7.566 0.574 1
1 493 . 4 1 1 A 44 44 GLU HA H 44 4.432 4.618 -0.186 1
1 497 . 4 1 1 A 44 44 GLU C C 44 173.010 174.000 -0.990 1
1 498 . 4 1 1 A 44 44 GLU CA C 44 56.421 56.232 0.189 1
1 499 . 4 1 1 A 44 44 GLU CB C 44 33.285 33.495 -0.210 1
1 501 . 4 1 1 A 44 44 GLU N N 44 116.181 117.950 -1.769 1
1 502 . 4 1 1 A 45 45 VAL H H 45 8.428 8.878 -0.450 1
1 503 . 4 1 1 A 45 45 VAL HA H 45 4.492 5.108 -0.616 1
1 511 . 4 1 1 A 45 45 VAL C C 45 172.339 173.334 -0.995 1
1 512 . 4 1 1 A 45 45 VAL CA C 45 63.071 59.805 3.266 1
1 513 . 4 1 1 A 45 45 VAL CB C 45 35.145 35.686 -0.541 1
1 516 . 4 1 1 A 45 45 VAL N N 45 123.272 123.791 -0.519 1
1 517 . 4 1 1 A 46 46 ASN H H 46 9.050 8.846 0.204 1
1 518 . 4 1 1 A 46 46 ASN HA H 46 5.261 5.444 -0.183 1
1 523 . 4 1 1 A 46 46 ASN C C 46 172.845 173.747 -0.902 1
1 524 . 4 1 1 A 46 46 ASN CA C 46 51.895 51.764 0.131 1
1 525 . 4 1 1 A 46 46 ASN CB C 46 42.322 42.257 0.065 1
1 526 . 4 1 1 A 46 46 ASN N N 46 123.901 125.289 -1.388 1
1 528 . 4 1 1 A 47 47 CYS H H 47 9.039 9.146 -0.107 1
1 529 . 4 1 1 A 47 47 CYS HA H 47 5.160 5.512 -0.352 1
1 532 . 4 1 1 A 47 47 CYS C C 47 172.454 173.349 -0.895 1
1 533 . 4 1 1 A 47 47 CYS CA C 47 56.473 57.380 -0.907 1
1 534 . 4 1 1 A 47 47 CYS CB C 47 29.297 29.935 -0.638 1
1 535 . 4 1 1 A 47 47 CYS N N 47 119.663 118.321 1.342 1
1 536 . 4 1 1 A 48 48 VAL H H 48 9.083 8.967 0.116 1
1 537 . 4 1 1 A 48 48 VAL HA H 48 4.344 4.704 -0.360 1
1 542 . 4 1 1 A 48 48 VAL C C 48 173.307 174.903 -1.596 1
1 543 . 4 1 1 A 48 48 VAL CA C 48 61.368 60.725 0.643 1
1 544 . 4 1 1 A 48 48 VAL CB C 48 35.345 35.207 0.138 1
1 546 . 4 1 1 A 48 48 VAL N N 48 124.672 123.962 0.710 1
1 547 . 4 1 1 A 49 49 GLY H H 49 9.019 9.082 -0.063 1
1 548 . 4 1 1 A 49 49 GLY HA2 H 49 3.460 4.155 -0.695 1
1 549 . 4 1 1 A 49 49 GLY HA3 H 49 4.539 4.155 0.384 1
1 550 . 4 1 1 A 49 49 GLY C C 49 171.278 172.558 -1.280 1
1 551 . 4 1 1 A 49 49 GLY CA C 49 45.075 44.519 0.556 1
1 552 . 4 1 1 A 49 49 GLY N N 49 113.131 115.450 -2.319 1
1 553 . 4 1 1 A 50 50 LEU H H 50 8.747 8.971 -0.224 1
1 554 . 4 1 1 A 50 50 LEU HA H 50 5.102 4.948 0.154 1
1 564 . 4 1 1 A 50 50 LEU CA C 50 51.417 51.285 0.132 1
1 565 . 4 1 1 A 50 50 LEU CB C 50 41.754 42.458 -0.704 1
1 569 . 4 1 1 A 50 50 LEU N N 50 124.471 127.625 -3.154 1
1 570 . 4 1 1 A 51 51 PRO HA H 51 4.106 4.311 -0.205 1
1 577 . 4 1 1 A 51 51 PRO C C 51 178.422 178.644 -0.222 1
1 578 . 4 1 1 A 51 51 PRO CA C 51 65.680 64.681 0.999 1
1 579 . 4 1 1 A 51 51 PRO CB C 51 31.939 32.137 -0.198 1
1 582 . 4 1 1 A 52 52 GLU H H 52 9.721 8.499 1.222 1
1 583 . 4 1 1 A 52 52 GLU HA H 52 4.176 4.079 0.097 1
1 588 . 4 1 1 A 52 52 GLU C C 52 176.146 177.811 -1.665 1
1 589 . 4 1 1 A 52 52 GLU CA C 52 59.158 59.336 -0.178 1
1 590 . 4 1 1 A 52 52 GLU CB C 52 28.442 29.331 -0.889 1
1 592 . 4 1 1 A 52 52 GLU N N 52 118.552 118.136 0.416 1
1 593 . 4 1 1 A 53 53 LEU H H 53 7.089 7.418 -0.329 1
1 594 . 4 1 1 A 53 53 LEU HA H 53 4.511 4.354 0.157 1
1 603 . 4 1 1 A 53 53 LEU C C 53 174.027 176.214 -2.187 1
1 604 . 4 1 1 A 53 53 LEU CA C 53 53.825 54.660 -0.835 1
1 605 . 4 1 1 A 53 53 LEU CB C 53 43.825 42.365 1.460 1
1 608 . 4 1 1 A 53 53 LEU N N 53 116.763 117.833 -1.070 1
1 609 . 4 1 1 A 54 54 GLN H H 54 7.964 7.684 0.280 1
1 610 . 4 1 1 A 54 54 GLN HA H 54 3.591 3.869 -0.278 1
1 616 . 4 1 1 A 54 54 GLN C C 54 172.604 173.793 -1.189 1
1 617 . 4 1 1 A 54 54 GLN CA C 54 56.961 57.049 -0.088 1
1 618 . 4 1 1 A 54 54 GLN CB C 54 26.545 26.285 0.260 1
1 620 . 4 1 1 A 54 54 GLN N N 54 115.489 116.225 -0.736 1
1 622 . 4 1 1 A 55 55 LEU H H 55 7.139 7.465 -0.326 1
1 623 . 4 1 1 A 55 55 LEU HA H 55 4.750 4.839 -0.089 1
1 629 . 4 1 1 A 55 55 LEU C C 55 173.475 174.828 -1.353 1
1 630 . 4 1 1 A 55 55 LEU CA C 55 53.698 53.417 0.281 1
1 631 . 4 1 1 A 55 55 LEU CB C 55 47.859 44.793 3.066 1
1 633 . 4 1 1 A 55 55 LEU N N 55 116.422 119.207 -2.785 1
1 634 . 4 1 1 A 56 56 ILE H H 56 8.223 8.888 -0.665 1
1 635 . 4 1 1 A 56 56 ILE HA H 56 4.540 5.206 -0.666 1
1 643 . 4 1 1 A 56 56 ILE C C 56 173.938 174.969 -1.031 1
1 644 . 4 1 1 A 56 56 ILE CA C 56 61.020 60.091 0.929 1
1 645 . 4 1 1 A 56 56 ILE CB C 56 39.403 40.069 -0.666 1
1 648 . 4 1 1 A 56 56 ILE N N 56 122.792 126.563 -3.771 1
1 649 . 4 1 1 A 57 57 CYS H H 57 8.995 8.879 0.116 1
1 650 . 4 1 1 A 57 57 CYS HA H 57 5.036 5.129 -0.093 1
1 653 . 4 1 1 A 57 57 CYS C C 57 170.483 173.149 -2.666 1
1 654 . 4 1 1 A 57 57 CYS CA C 57 56.484 57.787 -1.303 1
1 655 . 4 1 1 A 57 57 CYS CB C 57 30.545 30.844 -0.299 1
1 656 . 4 1 1 A 57 57 CYS N N 57 121.575 125.986 -4.411 1
1 657 . 4 1 1 A 58 58 LEU H H 58 9.076 8.529 0.547 1
1 658 . 4 1 1 A 58 58 LEU HA H 58 5.472 5.817 -0.345 1
1 668 . 4 1 1 A 58 58 LEU C C 58 174.009 175.848 -1.839 1
1 669 . 4 1 1 A 58 58 LEU CA C 58 52.851 53.607 -0.756 1
1 670 . 4 1 1 A 58 58 LEU CB C 58 42.177 42.827 -0.650 1
1 674 . 4 1 1 A 58 58 LEU N N 58 121.895 126.345 -4.450 1
1 675 . 4 1 1 A 59 59 VAL H H 59 8.966 8.554 0.412 1
1 676 . 4 1 1 A 59 59 VAL HA H 59 5.488 5.071 0.417 1
1 681 . 4 1 1 A 59 59 VAL C C 59 176.034 175.555 0.479 1
1 682 . 4 1 1 A 59 59 VAL CA C 59 59.820 60.836 -1.016 1
1 683 . 4 1 1 A 59 59 VAL CB C 59 34.786 35.184 -0.398 1
1 685 . 4 1 1 A 59 59 VAL N N 59 121.702 124.446 -2.744 1
1 686 . 4 1 1 A 60 60 GLY H H 60 9.258 8.688 0.570 1
1 687 . 4 1 1 A 60 60 GLY HA2 H 60 4.673 4.451 0.222 1
1 688 . 4 1 1 A 60 60 GLY HA3 H 60 4.804 4.559 0.245 1
1 689 . 4 1 1 A 60 60 GLY C C 60 169.831 172.835 -3.004 1
1 690 . 4 1 1 A 60 60 GLY CA C 60 46.399 45.979 0.420 1
1 691 . 4 1 1 A 60 60 GLY N N 60 114.126 113.019 1.107 1
1 692 . 4 1 1 A 61 61 THR H H 61 8.834 8.577 0.257 1
1 693 . 4 1 1 A 61 61 THR HA H 61 4.418 5.471 -1.053 1
1 698 . 4 1 1 A 61 61 THR C C 61 171.985 174.739 -2.754 1
1 699 . 4 1 1 A 61 61 THR CA C 61 60.634 60.678 -0.044 1
1 700 . 4 1 1 A 61 61 THR CB C 61 70.983 70.677 0.306 1
1 702 . 4 1 1 A 61 61 THR N N 61 114.856 112.682 2.174 1
1 703 . 4 1 1 A 62 62 GLU H H 62 8.502 8.842 -0.340 1
1 704 . 4 1 1 A 62 62 GLU HA H 62 2.867 3.604 -0.737 1
1 709 . 4 1 1 A 62 62 GLU C C 62 174.650 175.943 -1.293 1
1 710 . 4 1 1 A 62 62 GLU CA C 62 58.785 58.527 0.258 1
1 711 . 4 1 1 A 62 62 GLU CB C 62 28.981 29.447 -0.466 1
1 713 . 4 1 1 A 62 62 GLU N N 62 129.915 123.907 6.008 1
1 714 . 4 1 1 A 63 63 ILE H H 63 6.928 7.908 -0.980 1
1 715 . 4 1 1 A 63 63 ILE HA H 63 4.038 4.324 -0.286 1
1 725 . 4 1 1 A 63 63 ILE C C 63 173.482 175.146 -1.664 1
1 726 . 4 1 1 A 63 63 ILE CA C 63 58.664 60.069 -1.405 1
1 727 . 4 1 1 A 63 63 ILE CB C 63 40.009 40.492 -0.483 1
1 731 . 4 1 1 A 63 63 ILE N N 63 117.075 117.978 -0.903 1
1 732 . 4 1 1 A 64 64 GLU H H 64 8.585 8.227 0.358 1
1 733 . 4 1 1 A 64 64 GLU HA H 64 3.427 3.793 -0.366 1
1 738 . 4 1 1 A 64 64 GLU C C 64 175.186 177.189 -2.003 1
1 739 . 4 1 1 A 64 64 GLU CA C 64 58.703 58.111 0.592 1
1 740 . 4 1 1 A 64 64 GLU CB C 64 28.999 29.065 -0.066 1
1 742 . 4 1 1 A 64 64 GLU N N 64 126.422 127.012 -0.590 1
1 743 . 4 1 1 A 65 65 GLY H H 65 8.754 8.881 -0.127 1
1 744 . 4 1 1 A 65 65 GLY HA2 H 65 3.631 3.937 -0.306 1
1 745 . 4 1 1 A 65 65 GLY HA3 H 65 4.287 3.957 0.330 1
1 746 . 4 1 1 A 65 65 GLY C C 65 174.005 174.833 -0.828 1
1 747 . 4 1 1 A 65 65 GLY CA C 65 44.954 45.093 -0.139 1
1 748 . 4 1 1 A 65 65 GLY N N 65 114.614 114.945 -0.331 1
1 749 . 4 1 1 A 66 66 GLU H H 66 7.760 7.576 0.184 1
1 750 . 4 1 1 A 66 66 GLU HA H 66 4.462 4.660 -0.198 1
1 754 . 4 1 1 A 66 66 GLU C C 66 175.255 175.988 -0.733 1
1 755 . 4 1 1 A 66 66 GLU CA C 66 55.582 55.721 -0.139 1
1 756 . 4 1 1 A 66 66 GLU CB C 66 30.654 31.428 -0.774 1
1 758 . 4 1 1 A 66 66 GLU N N 66 119.292 120.477 -1.185 1
1 759 . 4 1 1 A 67 67 GLY H H 67 8.262 8.335 -0.073 1
1 760 . 4 1 1 A 67 67 GLY HA2 H 67 3.875 4.136 -0.261 1
1 761 . 4 1 1 A 67 67 GLY HA3 H 67 4.088 4.143 -0.055 1
1 762 . 4 1 1 A 67 67 GLY C C 67 172.197 173.891 -1.694 1
1 763 . 4 1 1 A 67 67 GLY CA C 67 44.845 45.186 -0.341 1
1 764 . 4 1 1 A 67 67 GLY N N 67 106.161 108.878 -2.717 1
1 765 . 4 1 1 A 68 68 LEU H H 68 8.142 7.808 0.334 1
1 766 . 4 1 1 A 68 68 LEU HA H 68 4.491 4.706 -0.215 1
1 775 . 4 1 1 A 68 68 LEU C C 68 176.194 175.010 1.184 1
1 776 . 4 1 1 A 68 68 LEU CA C 68 55.123 54.137 0.986 1
1 777 . 4 1 1 A 68 68 LEU CB C 68 44.527 43.330 1.197 1
1 780 . 4 1 1 A 68 68 LEU N N 68 120.269 121.070 -0.801 1
1 781 . 4 1 1 A 69 69 GLN H H 69 9.253 8.694 0.559 1
1 782 . 4 1 1 A 69 69 GLN HA H 69 4.770 5.166 -0.396 1
1 788 . 4 1 1 A 69 69 GLN C C 69 173.607 173.922 -0.315 1
1 789 . 4 1 1 A 69 69 GLN CA C 69 54.736 54.895 -0.159 1
1 790 . 4 1 1 A 69 69 GLN CB C 69 33.782 31.924 1.858 1
1 792 . 4 1 1 A 69 69 GLN N N 69 119.336 120.468 -1.132 1
1 794 . 4 1 1 A 70 70 THR H H 70 8.803 9.071 -0.268 1
1 795 . 4 1 1 A 70 70 THR HA H 70 5.033 5.203 -0.170 1
1 800 . 4 1 1 A 70 70 THR C C 70 172.596 173.934 -1.338 1
1 801 . 4 1 1 A 70 70 THR CA C 70 62.768 61.918 0.850 1
1 802 . 4 1 1 A 70 70 THR CB C 70 69.990 70.959 -0.969 1
1 804 . 4 1 1 A 70 70 THR N N 70 118.372 119.871 -1.499 1
1 805 . 4 1 1 A 71 71 VAL H H 71 9.882 9.385 0.497 1
1 806 . 4 1 1 A 71 71 VAL HA H 71 5.239 5.351 -0.112 1
1 811 . 4 1 1 A 71 71 VAL C C 71 174.015 174.705 -0.690 1
1 812 . 4 1 1 A 71 71 VAL CA C 71 60.577 59.880 0.697 1
1 813 . 4 1 1 A 71 71 VAL CB C 71 34.149 35.490 -1.341 1
1 815 . 4 1 1 A 71 71 VAL N N 71 129.063 120.450 8.613 1
1 816 . 4 1 1 A 72 72 VAL H H 72 9.491 8.965 0.526 1
1 817 . 4 1 1 A 72 72 VAL HA H 72 4.672 4.566 0.106 1
1 825 . 4 1 1 A 72 72 VAL CA C 72 59.568 58.708 0.860 1
1 826 . 4 1 1 A 72 72 VAL CB C 72 34.057 35.466 -1.409 1
1 829 . 4 1 1 A 72 72 VAL N N 72 128.521 124.821 3.700 1
1 830 . 4 1 1 A 73 73 PRO HA H 73 5.368 4.495 0.873 1
1 836 . 4 1 1 A 73 73 PRO C C 73 175.079 176.138 -1.059 1
1 837 . 4 1 1 A 73 73 PRO CA C 73 61.324 63.000 -1.676 1
1 838 . 4 1 1 A 73 73 PRO CB C 73 33.089 32.088 1.001 1
1 841 . 4 1 1 A 74 74 THR H H 74 9.103 8.671 0.432 1
1 842 . 4 1 1 A 74 74 THR HA H 74 5.191 4.835 0.356 1
1 847 . 4 1 1 A 74 74 THR CA C 74 57.986 59.469 -1.483 1
1 848 . 4 1 1 A 74 74 THR CB C 74 72.212 72.057 0.155 1
1 850 . 4 1 1 A 74 74 THR N N 74 118.075 118.535 -0.460 1
1 851 . 4 1 1 A 75 75 PRO HA H 75 5.015 4.668 0.347 1
1 858 . 4 1 1 A 75 75 PRO C C 75 178.704 177.614 1.090 1
1 859 . 4 1 1 A 75 75 PRO CA C 75 63.038 62.553 0.485 1
1 860 . 4 1 1 A 75 75 PRO CB C 75 32.529 32.712 -0.183 1
1 863 . 4 1 1 A 76 76 ILE H H 76 8.221 8.363 -0.142 1
1 864 . 4 1 1 A 76 76 ILE HA H 76 4.218 3.756 0.462 1
1 873 . 4 1 1 A 76 76 ILE C C 76 172.375 177.210 -4.835 1
1 874 . 4 1 1 A 76 76 ILE CA C 76 63.509 64.201 -0.692 1
1 875 . 4 1 1 A 76 76 ILE CB C 76 39.322 37.861 1.461 1
1 879 . 4 1 1 A 76 76 ILE N N 76 122.273 122.785 -0.512 1
1 880 . 4 1 1 A 77 77 THR H H 77 6.984 7.536 -0.552 1
1 881 . 4 1 1 A 77 77 THR HA H 77 4.227 4.383 -0.156 1
1 886 . 4 1 1 A 77 77 THR C C 77 173.531 174.349 -0.818 1
1 887 . 4 1 1 A 77 77 THR CA C 77 61.435 63.138 -1.703 1
1 888 . 4 1 1 A 77 77 THR CB C 77 68.944 69.232 -0.288 1
1 890 . 4 1 1 A 77 77 THR N N 77 105.803 114.479 -8.676 1
1 891 . 4 1 1 A 78 78 ALA H H 78 7.647 7.591 0.056 1
1 892 . 4 1 1 A 78 78 ALA HA H 78 4.757 4.350 0.407 1
1 896 . 4 1 1 A 78 78 ALA C C 78 173.520 177.115 -3.595 1
1 897 . 4 1 1 A 78 78 ALA CA C 78 51.164 52.290 -1.126 1
1 898 . 4 1 1 A 78 78 ALA CB C 78 20.011 20.223 -0.212 1
1 899 . 4 1 1 A 78 78 ALA N N 78 126.635 124.073 2.562 1
1 900 . 4 1 1 A 79 79 SER H H 79 7.884 8.681 -0.797 1
1 901 . 4 1 1 A 79 79 SER HA H 79 4.386 5.354 -0.968 1
1 903 . 4 1 1 A 79 79 SER C C 79 176.077 172.743 3.334 1
1 904 . 4 1 1 A 79 79 SER CA C 79 57.465 56.523 0.942 1
1 905 . 4 1 1 A 79 79 SER CB C 79 65.285 64.550 0.735 1
1 906 . 4 1 1 A 79 79 SER N N 79 115.272 113.306 1.966 1
1 907 . 4 1 1 A 80 80 LEU H H 80 7.700 8.925 -1.225 1
1 908 . 4 1 1 A 80 80 LEU HA H 80 4.912 5.001 -0.089 1
1 915 . 4 1 1 A 80 80 LEU C C 80 173.927 175.868 -1.941 1
1 916 . 4 1 1 A 80 80 LEU CA C 80 53.829 53.792 0.037 1
1 917 . 4 1 1 A 80 80 LEU CB C 80 45.990 44.012 1.978 1
1 920 . 4 1 1 A 80 80 LEU N N 80 121.507 127.903 -6.396 1
1 921 . 4 1 1 A 81 81 SER H H 81 7.885 8.535 -0.650 1
1 922 . 4 1 1 A 81 81 SER HA H 81 5.269 5.062 0.207 1
1 925 . 4 1 1 A 81 81 SER C C 81 175.756 176.356 -0.600 1
1 926 . 4 1 1 A 81 81 SER CA C 81 55.507 55.466 0.041 1
1 927 . 4 1 1 A 81 81 SER CB C 81 65.966 66.446 -0.480 1
1 928 . 4 1 1 A 81 81 SER N N 81 118.323 118.550 -0.227 1
1 929 . 4 1 1 A 82 82 HIS H H 82 8.935 8.985 -0.050 1
1 930 . 4 1 1 A 82 82 HIS HA H 82 4.407 4.398 0.009 1
1 932 . 4 1 1 A 82 82 HIS C C 82 176.550 177.212 -0.662 1
1 933 . 4 1 1 A 82 82 HIS CA C 82 60.960 58.894 2.066 1
1 934 . 4 1 1 A 82 82 HIS CB C 82 30.755 29.416 1.339 1
1 935 . 4 1 1 A 82 82 HIS N N 82 124.042 119.557 4.485 1
1 936 . 4 1 1 A 83 83 ASN H H 83 8.435 8.221 0.214 1
1 937 . 4 1 1 A 83 83 ASN HA H 83 4.439 4.281 0.158 1
1 941 . 4 1 1 A 83 83 ASN C C 83 174.769 177.475 -2.706 1
1 942 . 4 1 1 A 83 83 ASN CA C 83 56.575 56.551 0.024 1
1 943 . 4 1 1 A 83 83 ASN CB C 83 38.731 38.761 -0.030 1
1 944 . 4 1 1 A 83 83 ASN N N 83 118.543 119.314 -0.771 1
1 946 . 4 1 1 A 84 84 ARG H H 84 7.716 8.057 -0.341 1
1 947 . 4 1 1 A 84 84 ARG HA H 84 4.183 4.030 0.153 1
1 953 . 4 1 1 A 84 84 ARG C C 84 177.399 178.292 -0.893 1
1 954 . 4 1 1 A 84 84 ARG CA C 84 59.045 59.244 -0.199 1
1 955 . 4 1 1 A 84 84 ARG CB C 84 29.992 29.711 0.281 1
1 957 . 4 1 1 A 84 84 ARG N N 84 121.312 119.535 1.777 1
1 958 . 4 1 1 A 85 85 ILE H H 85 8.354 7.990 0.364 1
1 959 . 4 1 1 A 85 85 ILE HA H 85 3.650 3.886 -0.236 1
1 967 . 4 1 1 A 85 85 ILE C C 85 176.098 178.032 -1.934 1
1 968 . 4 1 1 A 85 85 ILE CA C 85 66.704 64.890 1.814 1
1 969 . 4 1 1 A 85 85 ILE CB C 85 38.017 37.846 0.171 1
1 972 . 4 1 1 A 85 85 ILE N N 85 119.321 118.614 0.707 1
1 973 . 4 1 1 A 86 86 ARG H H 86 7.690 7.782 -0.092 1
1 974 . 4 1 1 A 86 86 ARG HA H 86 3.704 3.910 -0.206 1
1 981 . 4 1 1 A 86 86 ARG C C 86 177.524 178.767 -1.243 1
1 982 . 4 1 1 A 86 86 ARG CA C 86 59.881 60.037 -0.156 1
1 983 . 4 1 1 A 86 86 ARG CB C 86 29.248 29.870 -0.622 1
1 986 . 4 1 1 A 86 86 ARG N N 86 118.362 121.730 -3.368 1
1 987 . 4 1 1 A 87 87 GLU H H 87 7.884 7.806 0.078 1
1 988 . 4 1 1 A 87 87 GLU HA H 87 4.064 4.112 -0.048 1
1 993 . 4 1 1 A 87 87 GLU C C 87 178.785 178.650 0.135 1
1 994 . 4 1 1 A 87 87 GLU CA C 87 58.999 59.470 -0.471 1
1 995 . 4 1 1 A 87 87 GLU CB C 87 29.872 29.017 0.855 1
1 997 . 4 1 1 A 87 87 GLU N N 87 118.124 118.680 -0.556 1
1 998 . 4 1 1 A 88 88 ILE H H 88 8.715 8.164 0.551 1
1 999 . 4 1 1 A 88 88 ILE HA H 88 3.305 3.468 -0.163 1
1 1009 . 4 1 1 A 88 88 ILE C C 88 177.261 177.961 -0.700 1
1 1010 . 4 1 1 A 88 88 ILE CA C 88 65.822 65.603 0.219 1
1 1011 . 4 1 1 A 88 88 ILE CB C 88 37.370 37.683 -0.313 1
1 1015 . 4 1 1 A 88 88 ILE N N 88 122.929 120.796 2.133 1
1 1016 . 4 1 1 A 89 89 LEU H H 89 8.486 8.345 0.141 1
1 1017 . 4 1 1 A 89 89 LEU HA H 89 3.932 3.894 0.038 1
1 1023 . 4 1 1 A 89 89 LEU C C 89 177.919 179.341 -1.422 1
1 1024 . 4 1 1 A 89 89 LEU CA C 89 59.060 57.612 1.448 1
1 1025 . 4 1 1 A 89 89 LEU CB C 89 41.129 41.545 -0.416 1
1 1028 . 4 1 1 A 89 89 LEU N N 89 122.696 119.600 3.096 1
1 1029 . 4 1 1 A 90 90 LYS H H 90 7.790 7.680 0.110 1
1 1030 . 4 1 1 A 90 90 LYS HA H 90 4.061 3.982 0.079 1
1 1035 . 4 1 1 A 90 90 LYS C C 90 178.432 178.479 -0.047 1
1 1036 . 4 1 1 A 90 90 LYS CA C 90 59.840 58.556 1.284 1
1 1037 . 4 1 1 A 90 90 LYS CB C 90 32.582 32.193 0.389 1
1 1039 . 4 1 1 A 90 90 LYS N N 90 118.640 121.034 -2.394 1
1 1040 . 4 1 1 A 91 91 ALA H H 91 8.113 8.083 0.030 1
1 1041 . 4 1 1 A 91 91 ALA HA H 91 4.151 4.071 0.080 1
1 1045 . 4 1 1 A 91 91 ALA C C 91 179.147 179.649 -0.502 1
1 1046 . 4 1 1 A 91 91 ALA CA C 91 54.942 55.266 -0.324 1
1 1047 . 4 1 1 A 91 91 ALA CB C 91 18.242 18.618 -0.376 1
1 1048 . 4 1 1 A 91 91 ALA N N 91 122.939 122.139 0.800 1
1 1049 . 4 1 1 A 92 92 SER H H 92 8.858 7.921 0.937 1
1 1050 . 4 1 1 A 92 92 SER HA H 92 4.898 4.179 0.719 1
1 1052 . 4 1 1 A 92 92 SER C C 92 172.440 176.391 -3.951 1
1 1053 . 4 1 1 A 92 92 SER CA C 92 61.913 61.331 0.582 1
1 1054 . 4 1 1 A 92 92 SER CB C 92 63.081 62.982 0.099 1
1 1055 . 4 1 1 A 92 92 SER N N 92 114.526 113.629 0.897 1
1 1056 . 4 1 1 A 93 93 ARG H H 93 7.704 8.578 -0.874 1
1 1057 . 4 1 1 A 93 93 ARG HA H 93 4.162 4.072 0.090 1
1 1059 . 4 1 1 A 93 93 ARG C C 93 177.757 178.477 -0.720 1
1 1060 . 4 1 1 A 93 93 ARG CA C 93 59.544 58.856 0.688 1
1 1061 . 4 1 1 A 93 93 ARG CB C 93 30.343 29.869 0.474 1
1 1062 . 4 1 1 A 93 93 ARG N N 93 121.505 120.022 1.483 1
1 1063 . 4 1 1 A 94 94 LYS H H 94 7.456 7.874 -0.418 1
1 1064 . 4 1 1 A 94 94 LYS HA H 94 4.174 4.211 -0.037 1
1 1071 . 4 1 1 A 94 94 LYS C C 94 178.861 178.735 0.126 1
1 1072 . 4 1 1 A 94 94 LYS CA C 94 59.030 58.962 0.068 1
1 1073 . 4 1 1 A 94 94 LYS CB C 94 32.239 31.913 0.326 1
1 1077 . 4 1 1 A 94 94 LYS N N 94 119.072 119.683 -0.611 1
1 1078 . 4 1 1 A 95 95 LEU H H 95 8.148 7.854 0.294 1
1 1079 . 4 1 1 A 95 95 LEU HA H 95 4.129 4.173 -0.044 1
1 1088 . 4 1 1 A 95 95 LEU C C 95 177.274 179.506 -2.232 1
1 1089 . 4 1 1 A 95 95 LEU CA C 95 57.136 56.916 0.220 1
1 1090 . 4 1 1 A 95 95 LEU CB C 95 41.908 41.828 0.080 1
1 1093 . 4 1 1 A 95 95 LEU N N 95 119.717 119.018 0.699 1
1 1094 . 4 1 1 A 96 96 GLN H H 96 7.807 8.205 -0.398 1
1 1095 . 4 1 1 A 96 96 GLN HA H 96 4.242 4.295 -0.053 1
1 1102 . 4 1 1 A 96 96 GLN C C 96 175.371 176.802 -1.431 1
1 1103 . 4 1 1 A 96 96 GLN CA C 96 56.397 55.724 0.673 1
1 1104 . 4 1 1 A 96 96 GLN CB C 96 29.123 29.228 -0.105 1
1 1106 . 4 1 1 A 96 96 GLN N N 96 114.581 116.139 -1.558 1
1 1108 . 4 1 1 A 97 97 GLY H H 97 7.802 7.873 -0.071 1
1 1109 . 4 1 1 A 97 97 GLY HA2 H 97 3.839 3.948 -0.109 1
1 1110 . 4 1 1 A 97 97 GLY HA3 H 97 4.096 3.949 0.147 1
1 1111 . 4 1 1 A 97 97 GLY C C 97 172.636 174.323 -1.687 1
1 1112 . 4 1 1 A 97 97 GLY CA C 97 46.372 46.389 -0.017 1
1 1113 . 4 1 1 A 97 97 GLY N N 97 106.959 109.467 -2.508 1
1 1114 . 4 1 1 A 98 98 ASP H H 98 8.156 8.018 0.138 1
1 1115 . 4 1 1 A 98 98 ASP HA H 98 4.754 4.888 -0.134 1
1 1118 . 4 1 1 A 98 98 ASP CA C 98 52.882 51.780 1.102 1
1 1119 . 4 1 1 A 98 98 ASP CB C 98 41.603 42.111 -0.508 1
1 1120 . 4 1 1 A 98 98 ASP N N 98 118.447 120.405 -1.958 1
1 1121 . 4 1 1 A 99 99 PRO HA H 99 4.470 4.304 0.166 1
1 1126 . 4 1 1 A 99 99 PRO C C 99 175.500 177.282 -1.782 1
1 1127 . 4 1 1 A 99 99 PRO CA C 99 63.601 65.844 -2.243 1
1 1128 . 4 1 1 A 99 99 PRO CB C 99 32.423 31.517 0.906 1
1 1130 . 4 1 1 A 100 100 ASP H H 100 8.527 7.850 0.677 1
1 1131 . 4 1 1 A 100 100 ASP HA H 100 4.778 4.930 -0.152 1
1 1134 . 4 1 1 A 100 100 ASP C C 100 174.931 175.071 -0.140 1
1 1135 . 4 1 1 A 100 100 ASP CA C 100 53.915 53.449 0.466 1
1 1136 . 4 1 1 A 100 100 ASP CB C 100 40.665 41.696 -1.031 1
1 1137 . 4 1 1 A 100 100 ASP N N 100 119.340 114.921 4.419 1
1 1138 . 4 1 1 A 101 101 LEU H H 101 7.379 7.790 -0.411 1
1 1139 . 4 1 1 A 101 101 LEU HA H 101 4.682 4.545 0.137 1
1 1148 . 4 1 1 A 101 101 LEU CA C 101 52.956 52.765 0.191 1
1 1149 . 4 1 1 A 101 101 LEU CB C 101 43.393 41.109 2.284 1
1 1152 . 4 1 1 A 101 101 LEU N N 101 122.107 121.255 0.852 1
1 1153 . 4 1 1 A 102 102 PRO HA H 102 4.487 4.872 -0.385 1
1 1158 . 4 1 1 A 102 102 PRO C C 102 175.697 175.501 0.196 1
1 1159 . 4 1 1 A 102 102 PRO CA C 102 63.113 62.790 0.323 1
1 1160 . 4 1 1 A 102 102 PRO CB C 102 32.138 32.254 -0.116 1
1 1163 . 4 1 1 A 103 103 MET H H 103 9.011 8.818 0.193 1
1 1164 . 4 1 1 A 103 103 MET HA H 103 4.769 4.879 -0.110 1
1 1171 . 4 1 1 A 103 103 MET C C 103 174.080 174.553 -0.473 1
1 1172 . 4 1 1 A 103 103 MET CA C 103 54.737 53.307 1.430 1
1 1173 . 4 1 1 A 103 103 MET CB C 103 34.857 34.608 0.249 1
1 1176 . 4 1 1 A 103 103 MET N N 103 123.334 121.124 2.210 1
1 1177 . 4 1 1 A 104 104 SER H H 104 8.239 8.687 -0.448 1
1 1178 . 4 1 1 A 104 104 SER HA H 104 5.079 5.588 -0.509 1
1 1181 . 4 1 1 A 104 104 SER C C 104 171.795 173.515 -1.720 1
1 1182 . 4 1 1 A 104 104 SER CA C 104 57.641 56.225 1.416 1
1 1183 . 4 1 1 A 104 104 SER CB C 104 66.282 66.515 -0.233 1
1 1184 . 4 1 1 A 104 104 SER N N 104 114.434 115.035 -0.601 1
1 1185 . 4 1 1 A 105 105 PHE H H 105 9.003 8.614 0.389 1
1 1186 . 4 1 1 A 105 105 PHE HA H 105 5.209 5.393 -0.184 1
1 1193 . 4 1 1 A 105 105 PHE C C 105 170.688 172.173 -1.485 1
1 1194 . 4 1 1 A 105 105 PHE CA C 105 56.917 55.849 1.068 1
1 1195 . 4 1 1 A 105 105 PHE CB C 105 41.350 41.370 -0.020 1
1 1196 . 4 1 1 A 105 105 PHE N N 105 116.224 117.196 -0.972 1
1 1197 . 4 1 1 A 106 106 THR H H 106 9.074 9.291 -0.217 1
1 1198 . 4 1 1 A 106 106 THR HA H 106 4.664 4.799 -0.135 1
1 1203 . 4 1 1 A 106 106 THR C C 106 171.767 174.607 -2.840 1
1 1204 . 4 1 1 A 106 106 THR CA C 106 62.162 61.935 0.227 1
1 1205 . 4 1 1 A 106 106 THR CB C 106 70.072 69.708 0.364 1
1 1207 . 4 1 1 A 106 106 THR N N 106 117.469 116.321 1.148 1
1 1208 . 4 1 1 A 107 107 LEU H H 107 9.804 9.224 0.580 1
1 1209 . 4 1 1 A 107 107 LEU HA H 107 4.750 4.721 0.029 1
1 1219 . 4 1 1 A 107 107 LEU C C 107 172.742 176.180 -3.438 1
1 1220 . 4 1 1 A 107 107 LEU CA C 107 54.151 54.741 -0.590 1
1 1221 . 4 1 1 A 107 107 LEU CB C 107 44.486 42.675 1.811 1
1 1224 . 4 1 1 A 107 107 LEU N N 107 133.400 128.653 4.747 1
1 1225 . 4 1 1 A 108 108 ALA H H 108 8.435 8.731 -0.296 1
1 1226 . 4 1 1 A 108 108 ALA HA H 108 4.683 4.615 0.068 1
1 1230 . 4 1 1 A 108 108 ALA C C 108 173.052 175.474 -2.422 1
1 1231 . 4 1 1 A 108 108 ALA CA C 108 49.308 50.303 -0.995 1
1 1232 . 4 1 1 A 108 108 ALA CB C 108 22.120 20.007 2.113 1
1 1233 . 4 1 1 A 108 108 ALA N N 108 131.422 127.084 4.338 1
1 1234 . 4 1 1 A 109 109 ILE H H 109 8.909 9.399 -0.490 1
1 1235 . 4 1 1 A 109 109 ILE HA H 109 4.063 5.142 -1.079 1
1 1245 . 4 1 1 A 109 109 ILE CA C 109 60.982 60.543 0.439 1
1 1246 . 4 1 1 A 109 109 ILE CB C 109 39.074 37.720 1.354 1
1 1250 . 4 1 1 A 109 109 ILE N N 109 124.415 123.857 0.558 1
1 1251 . 4 1 1 A 110 110 VAL H H 110 8.706 9.252 -0.546 1
1 1252 . 4 1 1 A 110 110 VAL HA H 110 4.324 5.222 -0.898 1
1 1260 . 4 1 1 A 110 110 VAL C C 110 175.700 174.155 1.545 1
1 1261 . 4 1 1 A 110 110 VAL CA C 110 62.316 59.643 2.673 1
1 1262 . 4 1 1 A 110 110 VAL CB C 110 31.876 34.354 -2.478 1
1 1264 . 4 1 1 A 110 110 VAL N N 110 127.457 123.238 4.219 1
1 1265 . 4 1 1 A 111 111 GLU H H 111 9.024 8.778 0.246 1
1 1266 . 4 1 1 A 111 111 GLU HA H 111 4.403 4.691 -0.288 1
1 1269 . 4 1 1 A 111 111 GLU C C 111 175.987 177.544 -1.557 1
1 1270 . 4 1 1 A 111 111 GLU CA C 111 56.842 55.983 0.859 1
1 1271 . 4 1 1 A 111 111 GLU CB C 111 31.044 31.869 -0.825 1
1 1272 . 4 1 1 A 111 111 GLU N N 111 129.768 125.527 4.241 1
1 1273 . 4 1 1 A 112 112 SER H H 112 9.143 9.064 0.079 1
1 1274 . 4 1 1 A 112 112 SER HA H 112 4.394 4.229 0.165 1
1 1276 . 4 1 1 A 112 112 SER C C 112 173.187 176.186 -2.999 1
1 1277 . 4 1 1 A 112 112 SER CA C 112 60.180 61.077 -0.897 1
1 1278 . 4 1 1 A 112 112 SER CB C 112 63.415 62.621 0.794 1
1 1279 . 4 1 1 A 112 112 SER N N 112 115.956 122.064 -6.108 1
1 1280 . 4 1 1 A 113 113 ASP H H 113 8.133 7.984 0.149 1
1 1281 . 4 1 1 A 113 113 ASP HA H 113 4.573 4.448 0.125 1
1 1284 . 4 1 1 A 113 113 ASP C C 113 175.430 176.186 -0.756 1
1 1285 . 4 1 1 A 113 113 ASP CA C 113 54.115 57.185 -3.070 1
1 1286 . 4 1 1 A 113 113 ASP CB C 113 40.011 41.099 -1.088 1
1 1287 . 4 1 1 A 113 113 ASP N N 113 118.343 121.542 -3.199 1
1 1288 . 4 1 1 A 114 114 SER H H 114 8.034 7.390 0.644 1
1 1289 . 4 1 1 A 114 114 SER HA H 114 4.057 4.589 -0.532 1
1 1291 . 4 1 1 A 114 114 SER C C 114 172.209 173.822 -1.613 1
1 1292 . 4 1 1 A 114 114 SER CA C 114 60.179 57.560 2.619 1
1 1293 . 4 1 1 A 114 114 SER CB C 114 62.702 65.143 -2.441 1
1 1294 . 4 1 1 A 114 114 SER N N 114 109.836 113.620 -3.784 1
1 1295 . 4 1 1 A 115 115 THR H H 115 7.711 7.722 -0.011 1
1 1296 . 4 1 1 A 115 115 THR HA H 115 4.250 4.511 -0.261 1
1 1300 . 4 1 1 A 115 115 THR C C 115 171.500 173.900 -2.400 1
1 1301 . 4 1 1 A 115 115 THR CA C 115 63.547 62.388 1.159 1
1 1302 . 4 1 1 A 115 115 THR CB C 115 69.595 69.929 -0.334 1
1 1303 . 4 1 1 A 115 115 THR N N 115 117.407 115.743 1.664 1
1 1304 . 4 1 1 A 116 116 ILE H H 116 8.219 9.138 -0.919 1
1 1305 . 4 1 1 A 116 116 ILE HA H 116 4.769 4.695 0.074 1
1 1315 . 4 1 1 A 116 116 ILE C C 116 174.434 174.602 -0.168 1
1 1316 . 4 1 1 A 116 116 ILE CA C 116 60.306 59.258 1.048 1
1 1317 . 4 1 1 A 116 116 ILE CB C 116 40.686 38.766 1.920 1
1 1321 . 4 1 1 A 116 116 ILE N N 116 125.480 128.272 -2.792 1
1 1322 . 4 1 1 A 117 117 VAL H H 117 8.695 9.446 -0.751 1
1 1323 . 4 1 1 A 117 117 VAL HA H 117 4.315 4.525 -0.210 1
1 1328 . 4 1 1 A 117 117 VAL C C 117 172.243 174.613 -2.370 1
1 1329 . 4 1 1 A 117 117 VAL CA C 117 60.621 61.127 -0.506 1
1 1330 . 4 1 1 A 117 117 VAL CB C 117 34.558 33.066 1.492 1
1 1332 . 4 1 1 A 117 117 VAL N N 117 127.887 127.050 0.837 1
1 1333 . 4 1 1 A 118 118 TYR H H 118 8.270 8.987 -0.717 1
1 1334 . 4 1 1 A 118 118 TYR HA H 118 5.327 5.200 0.127 1
1 1342 . 4 1 1 A 118 118 TYR C C 118 174.250 174.722 -0.472 1
1 1343 . 4 1 1 A 118 118 TYR CA C 118 57.283 56.982 0.301 1
1 1344 . 4 1 1 A 118 118 TYR CB C 118 39.262 39.138 0.124 1
1 1345 . 4 1 1 A 118 118 TYR N N 118 124.822 126.827 -2.005 1
1 1346 . 4 1 1 A 119 119 TYR H H 119 9.207 9.348 -0.141 1
1 1347 . 4 1 1 A 119 119 TYR HA H 119 4.821 5.324 -0.503 1
1 1354 . 4 1 1 A 119 119 TYR C C 119 171.994 173.624 -1.630 1
1 1355 . 4 1 1 A 119 119 TYR CA C 119 58.116 56.650 1.466 1
1 1356 . 4 1 1 A 119 119 TYR CB C 119 43.544 41.992 1.552 1
1 1357 . 4 1 1 A 119 119 TYR N N 119 125.153 125.154 -0.001 1
1 1358 . 4 1 1 A 120 120 LYS H H 120 7.700 8.544 -0.844 1
1 1359 . 4 1 1 A 120 120 LYS HA H 120 4.558 4.502 0.056 1
1 1366 . 4 1 1 A 120 120 LYS C C 120 172.017 174.789 -2.772 1
1 1367 . 4 1 1 A 120 120 LYS CA C 120 57.217 55.961 1.256 1
1 1368 . 4 1 1 A 120 120 LYS CB C 120 33.914 33.335 0.579 1
1 1372 . 4 1 1 A 120 120 LYS N N 120 129.442 129.469 -0.027 1
1 1373 . 4 1 1 A 121 121 LEU H H 121 8.112 8.742 -0.630 1
1 1374 . 4 1 1 A 121 121 LEU HA H 121 5.323 4.989 0.334 1
1 1384 . 4 1 1 A 121 121 LEU C C 121 175.733 174.607 1.126 1
1 1385 . 4 1 1 A 121 121 LEU CA C 121 52.716 52.951 -0.235 1
1 1386 . 4 1 1 A 121 121 LEU CB C 121 44.098 44.939 -0.841 1
1 1389 . 4 1 1 A 121 121 LEU N N 121 123.403 128.388 -4.985 1
1 1390 . 4 1 1 A 122 122 THR H H 122 8.338 9.017 -0.679 1
1 1391 . 4 1 1 A 122 122 THR HA H 122 5.097 4.748 0.349 1
1 1396 . 4 1 1 A 122 122 THR C C 122 173.221 172.919 0.302 1
1 1397 . 4 1 1 A 122 122 THR CA C 122 60.306 61.092 -0.786 1
1 1398 . 4 1 1 A 122 122 THR CB C 122 72.473 71.989 0.484 1
1 1400 . 4 1 1 A 122 122 THR N N 122 109.081 121.779 -12.698 1
1 7 . 5 1 1 A 2 2 GLU H H 2 8.994 8.538 0.456 1
1 8 . 5 1 1 A 2 2 GLU HA H 2 4.278 4.335 -0.057 1
1 13 . 5 1 1 A 2 2 GLU C C 2 175.315 175.553 -0.238 1
1 14 . 5 1 1 A 2 2 GLU CA C 2 57.318 57.109 0.209 1
1 15 . 5 1 1 A 2 2 GLU CB C 2 29.221 31.351 -2.130 1
1 17 . 5 1 1 A 2 2 GLU N N 2 122.259 121.903 0.356 1
1 18 . 5 1 1 A 3 3 ASP H H 3 8.048 8.006 0.042 1
1 19 . 5 1 1 A 3 3 ASP HA H 3 4.580 4.144 0.436 1
1 21 . 5 1 1 A 3 3 ASP C C 3 175.636 175.430 0.206 1
1 22 . 5 1 1 A 3 3 ASP CA C 3 54.579 53.498 1.081 1
1 23 . 5 1 1 A 3 3 ASP CB C 3 40.984 39.780 1.204 1
1 24 . 5 1 1 A 3 3 ASP N N 3 119.830 118.883 0.947 1
1 25 . 5 1 1 A 4 4 ALA H H 4 8.090 7.252 0.838 1
1 26 . 5 1 1 A 4 4 ALA HA H 4 4.216 4.491 -0.275 1
1 30 . 5 1 1 A 4 4 ALA C C 4 177.157 178.649 -1.492 1
1 31 . 5 1 1 A 4 4 ALA CA C 4 53.620 52.916 0.704 1
1 32 . 5 1 1 A 4 4 ALA CB C 4 18.728 20.953 -2.225 1
1 33 . 5 1 1 A 4 4 ALA N N 4 123.957 122.938 1.019 1
1 34 . 5 1 1 A 5 5 TRP H H 5 7.941 7.384 0.557 1
1 35 . 5 1 1 A 5 5 TRP HA H 5 4.559 4.462 0.097 1
1 39 . 5 1 1 A 5 5 TRP C C 5 176.072 176.886 -0.814 1
1 40 . 5 1 1 A 5 5 TRP CA C 5 57.744 58.381 -0.637 1
1 41 . 5 1 1 A 5 5 TRP CB C 5 28.906 28.462 0.444 1
1 42 . 5 1 1 A 5 5 TRP N N 5 118.408 117.637 0.771 1
1 44 . 5 1 1 A 6 6 MET H H 6 7.679 7.545 0.134 1
1 45 . 5 1 1 A 6 6 MET HA H 6 3.785 4.697 -0.912 1
1 52 . 5 1 1 A 6 6 MET C C 6 175.174 176.289 -1.115 1
1 53 . 5 1 1 A 6 6 MET CA C 6 57.724 54.781 2.943 1
1 54 . 5 1 1 A 6 6 MET CB C 6 31.640 34.201 -2.561 1
1 57 . 5 1 1 A 6 6 MET N N 6 121.538 115.341 6.197 1
1 58 . 5 1 1 A 7 7 GLY H H 7 7.247 7.999 -0.752 1
1 59 . 5 1 1 A 7 7 GLY HA2 H 7 3.455 3.843 -0.388 1
1 60 . 5 1 1 A 7 7 GLY HA3 H 7 3.578 4.117 -0.539 1
1 61 . 5 1 1 A 7 7 GLY C C 7 172.852 175.169 -2.317 1
1 62 . 5 1 1 A 7 7 GLY CA C 7 45.896 46.696 -0.800 1
1 63 . 5 1 1 A 7 7 GLY N N 7 104.055 109.006 -4.951 1
1 64 . 5 1 1 A 8 8 THR H H 8 7.436 7.961 -0.525 1
1 65 . 5 1 1 A 8 8 THR HA H 8 4.428 4.723 -0.295 1
1 70 . 5 1 1 A 8 8 THR C C 8 172.973 174.830 -1.857 1
1 71 . 5 1 1 A 8 8 THR CA C 8 60.751 61.109 -0.358 1
1 72 . 5 1 1 A 8 8 THR CB C 8 69.637 69.625 0.012 1
1 74 . 5 1 1 A 8 8 THR N N 8 107.669 110.105 -2.436 1
1 75 . 5 1 1 A 9 9 HIS H H 9 8.048 7.567 0.481 1
1 76 . 5 1 1 A 9 9 HIS HA H 9 4.654 4.667 -0.013 1
1 79 . 5 1 1 A 9 9 HIS CA C 9 56.163 55.515 0.648 1
1 80 . 5 1 1 A 9 9 HIS CB C 9 32.619 29.830 2.789 1
1 81 . 5 1 1 A 9 9 HIS N N 9 127.281 122.491 4.790 1
1 82 . 5 1 1 A 10 10 PRO HA H 10 4.257 4.219 0.038 1
1 88 . 5 1 1 A 10 10 PRO C C 10 178.779 179.196 -0.417 1
1 89 . 5 1 1 A 10 10 PRO CA C 10 65.565 66.067 -0.502 1
1 90 . 5 1 1 A 10 10 PRO CB C 10 32.422 31.843 0.579 1
1 93 . 5 1 1 A 11 11 LYS H H 11 10.994 8.469 2.525 1
1 94 . 5 1 1 A 11 11 LYS HA H 11 4.282 4.140 0.142 1
1 100 . 5 1 1 A 11 11 LYS C C 11 177.279 178.533 -1.254 1
1 101 . 5 1 1 A 11 11 LYS CA C 11 56.859 59.565 -2.706 1
1 102 . 5 1 1 A 11 11 LYS CB C 11 31.279 32.263 -0.984 1
1 104 . 5 1 1 A 11 11 LYS N N 11 121.398 118.291 3.107 1
1 105 . 5 1 1 A 12 12 TYR H H 12 7.146 8.190 -1.044 1
1 106 . 5 1 1 A 12 12 TYR HA H 12 3.722 4.380 -0.658 1
1 113 . 5 1 1 A 12 12 TYR C C 12 176.265 177.480 -1.215 1
1 114 . 5 1 1 A 12 12 TYR CA C 12 61.189 61.387 -0.198 1
1 115 . 5 1 1 A 12 12 TYR CB C 12 37.796 38.328 -0.532 1
1 116 . 5 1 1 A 12 12 TYR N N 12 121.579 121.206 0.373 1
1 117 . 5 1 1 A 13 13 LEU H H 13 7.778 8.779 -1.001 1
1 118 . 5 1 1 A 13 13 LEU HA H 13 3.773 3.841 -0.068 1
1 127 . 5 1 1 A 13 13 LEU C C 13 178.462 178.625 -0.163 1
1 128 . 5 1 1 A 13 13 LEU CA C 13 57.942 58.099 -0.157 1
1 129 . 5 1 1 A 13 13 LEU CB C 13 41.064 41.408 -0.344 1
1 132 . 5 1 1 A 13 13 LEU N N 13 117.518 120.795 -3.277 1
1 133 . 5 1 1 A 14 14 GLU H H 14 7.867 8.242 -0.375 1
1 134 . 5 1 1 A 14 14 GLU HA H 14 3.935 3.885 0.050 1
1 139 . 5 1 1 A 14 14 GLU C C 14 178.326 178.981 -0.655 1
1 140 . 5 1 1 A 14 14 GLU CA C 14 59.368 59.790 -0.422 1
1 141 . 5 1 1 A 14 14 GLU CB C 14 30.147 29.098 1.049 1
1 143 . 5 1 1 A 14 14 GLU N N 14 119.135 118.393 0.742 1
1 144 . 5 1 1 A 15 15 MET H H 15 7.773 7.811 -0.038 1
1 145 . 5 1 1 A 15 15 MET HA H 15 3.936 4.079 -0.143 1
1 152 . 5 1 1 A 15 15 MET C C 15 177.886 177.869 0.017 1
1 153 . 5 1 1 A 15 15 MET CA C 15 59.465 58.113 1.352 1
1 154 . 5 1 1 A 15 15 MET CB C 15 33.987 32.215 1.772 1
1 157 . 5 1 1 A 15 15 MET N N 15 117.884 119.745 -1.861 1
1 158 . 5 1 1 A 16 16 MET H H 16 8.145 8.545 -0.400 1
1 159 . 5 1 1 A 16 16 MET HA H 16 4.159 4.071 0.088 1
1 166 . 5 1 1 A 16 16 MET C C 16 177.835 177.514 0.321 1
1 167 . 5 1 1 A 16 16 MET CA C 16 57.397 57.497 -0.100 1
1 168 . 5 1 1 A 16 16 MET CB C 16 31.867 31.742 0.125 1
1 171 . 5 1 1 A 16 16 MET N N 16 119.555 117.818 1.737 1
1 172 . 5 1 1 A 17 17 GLU H H 17 7.761 7.790 -0.029 1
1 173 . 5 1 1 A 17 17 GLU HA H 17 4.117 4.190 -0.073 1
1 176 . 5 1 1 A 17 17 GLU C C 17 175.994 175.952 0.042 1
1 177 . 5 1 1 A 17 17 GLU CA C 17 57.392 57.545 -0.153 1
1 178 . 5 1 1 A 17 17 GLU CB C 17 29.432 29.741 -0.309 1
1 180 . 5 1 1 A 17 17 GLU N N 17 118.216 118.862 -0.646 1
1 181 . 5 1 1 A 18 18 LEU H H 18 7.201 7.273 -0.072 1
1 182 . 5 1 1 A 18 18 LEU HA H 18 4.111 4.335 -0.224 1
1 191 . 5 1 1 A 18 18 LEU C C 18 175.781 177.233 -1.452 1
1 192 . 5 1 1 A 18 18 LEU CA C 18 56.366 53.593 2.773 1
1 193 . 5 1 1 A 18 18 LEU CB C 18 42.030 43.784 -1.754 1
1 196 . 5 1 1 A 18 18 LEU N N 18 117.448 119.249 -1.801 1
1 197 . 5 1 1 A 19 19 ASP H H 19 7.789 8.677 -0.888 1
1 198 . 5 1 1 A 19 19 ASP HA H 19 4.360 4.584 -0.224 1
1 201 . 5 1 1 A 19 19 ASP C C 19 173.765 175.986 -2.221 1
1 202 . 5 1 1 A 19 19 ASP CA C 19 54.851 55.393 -0.542 1
1 203 . 5 1 1 A 19 19 ASP CB C 19 39.115 40.934 -1.819 1
1 204 . 5 1 1 A 19 19 ASP N N 19 115.844 117.120 -1.276 1
1 205 . 5 1 1 A 20 20 ILE H H 20 8.142 7.466 0.676 1
1 206 . 5 1 1 A 20 20 ILE HA H 20 4.128 4.441 -0.313 1
1 216 . 5 1 1 A 20 20 ILE C C 20 174.710 175.153 -0.443 1
1 217 . 5 1 1 A 20 20 ILE CA C 20 60.465 60.546 -0.081 1
1 218 . 5 1 1 A 20 20 ILE CB C 20 40.407 39.643 0.764 1
1 222 . 5 1 1 A 20 20 ILE N N 20 117.287 119.439 -2.152 1
1 223 . 5 1 1 A 21 21 GLY H H 21 8.207 8.982 -0.775 1
1 224 . 5 1 1 A 21 21 GLY HA2 H 21 3.889 3.903 -0.014 1
1 225 . 5 1 1 A 21 21 GLY HA3 H 21 3.924 3.911 0.013 1
1 226 . 5 1 1 A 21 21 GLY C C 21 172.162 172.552 -0.390 1
1 227 . 5 1 1 A 21 21 GLY CA C 21 45.017 46.657 -1.640 1
1 228 . 5 1 1 A 21 21 GLY N N 21 110.656 114.607 -3.951 1
1 229 . 5 1 1 A 22 22 ASP H H 22 7.727 8.424 -0.697 1
1 230 . 5 1 1 A 22 22 ASP HA H 22 4.794 4.979 -0.185 1
1 233 . 5 1 1 A 22 22 ASP C C 22 174.884 176.375 -1.491 1
1 234 . 5 1 1 A 22 22 ASP CA C 22 52.471 52.492 -0.021 1
1 235 . 5 1 1 A 22 22 ASP CB C 22 42.069 42.491 -0.422 1
1 236 . 5 1 1 A 22 22 ASP N N 22 119.305 125.367 -6.062 1
1 237 . 5 1 1 A 23 23 ALA H H 23 8.644 9.039 -0.395 1
1 238 . 5 1 1 A 23 23 ALA HA H 23 4.120 3.987 0.133 1
1 242 . 5 1 1 A 23 23 ALA C C 23 179.546 179.549 -0.003 1
1 243 . 5 1 1 A 23 23 ALA CA C 23 55.609 55.347 0.262 1
1 244 . 5 1 1 A 23 23 ALA CB C 23 18.573 18.531 0.042 1
1 245 . 5 1 1 A 23 23 ALA N N 23 122.468 129.088 -6.620 1
1 246 . 5 1 1 A 24 24 THR H H 24 8.238 7.598 0.640 1
1 247 . 5 1 1 A 24 24 THR HA H 24 4.184 4.081 0.103 1
1 252 . 5 1 1 A 24 24 THR C C 24 174.841 176.438 -1.597 1
1 253 . 5 1 1 A 24 24 THR CA C 24 66.241 66.232 0.009 1
1 254 . 5 1 1 A 24 24 THR CB C 24 68.376 68.873 -0.497 1
1 256 . 5 1 1 A 24 24 THR N N 24 114.824 113.759 1.065 1
1 257 . 5 1 1 A 25 25 GLN H H 25 8.037 9.005 -0.968 1
1 258 . 5 1 1 A 25 25 GLN HA H 25 4.095 4.012 0.083 1
1 265 . 5 1 1 A 25 25 GLN C C 25 177.603 178.099 -0.496 1
1 266 . 5 1 1 A 25 25 GLN CA C 25 59.261 59.095 0.166 1
1 267 . 5 1 1 A 25 25 GLN CB C 25 28.437 28.779 -0.342 1
1 269 . 5 1 1 A 25 25 GLN N N 25 122.518 121.498 1.020 1
1 271 . 5 1 1 A 26 26 VAL H H 26 7.994 8.402 -0.408 1
1 272 . 5 1 1 A 26 26 VAL HA H 26 3.469 3.824 -0.355 1
1 280 . 5 1 1 A 26 26 VAL C C 26 175.552 177.827 -2.275 1
1 281 . 5 1 1 A 26 26 VAL CA C 26 66.909 65.799 1.110 1
1 282 . 5 1 1 A 26 26 VAL CB C 26 31.582 31.451 0.131 1
1 285 . 5 1 1 A 26 26 VAL N N 26 119.112 118.938 0.174 1
1 286 . 5 1 1 A 27 27 TYR H H 27 8.003 8.200 -0.197 1
1 287 . 5 1 1 A 27 27 TYR HA H 27 4.357 4.263 0.094 1
1 294 . 5 1 1 A 27 27 TYR C C 27 175.856 177.066 -1.210 1
1 295 . 5 1 1 A 27 27 TYR CA C 27 62.197 61.951 0.246 1
1 296 . 5 1 1 A 27 27 TYR CB C 27 38.394 38.752 -0.358 1
1 297 . 5 1 1 A 27 27 TYR N N 27 119.170 124.888 -5.718 1
1 298 . 5 1 1 A 28 28 VAL H H 28 8.087 8.250 -0.163 1
1 299 . 5 1 1 A 28 28 VAL HA H 28 3.652 3.513 0.139 1
1 307 . 5 1 1 A 28 28 VAL C C 28 176.134 177.950 -1.816 1
1 308 . 5 1 1 A 28 28 VAL CA C 28 66.247 66.236 0.011 1
1 309 . 5 1 1 A 28 28 VAL CB C 28 31.241 31.403 -0.162 1
1 312 . 5 1 1 A 28 28 VAL N N 28 113.112 119.650 -6.538 1
1 313 . 5 1 1 A 29 29 ALA H H 29 7.853 8.947 -1.094 1
1 314 . 5 1 1 A 29 29 ALA HA H 29 3.913 4.079 -0.166 1
1 318 . 5 1 1 A 29 29 ALA C C 29 177.850 179.471 -1.621 1
1 319 . 5 1 1 A 29 29 ALA CA C 29 55.274 55.064 0.210 1
1 320 . 5 1 1 A 29 29 ALA CB C 29 17.876 18.239 -0.363 1
1 321 . 5 1 1 A 29 29 ALA N N 29 121.350 123.103 -1.753 1
1 322 . 5 1 1 A 30 30 PHE H H 30 8.724 8.413 0.311 1
1 323 . 5 1 1 A 30 30 PHE HA H 30 4.098 4.419 -0.321 1
1 327 . 5 1 1 A 30 30 PHE C C 30 175.035 177.283 -2.248 1
1 328 . 5 1 1 A 30 30 PHE CA C 30 61.264 61.571 -0.307 1
1 329 . 5 1 1 A 30 30 PHE CB C 30 38.926 39.347 -0.421 1
1 330 . 5 1 1 A 30 30 PHE N N 30 120.478 120.184 0.294 1
1 331 . 5 1 1 A 31 31 LEU H H 31 8.146 8.014 0.132 1
1 332 . 5 1 1 A 31 31 LEU HA H 31 3.597 3.610 -0.013 1
1 341 . 5 1 1 A 31 31 LEU C C 31 179.508 179.272 0.236 1
1 342 . 5 1 1 A 31 31 LEU CA C 31 57.884 58.130 -0.246 1
1 343 . 5 1 1 A 31 31 LEU CB C 31 41.829 42.471 -0.642 1
1 346 . 5 1 1 A 31 31 LEU N N 31 118.427 120.310 -1.883 1
1 347 . 5 1 1 A 32 32 VAL H H 32 7.627 7.731 -0.104 1
1 348 . 5 1 1 A 32 32 VAL HA H 32 3.464 3.906 -0.442 1
1 356 . 5 1 1 A 32 32 VAL C C 32 174.956 177.749 -2.793 1
1 357 . 5 1 1 A 32 32 VAL CA C 32 66.373 65.585 0.788 1
1 358 . 5 1 1 A 32 32 VAL CB C 32 31.121 31.521 -0.400 1
1 361 . 5 1 1 A 32 32 VAL N N 32 119.497 113.983 5.514 1
1 362 . 5 1 1 A 33 33 TYR H H 33 8.366 8.650 -0.284 1
1 363 . 5 1 1 A 33 33 TYR HA H 33 3.485 4.095 -0.610 1
1 370 . 5 1 1 A 33 33 TYR C C 33 174.883 177.026 -2.143 1
1 371 . 5 1 1 A 33 33 TYR CA C 33 62.866 61.424 1.442 1
1 372 . 5 1 1 A 33 33 TYR CB C 33 37.778 38.381 -0.603 1
1 373 . 5 1 1 A 33 33 TYR N N 33 121.842 124.331 -2.489 1
1 374 . 5 1 1 A 34 34 LEU H H 34 8.000 8.531 -0.531 1
1 375 . 5 1 1 A 34 34 LEU HA H 34 3.495 3.734 -0.239 1
1 385 . 5 1 1 A 34 34 LEU C C 34 178.240 179.140 -0.900 1
1 386 . 5 1 1 A 34 34 LEU CA C 34 57.453 57.297 0.156 1
1 387 . 5 1 1 A 34 34 LEU CB C 34 41.828 41.110 0.718 1
1 390 . 5 1 1 A 34 34 LEU N N 34 116.692 119.604 -2.912 1
1 391 . 5 1 1 A 35 35 ASP H H 35 7.688 8.025 -0.337 1
1 392 . 5 1 1 A 35 35 ASP HA H 35 4.302 4.335 -0.033 1
1 395 . 5 1 1 A 35 35 ASP C C 35 177.507 178.554 -1.047 1
1 396 . 5 1 1 A 35 35 ASP CA C 35 58.196 57.600 0.596 1
1 397 . 5 1 1 A 35 35 ASP CB C 35 43.070 41.327 1.743 1
1 398 . 5 1 1 A 35 35 ASP N N 35 120.507 120.045 0.462 1
1 399 . 5 1 1 A 36 36 LEU H H 36 8.482 8.646 -0.164 1
1 400 . 5 1 1 A 36 36 LEU HA H 36 3.328 3.871 -0.543 1
1 410 . 5 1 1 A 36 36 LEU C C 36 176.774 178.903 -2.129 1
1 411 . 5 1 1 A 36 36 LEU CA C 36 57.461 57.718 -0.257 1
1 412 . 5 1 1 A 36 36 LEU CB C 36 41.344 41.673 -0.329 1
1 416 . 5 1 1 A 36 36 LEU N N 36 117.671 120.226 -2.555 1
1 417 . 5 1 1 A 37 37 MET H H 37 7.822 7.614 0.208 1
1 418 . 5 1 1 A 37 37 MET HA H 37 4.401 4.271 0.130 1
1 425 . 5 1 1 A 37 37 MET C C 37 177.862 177.229 0.633 1
1 426 . 5 1 1 A 37 37 MET CA C 37 56.434 57.476 -1.042 1
1 427 . 5 1 1 A 37 37 MET CB C 37 31.573 33.151 -1.578 1
1 430 . 5 1 1 A 37 37 MET N N 37 112.952 116.431 -3.479 1
1 431 . 5 1 1 A 38 38 GLU H H 38 8.667 8.083 0.584 1
1 432 . 5 1 1 A 38 38 GLU HA H 38 4.457 4.275 0.182 1
1 436 . 5 1 1 A 38 38 GLU C C 38 176.582 176.942 -0.360 1
1 437 . 5 1 1 A 38 38 GLU CA C 38 57.659 56.818 0.841 1
1 438 . 5 1 1 A 38 38 GLU CB C 38 29.936 30.397 -0.461 1
1 440 . 5 1 1 A 38 38 GLU N N 38 116.463 116.917 -0.454 1
1 441 . 5 1 1 A 39 39 SER H H 39 7.657 8.167 -0.510 1
1 442 . 5 1 1 A 39 39 SER HA H 39 4.658 4.629 0.029 1
1 445 . 5 1 1 A 39 39 SER C C 39 175.661 176.244 -0.583 1
1 446 . 5 1 1 A 39 39 SER CA C 39 60.449 59.499 0.950 1
1 447 . 5 1 1 A 39 39 SER CB C 39 63.341 64.493 -1.152 1
1 448 . 5 1 1 A 39 39 SER N N 39 113.870 115.330 -1.460 1
1 449 . 5 1 1 A 40 40 LYS H H 40 8.165 8.004 0.161 1
1 450 . 5 1 1 A 40 40 LYS HA H 40 4.454 3.868 0.586 1
1 458 . 5 1 1 A 40 40 LYS C C 40 174.970 175.337 -0.367 1
1 459 . 5 1 1 A 40 40 LYS CA C 40 55.753 57.957 -2.204 1
1 460 . 5 1 1 A 40 40 LYS CB C 40 32.337 32.273 0.064 1
1 464 . 5 1 1 A 40 40 LYS N N 40 116.671 122.086 -5.415 1
1 465 . 5 1 1 A 41 41 SER H H 41 7.017 7.754 -0.737 1
1 466 . 5 1 1 A 41 41 SER HA H 41 4.209 4.456 -0.247 1
1 469 . 5 1 1 A 41 41 SER C C 41 173.770 173.517 0.253 1
1 470 . 5 1 1 A 41 41 SER CA C 41 58.435 58.863 -0.428 1
1 471 . 5 1 1 A 41 41 SER CB C 41 61.700 61.606 0.094 1
1 472 . 5 1 1 A 41 41 SER N N 41 109.989 112.702 -2.713 1
1 473 . 5 1 1 A 42 42 TRP H H 42 8.876 7.686 1.190 1
1 474 . 5 1 1 A 42 42 TRP HA H 42 4.698 4.898 -0.200 1
1 478 . 5 1 1 A 42 42 TRP C C 42 174.477 177.572 -3.095 1
1 479 . 5 1 1 A 42 42 TRP CA C 42 59.443 57.190 2.253 1
1 480 . 5 1 1 A 42 42 TRP CB C 42 28.203 31.402 -3.199 1
1 481 . 5 1 1 A 42 42 TRP N N 42 121.116 122.861 -1.745 1
1 483 . 5 1 1 A 43 43 HIS H H 43 8.132 8.478 -0.346 1
1 484 . 5 1 1 A 43 43 HIS HA H 43 4.445 4.382 0.063 1
1 488 . 5 1 1 A 43 43 HIS C C 43 174.405 174.399 0.006 1
1 489 . 5 1 1 A 43 43 HIS CA C 43 58.556 59.424 -0.868 1
1 490 . 5 1 1 A 43 43 HIS CB C 43 29.430 30.516 -1.086 1
1 491 . 5 1 1 A 43 43 HIS N N 43 119.397 121.336 -1.939 1
1 492 . 5 1 1 A 44 44 GLU H H 44 8.140 7.494 0.646 1
1 493 . 5 1 1 A 44 44 GLU HA H 44 4.432 4.587 -0.155 1
1 497 . 5 1 1 A 44 44 GLU C C 44 173.010 174.252 -1.242 1
1 498 . 5 1 1 A 44 44 GLU CA C 44 56.421 56.166 0.255 1
1 499 . 5 1 1 A 44 44 GLU CB C 44 33.285 33.420 -0.135 1
1 501 . 5 1 1 A 44 44 GLU N N 44 116.181 117.985 -1.804 1
1 502 . 5 1 1 A 45 45 VAL H H 45 8.428 8.542 -0.114 1
1 503 . 5 1 1 A 45 45 VAL HA H 45 4.492 4.883 -0.391 1
1 511 . 5 1 1 A 45 45 VAL C C 45 172.339 174.539 -2.200 1
1 512 . 5 1 1 A 45 45 VAL CA C 45 63.071 60.720 2.351 1
1 513 . 5 1 1 A 45 45 VAL CB C 45 35.145 35.605 -0.460 1
1 516 . 5 1 1 A 45 45 VAL N N 45 123.272 125.887 -2.615 1
1 517 . 5 1 1 A 46 46 ASN H H 46 9.050 9.146 -0.096 1
1 518 . 5 1 1 A 46 46 ASN HA H 46 5.261 5.606 -0.345 1
1 523 . 5 1 1 A 46 46 ASN C C 46 172.845 173.691 -0.846 1
1 524 . 5 1 1 A 46 46 ASN CA C 46 51.895 51.687 0.208 1
1 525 . 5 1 1 A 46 46 ASN CB C 46 42.322 42.845 -0.523 1
1 526 . 5 1 1 A 46 46 ASN N N 46 123.901 122.989 0.912 1
1 528 . 5 1 1 A 47 47 CYS H H 47 9.039 9.084 -0.045 1
1 529 . 5 1 1 A 47 47 CYS HA H 47 5.160 5.553 -0.393 1
1 532 . 5 1 1 A 47 47 CYS C C 47 172.454 173.424 -0.970 1
1 533 . 5 1 1 A 47 47 CYS CA C 47 56.473 57.362 -0.889 1
1 534 . 5 1 1 A 47 47 CYS CB C 47 29.297 30.407 -1.110 1
1 535 . 5 1 1 A 47 47 CYS N N 47 119.663 118.905 0.758 1
1 536 . 5 1 1 A 48 48 VAL H H 48 9.083 9.186 -0.103 1
1 537 . 5 1 1 A 48 48 VAL HA H 48 4.344 4.746 -0.402 1
1 542 . 5 1 1 A 48 48 VAL C C 48 173.307 174.635 -1.328 1
1 543 . 5 1 1 A 48 48 VAL CA C 48 61.368 60.787 0.581 1
1 544 . 5 1 1 A 48 48 VAL CB C 48 35.345 35.397 -0.052 1
1 546 . 5 1 1 A 48 48 VAL N N 48 124.672 123.272 1.400 1
1 547 . 5 1 1 A 49 49 GLY H H 49 9.019 9.075 -0.056 1
1 548 . 5 1 1 A 49 49 GLY HA2 H 49 3.460 4.199 -0.739 1
1 549 . 5 1 1 A 49 49 GLY HA3 H 49 4.539 4.202 0.337 1
1 550 . 5 1 1 A 49 49 GLY C C 49 171.278 172.222 -0.944 1
1 551 . 5 1 1 A 49 49 GLY CA C 49 45.075 44.432 0.643 1
1 552 . 5 1 1 A 49 49 GLY N N 49 113.131 115.643 -2.512 1
1 553 . 5 1 1 A 50 50 LEU H H 50 8.747 9.081 -0.334 1
1 554 . 5 1 1 A 50 50 LEU HA H 50 5.102 4.987 0.115 1
1 564 . 5 1 1 A 50 50 LEU CA C 50 51.417 51.344 0.073 1
1 565 . 5 1 1 A 50 50 LEU CB C 50 41.754 42.428 -0.674 1
1 569 . 5 1 1 A 50 50 LEU N N 50 124.471 125.736 -1.265 1
1 570 . 5 1 1 A 51 51 PRO HA H 51 4.106 4.305 -0.199 1
1 577 . 5 1 1 A 51 51 PRO C C 51 178.422 178.694 -0.272 1
1 578 . 5 1 1 A 51 51 PRO CA C 51 65.680 64.718 0.962 1
1 579 . 5 1 1 A 51 51 PRO CB C 51 31.939 32.114 -0.175 1
1 582 . 5 1 1 A 52 52 GLU H H 52 9.721 8.499 1.222 1
1 583 . 5 1 1 A 52 52 GLU HA H 52 4.176 4.075 0.101 1
1 588 . 5 1 1 A 52 52 GLU C C 52 176.146 178.152 -2.006 1
1 589 . 5 1 1 A 52 52 GLU CA C 52 59.158 59.428 -0.270 1
1 590 . 5 1 1 A 52 52 GLU CB C 52 28.442 29.310 -0.868 1
1 592 . 5 1 1 A 52 52 GLU N N 52 118.552 117.764 0.788 1
1 593 . 5 1 1 A 53 53 LEU H H 53 7.089 7.821 -0.732 1
1 594 . 5 1 1 A 53 53 LEU HA H 53 4.511 4.344 0.167 1
1 603 . 5 1 1 A 53 53 LEU C C 53 174.027 176.853 -2.826 1
1 604 . 5 1 1 A 53 53 LEU CA C 53 53.825 54.730 -0.905 1
1 605 . 5 1 1 A 53 53 LEU CB C 53 43.825 42.483 1.342 1
1 608 . 5 1 1 A 53 53 LEU N N 53 116.763 117.848 -1.085 1
1 609 . 5 1 1 A 54 54 GLN H H 54 7.964 8.000 -0.036 1
1 610 . 5 1 1 A 54 54 GLN HA H 54 3.591 3.897 -0.306 1
1 616 . 5 1 1 A 54 54 GLN C C 54 172.604 174.275 -1.671 1
1 617 . 5 1 1 A 54 54 GLN CA C 54 56.961 57.248 -0.287 1
1 618 . 5 1 1 A 54 54 GLN CB C 54 26.545 27.768 -1.223 1
1 620 . 5 1 1 A 54 54 GLN N N 54 115.489 118.816 -3.327 1
1 622 . 5 1 1 A 55 55 LEU H H 55 7.139 7.193 -0.054 1
1 623 . 5 1 1 A 55 55 LEU HA H 55 4.750 4.900 -0.150 1
1 629 . 5 1 1 A 55 55 LEU C C 55 173.475 175.366 -1.891 1
1 630 . 5 1 1 A 55 55 LEU CA C 55 53.698 53.400 0.298 1
1 631 . 5 1 1 A 55 55 LEU CB C 55 47.859 44.374 3.485 1
1 633 . 5 1 1 A 55 55 LEU N N 55 116.422 119.467 -3.045 1
1 634 . 5 1 1 A 56 56 ILE H H 56 8.223 8.605 -0.382 1
1 635 . 5 1 1 A 56 56 ILE HA H 56 4.540 5.207 -0.667 1
1 643 . 5 1 1 A 56 56 ILE C C 56 173.938 174.625 -0.687 1
1 644 . 5 1 1 A 56 56 ILE CA C 56 61.020 59.640 1.380 1
1 645 . 5 1 1 A 56 56 ILE CB C 56 39.403 41.335 -1.932 1
1 648 . 5 1 1 A 56 56 ILE N N 56 122.792 121.739 1.053 1
1 649 . 5 1 1 A 57 57 CYS H H 57 8.995 9.063 -0.068 1
1 650 . 5 1 1 A 57 57 CYS HA H 57 5.036 5.042 -0.006 1
1 653 . 5 1 1 A 57 57 CYS C C 57 170.483 173.205 -2.722 1
1 654 . 5 1 1 A 57 57 CYS CA C 57 56.484 58.083 -1.599 1
1 655 . 5 1 1 A 57 57 CYS CB C 57 30.545 31.550 -1.005 1
1 656 . 5 1 1 A 57 57 CYS N N 57 121.575 124.964 -3.389 1
1 657 . 5 1 1 A 58 58 LEU H H 58 9.076 8.856 0.220 1
1 658 . 5 1 1 A 58 58 LEU HA H 58 5.472 5.487 -0.015 1
1 668 . 5 1 1 A 58 58 LEU C C 58 174.009 175.982 -1.973 1
1 669 . 5 1 1 A 58 58 LEU CA C 58 52.851 53.743 -0.892 1
1 670 . 5 1 1 A 58 58 LEU CB C 58 42.177 42.947 -0.770 1
1 674 . 5 1 1 A 58 58 LEU N N 58 121.895 125.391 -3.496 1
1 675 . 5 1 1 A 59 59 VAL H H 59 8.966 8.594 0.372 1
1 676 . 5 1 1 A 59 59 VAL HA H 59 5.488 5.380 0.108 1
1 681 . 5 1 1 A 59 59 VAL C C 59 176.034 175.857 0.177 1
1 682 . 5 1 1 A 59 59 VAL CA C 59 59.820 60.726 -0.906 1
1 683 . 5 1 1 A 59 59 VAL CB C 59 34.786 35.104 -0.318 1
1 685 . 5 1 1 A 59 59 VAL N N 59 121.702 124.531 -2.829 1
1 686 . 5 1 1 A 60 60 GLY H H 60 9.258 8.369 0.889 1
1 687 . 5 1 1 A 60 60 GLY HA2 H 60 4.673 4.331 0.342 1
1 688 . 5 1 1 A 60 60 GLY HA3 H 60 4.804 4.339 0.465 1
1 689 . 5 1 1 A 60 60 GLY C C 60 169.831 172.922 -3.091 1
1 690 . 5 1 1 A 60 60 GLY CA C 60 46.399 45.865 0.534 1
1 691 . 5 1 1 A 60 60 GLY N N 60 114.126 113.121 1.005 1
1 692 . 5 1 1 A 61 61 THR H H 61 8.834 8.430 0.404 1
1 693 . 5 1 1 A 61 61 THR HA H 61 4.418 5.090 -0.672 1
1 698 . 5 1 1 A 61 61 THR C C 61 171.985 174.999 -3.014 1
1 699 . 5 1 1 A 61 61 THR CA C 61 60.634 60.682 -0.048 1
1 700 . 5 1 1 A 61 61 THR CB C 61 70.983 70.422 0.561 1
1 702 . 5 1 1 A 61 61 THR N N 61 114.856 111.361 3.495 1
1 703 . 5 1 1 A 62 62 GLU H H 62 8.502 8.767 -0.265 1
1 704 . 5 1 1 A 62 62 GLU HA H 62 2.867 3.816 -0.949 1
1 709 . 5 1 1 A 62 62 GLU C C 62 174.650 175.990 -1.340 1
1 710 . 5 1 1 A 62 62 GLU CA C 62 58.785 58.881 -0.096 1
1 711 . 5 1 1 A 62 62 GLU CB C 62 28.981 29.417 -0.436 1
1 713 . 5 1 1 A 62 62 GLU N N 62 129.915 124.856 5.059 1
1 714 . 5 1 1 A 63 63 ILE H H 63 6.928 7.987 -1.059 1
1 715 . 5 1 1 A 63 63 ILE HA H 63 4.038 4.374 -0.336 1
1 725 . 5 1 1 A 63 63 ILE C C 63 173.482 174.993 -1.511 1
1 726 . 5 1 1 A 63 63 ILE CA C 63 58.664 60.428 -1.764 1
1 727 . 5 1 1 A 63 63 ILE CB C 63 40.009 40.465 -0.456 1
1 731 . 5 1 1 A 63 63 ILE N N 63 117.075 117.946 -0.871 1
1 732 . 5 1 1 A 64 64 GLU H H 64 8.585 8.463 0.122 1
1 733 . 5 1 1 A 64 64 GLU HA H 64 3.427 3.830 -0.403 1
1 738 . 5 1 1 A 64 64 GLU C C 64 175.186 177.196 -2.010 1
1 739 . 5 1 1 A 64 64 GLU CA C 64 58.703 58.112 0.591 1
1 740 . 5 1 1 A 64 64 GLU CB C 64 28.999 29.107 -0.108 1
1 742 . 5 1 1 A 64 64 GLU N N 64 126.422 127.659 -1.237 1
1 743 . 5 1 1 A 65 65 GLY H H 65 8.754 8.807 -0.053 1
1 744 . 5 1 1 A 65 65 GLY HA2 H 65 3.631 3.948 -0.317 1
1 745 . 5 1 1 A 65 65 GLY HA3 H 65 4.287 3.962 0.325 1
1 746 . 5 1 1 A 65 65 GLY C C 65 174.005 174.768 -0.763 1
1 747 . 5 1 1 A 65 65 GLY CA C 65 44.954 45.042 -0.088 1
1 748 . 5 1 1 A 65 65 GLY N N 65 114.614 115.081 -0.467 1
1 749 . 5 1 1 A 66 66 GLU H H 66 7.760 7.673 0.087 1
1 750 . 5 1 1 A 66 66 GLU HA H 66 4.462 4.772 -0.310 1
1 754 . 5 1 1 A 66 66 GLU C C 66 175.255 175.346 -0.091 1
1 755 . 5 1 1 A 66 66 GLU CA C 66 55.582 55.402 0.180 1
1 756 . 5 1 1 A 66 66 GLU CB C 66 30.654 31.680 -1.026 1
1 758 . 5 1 1 A 66 66 GLU N N 66 119.292 120.287 -0.995 1
1 759 . 5 1 1 A 67 67 GLY H H 67 8.262 8.424 -0.162 1
1 760 . 5 1 1 A 67 67 GLY HA2 H 67 3.875 4.182 -0.307 1
1 761 . 5 1 1 A 67 67 GLY HA3 H 67 4.088 4.187 -0.099 1
1 762 . 5 1 1 A 67 67 GLY C C 67 172.197 173.098 -0.901 1
1 763 . 5 1 1 A 67 67 GLY CA C 67 44.845 45.745 -0.900 1
1 764 . 5 1 1 A 67 67 GLY N N 67 106.161 108.571 -2.410 1
1 765 . 5 1 1 A 68 68 LEU H H 68 8.142 8.042 0.100 1
1 766 . 5 1 1 A 68 68 LEU HA H 68 4.491 4.816 -0.325 1
1 775 . 5 1 1 A 68 68 LEU C C 68 176.194 175.381 0.813 1
1 776 . 5 1 1 A 68 68 LEU CA C 68 55.123 54.365 0.758 1
1 777 . 5 1 1 A 68 68 LEU CB C 68 44.527 43.640 0.887 1
1 780 . 5 1 1 A 68 68 LEU N N 68 120.269 121.184 -0.915 1
1 781 . 5 1 1 A 69 69 GLN H H 69 9.253 8.953 0.300 1
1 782 . 5 1 1 A 69 69 GLN HA H 69 4.770 4.652 0.118 1
1 788 . 5 1 1 A 69 69 GLN C C 69 173.607 174.025 -0.418 1
1 789 . 5 1 1 A 69 69 GLN CA C 69 54.736 55.779 -1.043 1
1 790 . 5 1 1 A 69 69 GLN CB C 69 33.782 31.696 2.086 1
1 792 . 5 1 1 A 69 69 GLN N N 69 119.336 125.678 -6.342 1
1 794 . 5 1 1 A 70 70 THR H H 70 8.803 8.990 -0.187 1
1 795 . 5 1 1 A 70 70 THR HA H 70 5.033 5.055 -0.022 1
1 800 . 5 1 1 A 70 70 THR C C 70 172.596 173.580 -0.984 1
1 801 . 5 1 1 A 70 70 THR CA C 70 62.768 61.630 1.138 1
1 802 . 5 1 1 A 70 70 THR CB C 70 69.990 70.713 -0.723 1
1 804 . 5 1 1 A 70 70 THR N N 70 118.372 121.826 -3.454 1
1 805 . 5 1 1 A 71 71 VAL H H 71 9.882 9.065 0.817 1
1 806 . 5 1 1 A 71 71 VAL HA H 71 5.239 5.458 -0.219 1
1 811 . 5 1 1 A 71 71 VAL C C 71 174.015 174.309 -0.294 1
1 812 . 5 1 1 A 71 71 VAL CA C 71 60.577 59.836 0.741 1
1 813 . 5 1 1 A 71 71 VAL CB C 71 34.149 34.627 -0.478 1
1 815 . 5 1 1 A 71 71 VAL N N 71 129.063 120.903 8.160 1
1 816 . 5 1 1 A 72 72 VAL H H 72 9.491 8.529 0.962 1
1 817 . 5 1 1 A 72 72 VAL HA H 72 4.672 4.862 -0.190 1
1 825 . 5 1 1 A 72 72 VAL CA C 72 59.568 57.971 1.597 1
1 826 . 5 1 1 A 72 72 VAL CB C 72 34.057 34.993 -0.936 1
1 829 . 5 1 1 A 72 72 VAL N N 72 128.521 124.052 4.469 1
1 830 . 5 1 1 A 73 73 PRO HA H 73 5.368 4.559 0.809 1
1 836 . 5 1 1 A 73 73 PRO C C 73 175.079 176.202 -1.123 1
1 837 . 5 1 1 A 73 73 PRO CA C 73 61.324 63.000 -1.676 1
1 838 . 5 1 1 A 73 73 PRO CB C 73 33.089 32.202 0.887 1
1 841 . 5 1 1 A 74 74 THR H H 74 9.103 8.568 0.535 1
1 842 . 5 1 1 A 74 74 THR HA H 74 5.191 4.830 0.361 1
1 847 . 5 1 1 A 74 74 THR CA C 74 57.986 59.232 -1.246 1
1 848 . 5 1 1 A 74 74 THR CB C 74 72.212 72.513 -0.301 1
1 850 . 5 1 1 A 74 74 THR N N 74 118.075 118.278 -0.203 1
1 851 . 5 1 1 A 75 75 PRO HA H 75 5.015 4.603 0.412 1
1 858 . 5 1 1 A 75 75 PRO C C 75 178.704 177.882 0.822 1
1 859 . 5 1 1 A 75 75 PRO CA C 75 63.038 62.811 0.227 1
1 860 . 5 1 1 A 75 75 PRO CB C 75 32.529 32.770 -0.241 1
1 863 . 5 1 1 A 76 76 ILE H H 76 8.221 8.885 -0.664 1
1 864 . 5 1 1 A 76 76 ILE HA H 76 4.218 4.026 0.192 1
1 873 . 5 1 1 A 76 76 ILE C C 76 172.375 177.360 -4.985 1
1 874 . 5 1 1 A 76 76 ILE CA C 76 63.509 63.208 0.301 1
1 875 . 5 1 1 A 76 76 ILE CB C 76 39.322 38.319 1.003 1
1 879 . 5 1 1 A 76 76 ILE N N 76 122.273 123.015 -0.742 1
1 880 . 5 1 1 A 77 77 THR H H 77 6.984 7.816 -0.832 1
1 881 . 5 1 1 A 77 77 THR HA H 77 4.227 4.165 0.062 1
1 886 . 5 1 1 A 77 77 THR C C 77 173.531 174.397 -0.866 1
1 887 . 5 1 1 A 77 77 THR CA C 77 61.435 63.145 -1.710 1
1 888 . 5 1 1 A 77 77 THR CB C 77 68.944 69.421 -0.477 1
1 890 . 5 1 1 A 77 77 THR N N 77 105.803 115.658 -9.855 1
1 891 . 5 1 1 A 78 78 ALA H H 78 7.647 7.990 -0.343 1
1 892 . 5 1 1 A 78 78 ALA HA H 78 4.757 3.972 0.785 1
1 896 . 5 1 1 A 78 78 ALA C C 78 173.520 176.950 -3.430 1
1 897 . 5 1 1 A 78 78 ALA CA C 78 51.164 54.246 -3.082 1
1 898 . 5 1 1 A 78 78 ALA CB C 78 20.011 17.838 2.173 1
1 899 . 5 1 1 A 78 78 ALA N N 78 126.635 124.375 2.260 1
1 900 . 5 1 1 A 79 79 SER H H 79 7.884 8.529 -0.645 1
1 901 . 5 1 1 A 79 79 SER HA H 79 4.386 5.232 -0.846 1
1 903 . 5 1 1 A 79 79 SER C C 79 176.077 172.371 3.706 1
1 904 . 5 1 1 A 79 79 SER CA C 79 57.465 57.295 0.170 1
1 905 . 5 1 1 A 79 79 SER CB C 79 65.285 65.757 -0.472 1
1 906 . 5 1 1 A 79 79 SER N N 79 115.272 111.615 3.657 1
1 907 . 5 1 1 A 80 80 LEU H H 80 7.700 8.679 -0.979 1
1 908 . 5 1 1 A 80 80 LEU HA H 80 4.912 4.620 0.292 1
1 915 . 5 1 1 A 80 80 LEU C C 80 173.927 175.227 -1.300 1
1 916 . 5 1 1 A 80 80 LEU CA C 80 53.829 55.087 -1.258 1
1 917 . 5 1 1 A 80 80 LEU CB C 80 45.990 43.425 2.565 1
1 920 . 5 1 1 A 80 80 LEU N N 80 121.507 128.259 -6.752 1
1 921 . 5 1 1 A 81 81 SER H H 81 7.885 8.694 -0.809 1
1 922 . 5 1 1 A 81 81 SER HA H 81 5.269 4.738 0.531 1
1 925 . 5 1 1 A 81 81 SER C C 81 175.756 174.905 0.851 1
1 926 . 5 1 1 A 81 81 SER CA C 81 55.507 57.099 -1.592 1
1 927 . 5 1 1 A 81 81 SER CB C 81 65.966 65.468 0.498 1
1 928 . 5 1 1 A 81 81 SER N N 81 118.323 116.838 1.485 1
1 929 . 5 1 1 A 82 82 HIS H H 82 8.935 8.715 0.220 1
1 930 . 5 1 1 A 82 82 HIS HA H 82 4.407 4.365 0.042 1
1 932 . 5 1 1 A 82 82 HIS C C 82 176.550 177.261 -0.711 1
1 933 . 5 1 1 A 82 82 HIS CA C 82 60.960 59.030 1.930 1
1 934 . 5 1 1 A 82 82 HIS CB C 82 30.755 29.395 1.360 1
1 935 . 5 1 1 A 82 82 HIS N N 82 124.042 119.435 4.607 1
1 936 . 5 1 1 A 83 83 ASN H H 83 8.435 8.332 0.103 1
1 937 . 5 1 1 A 83 83 ASN HA H 83 4.439 4.406 0.033 1
1 941 . 5 1 1 A 83 83 ASN C C 83 174.769 177.575 -2.806 1
1 942 . 5 1 1 A 83 83 ASN CA C 83 56.575 56.633 -0.058 1
1 943 . 5 1 1 A 83 83 ASN CB C 83 38.731 38.988 -0.257 1
1 944 . 5 1 1 A 83 83 ASN N N 83 118.543 120.434 -1.891 1
1 946 . 5 1 1 A 84 84 ARG H H 84 7.716 8.104 -0.388 1
1 947 . 5 1 1 A 84 84 ARG HA H 84 4.183 4.326 -0.143 1
1 953 . 5 1 1 A 84 84 ARG C C 84 177.399 178.625 -1.226 1
1 954 . 5 1 1 A 84 84 ARG CA C 84 59.045 59.035 0.010 1
1 955 . 5 1 1 A 84 84 ARG CB C 84 29.992 29.991 0.001 1
1 957 . 5 1 1 A 84 84 ARG N N 84 121.312 119.390 1.922 1
1 958 . 5 1 1 A 85 85 ILE H H 85 8.354 7.848 0.506 1
1 959 . 5 1 1 A 85 85 ILE HA H 85 3.650 3.844 -0.194 1
1 967 . 5 1 1 A 85 85 ILE C C 85 176.098 178.049 -1.951 1
1 968 . 5 1 1 A 85 85 ILE CA C 85 66.704 64.284 2.420 1
1 969 . 5 1 1 A 85 85 ILE CB C 85 38.017 37.666 0.351 1
1 972 . 5 1 1 A 85 85 ILE N N 85 119.321 119.269 0.052 1
1 973 . 5 1 1 A 86 86 ARG H H 86 7.690 7.774 -0.084 1
1 974 . 5 1 1 A 86 86 ARG HA H 86 3.704 3.974 -0.270 1
1 981 . 5 1 1 A 86 86 ARG C C 86 177.524 178.650 -1.126 1
1 982 . 5 1 1 A 86 86 ARG CA C 86 59.881 59.376 0.505 1
1 983 . 5 1 1 A 86 86 ARG CB C 86 29.248 29.901 -0.653 1
1 986 . 5 1 1 A 86 86 ARG N N 86 118.362 121.814 -3.452 1
1 987 . 5 1 1 A 87 87 GLU H H 87 7.884 7.774 0.110 1
1 988 . 5 1 1 A 87 87 GLU HA H 87 4.064 4.097 -0.033 1
1 993 . 5 1 1 A 87 87 GLU C C 87 178.785 179.326 -0.541 1
1 994 . 5 1 1 A 87 87 GLU CA C 87 58.999 59.170 -0.171 1
1 995 . 5 1 1 A 87 87 GLU CB C 87 29.872 29.300 0.572 1
1 997 . 5 1 1 A 87 87 GLU N N 87 118.124 119.285 -1.161 1
1 998 . 5 1 1 A 88 88 ILE H H 88 8.715 7.579 1.136 1
1 999 . 5 1 1 A 88 88 ILE HA H 88 3.305 3.489 -0.184 1
1 1009 . 5 1 1 A 88 88 ILE C C 88 177.261 178.017 -0.756 1
1 1010 . 5 1 1 A 88 88 ILE CA C 88 65.822 65.611 0.211 1
1 1011 . 5 1 1 A 88 88 ILE CB C 88 37.370 37.284 0.086 1
1 1015 . 5 1 1 A 88 88 ILE N N 88 122.929 120.653 2.276 1
1 1016 . 5 1 1 A 89 89 LEU H H 89 8.486 8.202 0.284 1
1 1017 . 5 1 1 A 89 89 LEU HA H 89 3.932 3.855 0.077 1
1 1023 . 5 1 1 A 89 89 LEU C C 89 177.919 179.121 -1.202 1
1 1024 . 5 1 1 A 89 89 LEU CA C 89 59.060 58.219 0.841 1
1 1025 . 5 1 1 A 89 89 LEU CB C 89 41.129 41.637 -0.508 1
1 1028 . 5 1 1 A 89 89 LEU N N 89 122.696 120.396 2.300 1
1 1029 . 5 1 1 A 90 90 LYS H H 90 7.790 7.861 -0.071 1
1 1030 . 5 1 1 A 90 90 LYS HA H 90 4.061 3.923 0.138 1
1 1035 . 5 1 1 A 90 90 LYS C C 90 178.432 178.865 -0.433 1
1 1036 . 5 1 1 A 90 90 LYS CA C 90 59.840 60.152 -0.312 1
1 1037 . 5 1 1 A 90 90 LYS CB C 90 32.582 32.276 0.306 1
1 1039 . 5 1 1 A 90 90 LYS N N 90 118.640 117.388 1.252 1
1 1040 . 5 1 1 A 91 91 ALA H H 91 8.113 7.877 0.236 1
1 1041 . 5 1 1 A 91 91 ALA HA H 91 4.151 4.093 0.058 1
1 1045 . 5 1 1 A 91 91 ALA C C 91 179.147 179.915 -0.768 1
1 1046 . 5 1 1 A 91 91 ALA CA C 91 54.942 55.288 -0.346 1
1 1047 . 5 1 1 A 91 91 ALA CB C 91 18.242 18.500 -0.258 1
1 1048 . 5 1 1 A 91 91 ALA N N 91 122.939 122.969 -0.030 1
1 1049 . 5 1 1 A 92 92 SER H H 92 8.858 8.323 0.535 1
1 1050 . 5 1 1 A 92 92 SER HA H 92 4.898 4.155 0.743 1
1 1052 . 5 1 1 A 92 92 SER C C 92 172.440 176.519 -4.079 1
1 1053 . 5 1 1 A 92 92 SER CA C 92 61.913 61.521 0.392 1
1 1054 . 5 1 1 A 92 92 SER CB C 92 63.081 62.489 0.592 1
1 1055 . 5 1 1 A 92 92 SER N N 92 114.526 112.884 1.642 1
1 1056 . 5 1 1 A 93 93 ARG H H 93 7.704 8.344 -0.640 1
1 1057 . 5 1 1 A 93 93 ARG HA H 93 4.162 4.068 0.094 1
1 1059 . 5 1 1 A 93 93 ARG C C 93 177.757 178.603 -0.846 1
1 1060 . 5 1 1 A 93 93 ARG CA C 93 59.544 58.809 0.735 1
1 1061 . 5 1 1 A 93 93 ARG CB C 93 30.343 29.861 0.482 1
1 1062 . 5 1 1 A 93 93 ARG N N 93 121.505 120.681 0.824 1
1 1063 . 5 1 1 A 94 94 LYS H H 94 7.456 7.600 -0.144 1
1 1064 . 5 1 1 A 94 94 LYS HA H 94 4.174 4.165 0.009 1
1 1071 . 5 1 1 A 94 94 LYS C C 94 178.861 179.034 -0.173 1
1 1072 . 5 1 1 A 94 94 LYS CA C 94 59.030 58.953 0.077 1
1 1073 . 5 1 1 A 94 94 LYS CB C 94 32.239 31.586 0.653 1
1 1077 . 5 1 1 A 94 94 LYS N N 94 119.072 119.614 -0.542 1
1 1078 . 5 1 1 A 95 95 LEU H H 95 8.148 7.856 0.292 1
1 1079 . 5 1 1 A 95 95 LEU HA H 95 4.129 4.181 -0.052 1
1 1088 . 5 1 1 A 95 95 LEU C C 95 177.274 179.028 -1.754 1
1 1089 . 5 1 1 A 95 95 LEU CA C 95 57.136 56.974 0.162 1
1 1090 . 5 1 1 A 95 95 LEU CB C 95 41.908 42.113 -0.205 1
1 1093 . 5 1 1 A 95 95 LEU N N 95 119.717 119.785 -0.068 1
1 1094 . 5 1 1 A 96 96 GLN H H 96 7.807 8.226 -0.419 1
1 1095 . 5 1 1 A 96 96 GLN HA H 96 4.242 4.370 -0.128 1
1 1102 . 5 1 1 A 96 96 GLN C C 96 175.371 176.466 -1.095 1
1 1103 . 5 1 1 A 96 96 GLN CA C 96 56.397 55.893 0.504 1
1 1104 . 5 1 1 A 96 96 GLN CB C 96 29.123 29.493 -0.370 1
1 1106 . 5 1 1 A 96 96 GLN N N 96 114.581 115.969 -1.388 1
1 1108 . 5 1 1 A 97 97 GLY H H 97 7.802 8.518 -0.716 1
1 1109 . 5 1 1 A 97 97 GLY HA2 H 97 3.839 4.011 -0.172 1
1 1110 . 5 1 1 A 97 97 GLY HA3 H 97 4.096 4.012 0.084 1
1 1111 . 5 1 1 A 97 97 GLY C C 97 172.636 173.609 -0.973 1
1 1112 . 5 1 1 A 97 97 GLY CA C 97 46.372 46.285 0.087 1
1 1113 . 5 1 1 A 97 97 GLY N N 97 106.959 107.910 -0.951 1
1 1114 . 5 1 1 A 98 98 ASP H H 98 8.156 7.901 0.255 1
1 1115 . 5 1 1 A 98 98 ASP HA H 98 4.754 5.139 -0.385 1
1 1118 . 5 1 1 A 98 98 ASP CA C 98 52.882 50.891 1.991 1
1 1119 . 5 1 1 A 98 98 ASP CB C 98 41.603 43.094 -1.491 1
1 1120 . 5 1 1 A 98 98 ASP N N 98 118.447 119.617 -1.170 1
1 1121 . 5 1 1 A 99 99 PRO HA H 99 4.470 4.726 -0.256 1
1 1126 . 5 1 1 A 99 99 PRO C C 99 175.500 175.921 -0.421 1
1 1127 . 5 1 1 A 99 99 PRO CA C 99 63.601 62.124 1.477 1
1 1128 . 5 1 1 A 99 99 PRO CB C 99 32.423 33.181 -0.758 1
1 1130 . 5 1 1 A 100 100 ASP H H 100 8.527 8.443 0.084 1
1 1131 . 5 1 1 A 100 100 ASP HA H 100 4.778 4.615 0.163 1
1 1134 . 5 1 1 A 100 100 ASP C C 100 174.931 174.955 -0.024 1
1 1135 . 5 1 1 A 100 100 ASP CA C 100 53.915 53.054 0.861 1
1 1136 . 5 1 1 A 100 100 ASP CB C 100 40.665 39.184 1.481 1
1 1137 . 5 1 1 A 100 100 ASP N N 100 119.340 121.200 -1.860 1
1 1138 . 5 1 1 A 101 101 LEU H H 101 7.379 8.703 -1.324 1
1 1139 . 5 1 1 A 101 101 LEU HA H 101 4.682 5.063 -0.381 1
1 1148 . 5 1 1 A 101 101 LEU CA C 101 52.956 50.941 2.015 1
1 1149 . 5 1 1 A 101 101 LEU CB C 101 43.393 44.308 -0.915 1
1 1152 . 5 1 1 A 101 101 LEU N N 101 122.107 119.588 2.519 1
1 1153 . 5 1 1 A 102 102 PRO HA H 102 4.487 4.695 -0.208 1
1 1158 . 5 1 1 A 102 102 PRO C C 102 175.697 176.553 -0.856 1
1 1159 . 5 1 1 A 102 102 PRO CA C 102 63.113 62.730 0.383 1
1 1160 . 5 1 1 A 102 102 PRO CB C 102 32.138 31.678 0.460 1
1 1163 . 5 1 1 A 103 103 MET H H 103 9.011 8.766 0.245 1
1 1164 . 5 1 1 A 103 103 MET HA H 103 4.769 4.717 0.052 1
1 1171 . 5 1 1 A 103 103 MET C C 103 174.080 174.455 -0.375 1
1 1172 . 5 1 1 A 103 103 MET CA C 103 54.737 53.717 1.020 1
1 1173 . 5 1 1 A 103 103 MET CB C 103 34.857 34.461 0.396 1
1 1176 . 5 1 1 A 103 103 MET N N 103 123.334 122.956 0.378 1
1 1177 . 5 1 1 A 104 104 SER H H 104 8.239 8.832 -0.593 1
1 1178 . 5 1 1 A 104 104 SER HA H 104 5.079 5.255 -0.176 1
1 1181 . 5 1 1 A 104 104 SER C C 104 171.795 172.362 -0.567 1
1 1182 . 5 1 1 A 104 104 SER CA C 104 57.641 56.429 1.212 1
1 1183 . 5 1 1 A 104 104 SER CB C 104 66.282 66.204 0.078 1
1 1184 . 5 1 1 A 104 104 SER N N 104 114.434 116.469 -2.035 1
1 1185 . 5 1 1 A 105 105 PHE H H 105 9.003 8.194 0.809 1
1 1186 . 5 1 1 A 105 105 PHE HA H 105 5.209 5.345 -0.136 1
1 1193 . 5 1 1 A 105 105 PHE C C 105 170.688 172.108 -1.420 1
1 1194 . 5 1 1 A 105 105 PHE CA C 105 56.917 55.973 0.944 1
1 1195 . 5 1 1 A 105 105 PHE CB C 105 41.350 40.998 0.352 1
1 1196 . 5 1 1 A 105 105 PHE N N 105 116.224 119.000 -2.776 1
1 1197 . 5 1 1 A 106 106 THR H H 106 9.074 9.109 -0.035 1
1 1198 . 5 1 1 A 106 106 THR HA H 106 4.664 4.931 -0.267 1
1 1203 . 5 1 1 A 106 106 THR C C 106 171.767 174.319 -2.552 1
1 1204 . 5 1 1 A 106 106 THR CA C 106 62.162 61.653 0.509 1
1 1205 . 5 1 1 A 106 106 THR CB C 106 70.072 70.602 -0.530 1
1 1207 . 5 1 1 A 106 106 THR N N 106 117.469 115.994 1.475 1
1 1208 . 5 1 1 A 107 107 LEU H H 107 9.804 9.375 0.429 1
1 1209 . 5 1 1 A 107 107 LEU HA H 107 4.750 4.771 -0.021 1
1 1219 . 5 1 1 A 107 107 LEU C C 107 172.742 175.992 -3.250 1
1 1220 . 5 1 1 A 107 107 LEU CA C 107 54.151 54.925 -0.774 1
1 1221 . 5 1 1 A 107 107 LEU CB C 107 44.486 42.416 2.070 1
1 1224 . 5 1 1 A 107 107 LEU N N 107 133.400 128.360 5.040 1
1 1225 . 5 1 1 A 108 108 ALA H H 108 8.435 8.772 -0.337 1
1 1226 . 5 1 1 A 108 108 ALA HA H 108 4.683 4.493 0.190 1
1 1230 . 5 1 1 A 108 108 ALA C C 108 173.052 175.655 -2.603 1
1 1231 . 5 1 1 A 108 108 ALA CA C 108 49.308 50.687 -1.379 1
1 1232 . 5 1 1 A 108 108 ALA CB C 108 22.120 19.971 2.149 1
1 1233 . 5 1 1 A 108 108 ALA N N 108 131.422 127.177 4.245 1
1 1234 . 5 1 1 A 109 109 ILE H H 109 8.909 9.022 -0.113 1
1 1235 . 5 1 1 A 109 109 ILE HA H 109 4.063 4.962 -0.899 1
1 1245 . 5 1 1 A 109 109 ILE CA C 109 60.982 60.089 0.893 1
1 1246 . 5 1 1 A 109 109 ILE CB C 109 39.074 38.103 0.971 1
1 1250 . 5 1 1 A 109 109 ILE N N 109 124.415 123.864 0.551 1
1 1251 . 5 1 1 A 110 110 VAL H H 110 8.706 9.015 -0.309 1
1 1252 . 5 1 1 A 110 110 VAL HA H 110 4.324 4.848 -0.524 1
1 1260 . 5 1 1 A 110 110 VAL C C 110 175.700 175.067 0.633 1
1 1261 . 5 1 1 A 110 110 VAL CA C 110 62.316 60.314 2.002 1
1 1262 . 5 1 1 A 110 110 VAL CB C 110 31.876 34.108 -2.232 1
1 1264 . 5 1 1 A 110 110 VAL N N 110 127.457 128.894 -1.437 1
1 1265 . 5 1 1 A 111 111 GLU H H 111 9.024 9.173 -0.149 1
1 1266 . 5 1 1 A 111 111 GLU HA H 111 4.403 4.347 0.056 1
1 1269 . 5 1 1 A 111 111 GLU C C 111 175.987 177.609 -1.622 1
1 1270 . 5 1 1 A 111 111 GLU CA C 111 56.842 56.643 0.199 1
1 1271 . 5 1 1 A 111 111 GLU CB C 111 31.044 31.874 -0.830 1
1 1272 . 5 1 1 A 111 111 GLU N N 111 129.768 130.123 -0.355 1
1 1273 . 5 1 1 A 112 112 SER H H 112 9.143 9.031 0.112 1
1 1274 . 5 1 1 A 112 112 SER HA H 112 4.394 4.110 0.284 1
1 1276 . 5 1 1 A 112 112 SER C C 112 173.187 176.422 -3.235 1
1 1277 . 5 1 1 A 112 112 SER CA C 112 60.180 61.843 -1.663 1
1 1278 . 5 1 1 A 112 112 SER CB C 112 63.415 62.620 0.795 1
1 1279 . 5 1 1 A 112 112 SER N N 112 115.956 121.131 -5.175 1
1 1280 . 5 1 1 A 113 113 ASP H H 113 8.133 8.174 -0.041 1
1 1281 . 5 1 1 A 113 113 ASP HA H 113 4.573 4.426 0.147 1
1 1284 . 5 1 1 A 113 113 ASP C C 113 175.430 176.087 -0.657 1
1 1285 . 5 1 1 A 113 113 ASP CA C 113 54.115 56.768 -2.653 1
1 1286 . 5 1 1 A 113 113 ASP CB C 113 40.011 41.672 -1.661 1
1 1287 . 5 1 1 A 113 113 ASP N N 113 118.343 122.152 -3.809 1
1 1288 . 5 1 1 A 114 114 SER H H 114 8.034 7.740 0.294 1
1 1289 . 5 1 1 A 114 114 SER HA H 114 4.057 4.596 -0.539 1
1 1291 . 5 1 1 A 114 114 SER C C 114 172.209 174.500 -2.291 1
1 1292 . 5 1 1 A 114 114 SER CA C 114 60.179 58.674 1.505 1
1 1293 . 5 1 1 A 114 114 SER CB C 114 62.702 66.124 -3.422 1
1 1294 . 5 1 1 A 114 114 SER N N 114 109.836 113.590 -3.754 1
1 1295 . 5 1 1 A 115 115 THR H H 115 7.711 7.697 0.014 1
1 1296 . 5 1 1 A 115 115 THR HA H 115 4.250 4.121 0.129 1
1 1300 . 5 1 1 A 115 115 THR C C 115 171.500 173.919 -2.419 1
1 1301 . 5 1 1 A 115 115 THR CA C 115 63.547 64.343 -0.796 1
1 1302 . 5 1 1 A 115 115 THR CB C 115 69.595 69.297 0.298 1
1 1303 . 5 1 1 A 115 115 THR N N 115 117.407 117.211 0.196 1
1 1304 . 5 1 1 A 116 116 ILE H H 116 8.219 8.974 -0.755 1
1 1305 . 5 1 1 A 116 116 ILE HA H 116 4.769 4.865 -0.096 1
1 1315 . 5 1 1 A 116 116 ILE C C 116 174.434 175.211 -0.777 1
1 1316 . 5 1 1 A 116 116 ILE CA C 116 60.306 59.654 0.652 1
1 1317 . 5 1 1 A 116 116 ILE CB C 116 40.686 38.429 2.257 1
1 1321 . 5 1 1 A 116 116 ILE N N 116 125.480 128.804 -3.324 1
1 1322 . 5 1 1 A 117 117 VAL H H 117 8.695 9.574 -0.879 1
1 1323 . 5 1 1 A 117 117 VAL HA H 117 4.315 4.570 -0.255 1
1 1328 . 5 1 1 A 117 117 VAL C C 117 172.243 174.639 -2.396 1
1 1329 . 5 1 1 A 117 117 VAL CA C 117 60.621 61.202 -0.581 1
1 1330 . 5 1 1 A 117 117 VAL CB C 117 34.558 33.327 1.231 1
1 1332 . 5 1 1 A 117 117 VAL N N 117 127.887 127.506 0.381 1
1 1333 . 5 1 1 A 118 118 TYR H H 118 8.270 8.989 -0.719 1
1 1334 . 5 1 1 A 118 118 TYR HA H 118 5.327 5.468 -0.141 1
1 1342 . 5 1 1 A 118 118 TYR C C 118 174.250 174.607 -0.357 1
1 1343 . 5 1 1 A 118 118 TYR CA C 118 57.283 56.952 0.331 1
1 1344 . 5 1 1 A 118 118 TYR CB C 118 39.262 39.234 0.028 1
1 1345 . 5 1 1 A 118 118 TYR N N 118 124.822 126.768 -1.946 1
1 1346 . 5 1 1 A 119 119 TYR H H 119 9.207 9.178 0.029 1
1 1347 . 5 1 1 A 119 119 TYR HA H 119 4.821 5.333 -0.512 1
1 1354 . 5 1 1 A 119 119 TYR C C 119 171.994 174.044 -2.050 1
1 1355 . 5 1 1 A 119 119 TYR CA C 119 58.116 56.736 1.380 1
1 1356 . 5 1 1 A 119 119 TYR CB C 119 43.544 41.945 1.599 1
1 1357 . 5 1 1 A 119 119 TYR N N 119 125.153 125.188 -0.035 1
1 1358 . 5 1 1 A 120 120 LYS H H 120 7.700 8.622 -0.922 1
1 1359 . 5 1 1 A 120 120 LYS HA H 120 4.558 4.631 -0.073 1
1 1366 . 5 1 1 A 120 120 LYS C C 120 172.017 174.868 -2.851 1
1 1367 . 5 1 1 A 120 120 LYS CA C 120 57.217 56.022 1.195 1
1 1368 . 5 1 1 A 120 120 LYS CB C 120 33.914 33.032 0.882 1
1 1372 . 5 1 1 A 120 120 LYS N N 120 129.442 125.975 3.467 1
1 1373 . 5 1 1 A 121 121 LEU H H 121 8.112 8.273 -0.161 1
1 1374 . 5 1 1 A 121 121 LEU HA H 121 5.323 5.031 0.292 1
1 1384 . 5 1 1 A 121 121 LEU C C 121 175.733 174.017 1.716 1
1 1385 . 5 1 1 A 121 121 LEU CA C 121 52.716 53.138 -0.422 1
1 1386 . 5 1 1 A 121 121 LEU CB C 121 44.098 46.269 -2.171 1
1 1389 . 5 1 1 A 121 121 LEU N N 121 123.403 126.399 -2.996 1
1 1390 . 5 1 1 A 122 122 THR H H 122 8.338 8.732 -0.394 1
1 1391 . 5 1 1 A 122 122 THR HA H 122 5.097 4.965 0.132 1
1 1396 . 5 1 1 A 122 122 THR C C 122 173.221 171.567 1.654 1
1 1397 . 5 1 1 A 122 122 THR CA C 122 60.306 59.732 0.574 1
1 1398 . 5 1 1 A 122 122 THR CB C 122 72.473 71.583 0.890 1
1 1400 . 5 1 1 A 122 122 THR N N 122 109.081 118.350 -9.269 1
1 7 . 6 1 1 A 2 2 GLU H H 2 8.994 8.506 0.488 1
1 8 . 6 1 1 A 2 2 GLU HA H 2 4.278 4.699 -0.421 1
1 13 . 6 1 1 A 2 2 GLU C C 2 175.315 176.186 -0.871 1
1 14 . 6 1 1 A 2 2 GLU CA C 2 57.318 57.134 0.184 1
1 15 . 6 1 1 A 2 2 GLU CB C 2 29.221 31.573 -2.352 1
1 17 . 6 1 1 A 2 2 GLU N N 2 122.259 121.205 1.054 1
1 18 . 6 1 1 A 3 3 ASP H H 3 8.048 7.903 0.145 1
1 19 . 6 1 1 A 3 3 ASP HA H 3 4.580 4.947 -0.367 1
1 21 . 6 1 1 A 3 3 ASP C C 3 175.636 176.078 -0.442 1
1 22 . 6 1 1 A 3 3 ASP CA C 3 54.579 52.968 1.611 1
1 23 . 6 1 1 A 3 3 ASP CB C 3 40.984 40.829 0.155 1
1 24 . 6 1 1 A 3 3 ASP N N 3 119.830 116.977 2.853 1
1 25 . 6 1 1 A 4 4 ALA H H 4 8.090 7.417 0.673 1
1 26 . 6 1 1 A 4 4 ALA HA H 4 4.216 4.673 -0.457 1
1 30 . 6 1 1 A 4 4 ALA C C 4 177.157 178.255 -1.098 1
1 31 . 6 1 1 A 4 4 ALA CA C 4 53.620 50.922 2.698 1
1 32 . 6 1 1 A 4 4 ALA CB C 4 18.728 19.824 -1.096 1
1 33 . 6 1 1 A 4 4 ALA N N 4 123.957 121.550 2.407 1
1 34 . 6 1 1 A 5 5 TRP H H 5 7.941 7.967 -0.026 1
1 35 . 6 1 1 A 5 5 TRP HA H 5 4.559 4.616 -0.057 1
1 39 . 6 1 1 A 5 5 TRP C C 5 176.072 176.631 -0.559 1
1 40 . 6 1 1 A 5 5 TRP CA C 5 57.744 58.969 -1.225 1
1 41 . 6 1 1 A 5 5 TRP CB C 5 28.906 30.317 -1.411 1
1 42 . 6 1 1 A 5 5 TRP N N 5 118.408 120.583 -2.175 1
1 44 . 6 1 1 A 6 6 MET H H 6 7.679 8.010 -0.331 1
1 45 . 6 1 1 A 6 6 MET HA H 6 3.785 4.575 -0.790 1
1 52 . 6 1 1 A 6 6 MET C C 6 175.174 176.242 -1.068 1
1 53 . 6 1 1 A 6 6 MET CA C 6 57.724 53.661 4.063 1
1 54 . 6 1 1 A 6 6 MET CB C 6 31.640 34.236 -2.596 1
1 57 . 6 1 1 A 6 6 MET N N 6 121.538 113.965 7.573 1
1 58 . 6 1 1 A 7 7 GLY H H 7 7.247 8.318 -1.071 1
1 59 . 6 1 1 A 7 7 GLY HA2 H 7 3.455 3.406 0.049 1
1 60 . 6 1 1 A 7 7 GLY HA3 H 7 3.578 3.806 -0.228 1
1 61 . 6 1 1 A 7 7 GLY C C 7 172.852 174.233 -1.381 1
1 62 . 6 1 1 A 7 7 GLY CA C 7 45.896 45.252 0.644 1
1 63 . 6 1 1 A 7 7 GLY N N 7 104.055 112.219 -8.164 1
1 64 . 6 1 1 A 8 8 THR H H 8 7.436 7.733 -0.297 1
1 65 . 6 1 1 A 8 8 THR HA H 8 4.428 4.492 -0.064 1
1 70 . 6 1 1 A 8 8 THR C C 8 172.973 173.852 -0.879 1
1 71 . 6 1 1 A 8 8 THR CA C 8 60.751 61.946 -1.195 1
1 72 . 6 1 1 A 8 8 THR CB C 8 69.637 68.800 0.837 1
1 74 . 6 1 1 A 8 8 THR N N 8 107.669 112.499 -4.830 1
1 75 . 6 1 1 A 9 9 HIS H H 9 8.048 7.723 0.325 1
1 76 . 6 1 1 A 9 9 HIS HA H 9 4.654 4.920 -0.266 1
1 79 . 6 1 1 A 9 9 HIS CA C 9 56.163 54.299 1.864 1
1 80 . 6 1 1 A 9 9 HIS CB C 9 32.619 30.669 1.950 1
1 81 . 6 1 1 A 9 9 HIS N N 9 127.281 122.363 4.918 1
1 82 . 6 1 1 A 10 10 PRO HA H 10 4.257 4.221 0.036 1
1 88 . 6 1 1 A 10 10 PRO C C 10 178.779 178.958 -0.179 1
1 89 . 6 1 1 A 10 10 PRO CA C 10 65.565 65.989 -0.424 1
1 90 . 6 1 1 A 10 10 PRO CB C 10 32.422 31.872 0.550 1
1 93 . 6 1 1 A 11 11 LYS H H 11 10.994 8.352 2.642 1
1 94 . 6 1 1 A 11 11 LYS HA H 11 4.282 4.312 -0.030 1
1 100 . 6 1 1 A 11 11 LYS C C 11 177.279 178.796 -1.517 1
1 101 . 6 1 1 A 11 11 LYS CA C 11 56.859 59.071 -2.212 1
1 102 . 6 1 1 A 11 11 LYS CB C 11 31.279 32.135 -0.856 1
1 104 . 6 1 1 A 11 11 LYS N N 11 121.398 118.175 3.223 1
1 105 . 6 1 1 A 12 12 TYR H H 12 7.146 8.572 -1.426 1
1 106 . 6 1 1 A 12 12 TYR HA H 12 3.722 4.191 -0.469 1
1 113 . 6 1 1 A 12 12 TYR C C 12 176.265 177.397 -1.132 1
1 114 . 6 1 1 A 12 12 TYR CA C 12 61.189 61.638 -0.449 1
1 115 . 6 1 1 A 12 12 TYR CB C 12 37.796 38.474 -0.678 1
1 116 . 6 1 1 A 12 12 TYR N N 12 121.579 123.143 -1.564 1
1 117 . 6 1 1 A 13 13 LEU H H 13 7.778 8.799 -1.021 1
1 118 . 6 1 1 A 13 13 LEU HA H 13 3.773 3.888 -0.115 1
1 127 . 6 1 1 A 13 13 LEU C C 13 178.462 179.212 -0.750 1
1 128 . 6 1 1 A 13 13 LEU CA C 13 57.942 58.129 -0.187 1
1 129 . 6 1 1 A 13 13 LEU CB C 13 41.064 41.555 -0.491 1
1 132 . 6 1 1 A 13 13 LEU N N 13 117.518 119.627 -2.109 1
1 133 . 6 1 1 A 14 14 GLU H H 14 7.867 8.357 -0.490 1
1 134 . 6 1 1 A 14 14 GLU HA H 14 3.935 3.888 0.047 1
1 139 . 6 1 1 A 14 14 GLU C C 14 178.326 178.774 -0.448 1
1 140 . 6 1 1 A 14 14 GLU CA C 14 59.368 59.871 -0.503 1
1 141 . 6 1 1 A 14 14 GLU CB C 14 30.147 29.076 1.071 1
1 143 . 6 1 1 A 14 14 GLU N N 14 119.135 117.824 1.311 1
1 144 . 6 1 1 A 15 15 MET H H 15 7.773 7.622 0.151 1
1 145 . 6 1 1 A 15 15 MET HA H 15 3.936 4.134 -0.198 1
1 152 . 6 1 1 A 15 15 MET C C 15 177.886 178.179 -0.293 1
1 153 . 6 1 1 A 15 15 MET CA C 15 59.465 58.055 1.410 1
1 154 . 6 1 1 A 15 15 MET CB C 15 33.987 32.134 1.853 1
1 157 . 6 1 1 A 15 15 MET N N 15 117.884 119.831 -1.947 1
1 158 . 6 1 1 A 16 16 MET H H 16 8.145 8.252 -0.107 1
1 159 . 6 1 1 A 16 16 MET HA H 16 4.159 3.997 0.162 1
1 166 . 6 1 1 A 16 16 MET C C 16 177.835 178.675 -0.840 1
1 167 . 6 1 1 A 16 16 MET CA C 16 57.397 57.978 -0.581 1
1 168 . 6 1 1 A 16 16 MET CB C 16 31.867 31.806 0.061 1
1 171 . 6 1 1 A 16 16 MET N N 16 119.555 118.188 1.367 1
1 172 . 6 1 1 A 17 17 GLU H H 17 7.761 7.984 -0.223 1
1 173 . 6 1 1 A 17 17 GLU HA H 17 4.117 4.197 -0.080 1
1 176 . 6 1 1 A 17 17 GLU C C 17 175.994 176.560 -0.566 1
1 177 . 6 1 1 A 17 17 GLU CA C 17 57.392 58.587 -1.195 1
1 178 . 6 1 1 A 17 17 GLU CB C 17 29.432 29.988 -0.556 1
1 180 . 6 1 1 A 17 17 GLU N N 17 118.216 118.432 -0.216 1
1 181 . 6 1 1 A 18 18 LEU H H 18 7.201 7.042 0.159 1
1 182 . 6 1 1 A 18 18 LEU HA H 18 4.111 4.583 -0.472 1
1 191 . 6 1 1 A 18 18 LEU C C 18 175.781 175.338 0.443 1
1 192 . 6 1 1 A 18 18 LEU CA C 18 56.366 52.888 3.478 1
1 193 . 6 1 1 A 18 18 LEU CB C 18 42.030 44.046 -2.016 1
1 196 . 6 1 1 A 18 18 LEU N N 18 117.448 115.408 2.040 1
1 197 . 6 1 1 A 19 19 ASP H H 19 7.789 9.201 -1.412 1
1 198 . 6 1 1 A 19 19 ASP HA H 19 4.360 4.297 0.063 1
1 201 . 6 1 1 A 19 19 ASP C C 19 173.765 175.645 -1.880 1
1 202 . 6 1 1 A 19 19 ASP CA C 19 54.851 55.535 -0.684 1
1 203 . 6 1 1 A 19 19 ASP CB C 19 39.115 39.087 0.028 1
1 204 . 6 1 1 A 19 19 ASP N N 19 115.844 117.072 -1.228 1
1 205 . 6 1 1 A 20 20 ILE H H 20 8.142 8.530 -0.388 1
1 206 . 6 1 1 A 20 20 ILE HA H 20 4.128 3.770 0.358 1
1 216 . 6 1 1 A 20 20 ILE C C 20 174.710 175.904 -1.194 1
1 217 . 6 1 1 A 20 20 ILE CA C 20 60.465 63.064 -2.599 1
1 218 . 6 1 1 A 20 20 ILE CB C 20 40.407 36.135 4.272 1
1 222 . 6 1 1 A 20 20 ILE N N 20 117.287 110.784 6.503 1
1 223 . 6 1 1 A 21 21 GLY H H 21 8.207 8.714 -0.507 1
1 224 . 6 1 1 A 21 21 GLY HA2 H 21 3.889 3.938 -0.049 1
1 225 . 6 1 1 A 21 21 GLY HA3 H 21 3.924 3.950 -0.026 1
1 226 . 6 1 1 A 21 21 GLY C C 21 172.162 173.502 -1.340 1
1 227 . 6 1 1 A 21 21 GLY CA C 21 45.017 46.238 -1.221 1
1 228 . 6 1 1 A 21 21 GLY N N 21 110.656 108.925 1.731 1
1 229 . 6 1 1 A 22 22 ASP H H 22 7.727 7.910 -0.183 1
1 230 . 6 1 1 A 22 22 ASP HA H 22 4.794 4.999 -0.205 1
1 233 . 6 1 1 A 22 22 ASP C C 22 174.884 176.252 -1.368 1
1 234 . 6 1 1 A 22 22 ASP CA C 22 52.471 52.730 -0.259 1
1 235 . 6 1 1 A 22 22 ASP CB C 22 42.069 42.944 -0.875 1
1 236 . 6 1 1 A 22 22 ASP N N 22 119.305 119.977 -0.672 1
1 237 . 6 1 1 A 23 23 ALA H H 23 8.644 9.084 -0.440 1
1 238 . 6 1 1 A 23 23 ALA HA H 23 4.120 4.041 0.079 1
1 242 . 6 1 1 A 23 23 ALA C C 23 179.546 179.739 -0.193 1
1 243 . 6 1 1 A 23 23 ALA CA C 23 55.609 55.211 0.398 1
1 244 . 6 1 1 A 23 23 ALA CB C 23 18.573 18.413 0.160 1
1 245 . 6 1 1 A 23 23 ALA N N 23 122.468 128.964 -6.496 1
1 246 . 6 1 1 A 24 24 THR H H 24 8.238 7.627 0.611 1
1 247 . 6 1 1 A 24 24 THR HA H 24 4.184 4.013 0.171 1
1 252 . 6 1 1 A 24 24 THR C C 24 174.841 176.330 -1.489 1
1 253 . 6 1 1 A 24 24 THR CA C 24 66.241 66.450 -0.209 1
1 254 . 6 1 1 A 24 24 THR CB C 24 68.376 68.284 0.092 1
1 256 . 6 1 1 A 24 24 THR N N 24 114.824 113.921 0.903 1
1 257 . 6 1 1 A 25 25 GLN H H 25 8.037 8.912 -0.875 1
1 258 . 6 1 1 A 25 25 GLN HA H 25 4.095 4.020 0.075 1
1 265 . 6 1 1 A 25 25 GLN C C 25 177.603 178.073 -0.470 1
1 266 . 6 1 1 A 25 25 GLN CA C 25 59.261 59.057 0.204 1
1 267 . 6 1 1 A 25 25 GLN CB C 25 28.437 28.789 -0.352 1
1 269 . 6 1 1 A 25 25 GLN N N 25 122.518 121.791 0.727 1
1 271 . 6 1 1 A 26 26 VAL H H 26 7.994 8.129 -0.135 1
1 272 . 6 1 1 A 26 26 VAL HA H 26 3.469 3.776 -0.307 1
1 280 . 6 1 1 A 26 26 VAL C C 26 175.552 177.801 -2.249 1
1 281 . 6 1 1 A 26 26 VAL CA C 26 66.909 65.728 1.181 1
1 282 . 6 1 1 A 26 26 VAL CB C 26 31.582 31.341 0.241 1
1 285 . 6 1 1 A 26 26 VAL N N 26 119.112 118.610 0.502 1
1 286 . 6 1 1 A 27 27 TYR H H 27 8.003 8.031 -0.028 1
1 287 . 6 1 1 A 27 27 TYR HA H 27 4.357 4.346 0.011 1
1 294 . 6 1 1 A 27 27 TYR C C 27 175.856 176.990 -1.134 1
1 295 . 6 1 1 A 27 27 TYR CA C 27 62.197 61.599 0.598 1
1 296 . 6 1 1 A 27 27 TYR CB C 27 38.394 38.829 -0.435 1
1 297 . 6 1 1 A 27 27 TYR N N 27 119.170 124.874 -5.704 1
1 298 . 6 1 1 A 28 28 VAL H H 28 8.087 8.238 -0.151 1
1 299 . 6 1 1 A 28 28 VAL HA H 28 3.652 3.480 0.172 1
1 307 . 6 1 1 A 28 28 VAL C C 28 176.134 178.110 -1.976 1
1 308 . 6 1 1 A 28 28 VAL CA C 28 66.247 66.338 -0.091 1
1 309 . 6 1 1 A 28 28 VAL CB C 28 31.241 31.384 -0.143 1
1 312 . 6 1 1 A 28 28 VAL N N 28 113.112 119.261 -6.149 1
1 313 . 6 1 1 A 29 29 ALA H H 29 7.853 8.758 -0.905 1
1 314 . 6 1 1 A 29 29 ALA HA H 29 3.913 4.030 -0.117 1
1 318 . 6 1 1 A 29 29 ALA C C 29 177.850 179.122 -1.272 1
1 319 . 6 1 1 A 29 29 ALA CA C 29 55.274 54.903 0.371 1
1 320 . 6 1 1 A 29 29 ALA CB C 29 17.876 18.171 -0.295 1
1 321 . 6 1 1 A 29 29 ALA N N 29 121.350 123.165 -1.815 1
1 322 . 6 1 1 A 30 30 PHE H H 30 8.724 8.518 0.206 1
1 323 . 6 1 1 A 30 30 PHE HA H 30 4.098 4.159 -0.061 1
1 327 . 6 1 1 A 30 30 PHE C C 30 175.035 177.209 -2.174 1
1 328 . 6 1 1 A 30 30 PHE CA C 30 61.264 61.595 -0.331 1
1 329 . 6 1 1 A 30 30 PHE CB C 30 38.926 39.304 -0.378 1
1 330 . 6 1 1 A 30 30 PHE N N 30 120.478 119.984 0.494 1
1 331 . 6 1 1 A 31 31 LEU H H 31 8.146 8.123 0.023 1
1 332 . 6 1 1 A 31 31 LEU HA H 31 3.597 3.548 0.049 1
1 341 . 6 1 1 A 31 31 LEU C C 31 179.508 179.388 0.120 1
1 342 . 6 1 1 A 31 31 LEU CA C 31 57.884 58.092 -0.208 1
1 343 . 6 1 1 A 31 31 LEU CB C 31 41.829 42.188 -0.359 1
1 346 . 6 1 1 A 31 31 LEU N N 31 118.427 120.459 -2.032 1
1 347 . 6 1 1 A 32 32 VAL H H 32 7.627 7.605 0.022 1
1 348 . 6 1 1 A 32 32 VAL HA H 32 3.464 3.810 -0.346 1
1 356 . 6 1 1 A 32 32 VAL C C 32 174.956 177.689 -2.733 1
1 357 . 6 1 1 A 32 32 VAL CA C 32 66.373 65.745 0.628 1
1 358 . 6 1 1 A 32 32 VAL CB C 32 31.121 31.385 -0.264 1
1 361 . 6 1 1 A 32 32 VAL N N 32 119.497 113.896 5.601 1
1 362 . 6 1 1 A 33 33 TYR H H 33 8.366 8.648 -0.282 1
1 363 . 6 1 1 A 33 33 TYR HA H 33 3.485 3.939 -0.454 1
1 370 . 6 1 1 A 33 33 TYR C C 33 174.883 176.941 -2.058 1
1 371 . 6 1 1 A 33 33 TYR CA C 33 62.866 61.282 1.584 1
1 372 . 6 1 1 A 33 33 TYR CB C 33 37.778 38.393 -0.615 1
1 373 . 6 1 1 A 33 33 TYR N N 33 121.842 124.117 -2.275 1
1 374 . 6 1 1 A 34 34 LEU H H 34 8.000 8.360 -0.360 1
1 375 . 6 1 1 A 34 34 LEU HA H 34 3.495 3.709 -0.214 1
1 385 . 6 1 1 A 34 34 LEU C C 34 178.240 179.162 -0.922 1
1 386 . 6 1 1 A 34 34 LEU CA C 34 57.453 57.337 0.116 1
1 387 . 6 1 1 A 34 34 LEU CB C 34 41.828 41.054 0.774 1
1 390 . 6 1 1 A 34 34 LEU N N 34 116.692 119.171 -2.479 1
1 391 . 6 1 1 A 35 35 ASP H H 35 7.688 7.988 -0.300 1
1 392 . 6 1 1 A 35 35 ASP HA H 35 4.302 4.314 -0.012 1
1 395 . 6 1 1 A 35 35 ASP C C 35 177.507 178.519 -1.012 1
1 396 . 6 1 1 A 35 35 ASP CA C 35 58.196 57.704 0.492 1
1 397 . 6 1 1 A 35 35 ASP CB C 35 43.070 41.237 1.833 1
1 398 . 6 1 1 A 35 35 ASP N N 35 120.507 120.029 0.478 1
1 399 . 6 1 1 A 36 36 LEU H H 36 8.482 8.382 0.100 1
1 400 . 6 1 1 A 36 36 LEU HA H 36 3.328 3.731 -0.403 1
1 410 . 6 1 1 A 36 36 LEU C C 36 176.774 178.845 -2.071 1
1 411 . 6 1 1 A 36 36 LEU CA C 36 57.461 57.678 -0.217 1
1 412 . 6 1 1 A 36 36 LEU CB C 36 41.344 41.215 0.129 1
1 416 . 6 1 1 A 36 36 LEU N N 36 117.671 120.669 -2.998 1
1 417 . 6 1 1 A 37 37 MET H H 37 7.822 8.031 -0.209 1
1 418 . 6 1 1 A 37 37 MET HA H 37 4.401 4.027 0.374 1
1 425 . 6 1 1 A 37 37 MET C C 37 177.862 178.176 -0.314 1
1 426 . 6 1 1 A 37 37 MET CA C 37 56.434 58.643 -2.209 1
1 427 . 6 1 1 A 37 37 MET CB C 37 31.573 31.837 -0.264 1
1 430 . 6 1 1 A 37 37 MET N N 37 112.952 118.281 -5.329 1
1 431 . 6 1 1 A 38 38 GLU H H 38 8.667 8.135 0.532 1
1 432 . 6 1 1 A 38 38 GLU HA H 38 4.457 4.203 0.254 1
1 436 . 6 1 1 A 38 38 GLU C C 38 176.582 177.218 -0.636 1
1 437 . 6 1 1 A 38 38 GLU CA C 38 57.659 57.886 -0.227 1
1 438 . 6 1 1 A 38 38 GLU CB C 38 29.936 30.417 -0.481 1
1 440 . 6 1 1 A 38 38 GLU N N 38 116.463 119.153 -2.690 1
1 441 . 6 1 1 A 39 39 SER H H 39 7.657 8.300 -0.643 1
1 442 . 6 1 1 A 39 39 SER HA H 39 4.658 4.725 -0.067 1
1 445 . 6 1 1 A 39 39 SER C C 39 175.661 176.321 -0.660 1
1 446 . 6 1 1 A 39 39 SER CA C 39 60.449 59.869 0.580 1
1 447 . 6 1 1 A 39 39 SER CB C 39 63.341 64.642 -1.301 1
1 448 . 6 1 1 A 39 39 SER N N 39 113.870 115.169 -1.299 1
1 449 . 6 1 1 A 40 40 LYS H H 40 8.165 7.668 0.497 1
1 450 . 6 1 1 A 40 40 LYS HA H 40 4.454 4.368 0.086 1
1 458 . 6 1 1 A 40 40 LYS C C 40 174.970 175.908 -0.938 1
1 459 . 6 1 1 A 40 40 LYS CA C 40 55.753 56.214 -0.461 1
1 460 . 6 1 1 A 40 40 LYS CB C 40 32.337 33.103 -0.766 1
1 464 . 6 1 1 A 40 40 LYS N N 40 116.671 118.941 -2.270 1
1 465 . 6 1 1 A 41 41 SER H H 41 7.017 7.699 -0.682 1
1 466 . 6 1 1 A 41 41 SER HA H 41 4.209 4.606 -0.397 1
1 469 . 6 1 1 A 41 41 SER C C 41 173.770 173.701 0.069 1
1 470 . 6 1 1 A 41 41 SER CA C 41 58.435 58.916 -0.481 1
1 471 . 6 1 1 A 41 41 SER CB C 41 61.700 61.631 0.069 1
1 472 . 6 1 1 A 41 41 SER N N 41 109.989 112.831 -2.842 1
1 473 . 6 1 1 A 42 42 TRP H H 42 8.876 7.992 0.884 1
1 474 . 6 1 1 A 42 42 TRP HA H 42 4.698 4.535 0.163 1
1 478 . 6 1 1 A 42 42 TRP C C 42 174.477 177.403 -2.926 1
1 479 . 6 1 1 A 42 42 TRP CA C 42 59.443 57.977 1.466 1
1 480 . 6 1 1 A 42 42 TRP CB C 42 28.203 29.324 -1.121 1
1 481 . 6 1 1 A 42 42 TRP N N 42 121.116 120.875 0.241 1
1 483 . 6 1 1 A 43 43 HIS H H 43 8.132 8.544 -0.412 1
1 484 . 6 1 1 A 43 43 HIS HA H 43 4.445 4.351 0.094 1
1 488 . 6 1 1 A 43 43 HIS C C 43 174.405 174.466 -0.061 1
1 489 . 6 1 1 A 43 43 HIS CA C 43 58.556 59.236 -0.680 1
1 490 . 6 1 1 A 43 43 HIS CB C 43 29.430 30.385 -0.955 1
1 491 . 6 1 1 A 43 43 HIS N N 43 119.397 123.840 -4.443 1
1 492 . 6 1 1 A 44 44 GLU H H 44 8.140 7.540 0.600 1
1 493 . 6 1 1 A 44 44 GLU HA H 44 4.432 4.552 -0.120 1
1 497 . 6 1 1 A 44 44 GLU C C 44 173.010 174.295 -1.285 1
1 498 . 6 1 1 A 44 44 GLU CA C 44 56.421 56.193 0.228 1
1 499 . 6 1 1 A 44 44 GLU CB C 44 33.285 33.431 -0.146 1
1 501 . 6 1 1 A 44 44 GLU N N 44 116.181 118.065 -1.884 1
1 502 . 6 1 1 A 45 45 VAL H H 45 8.428 8.842 -0.414 1
1 503 . 6 1 1 A 45 45 VAL HA H 45 4.492 5.119 -0.627 1
1 511 . 6 1 1 A 45 45 VAL C C 45 172.339 174.842 -2.503 1
1 512 . 6 1 1 A 45 45 VAL CA C 45 63.071 61.854 1.217 1
1 513 . 6 1 1 A 45 45 VAL CB C 45 35.145 34.478 0.667 1
1 516 . 6 1 1 A 45 45 VAL N N 45 123.272 125.869 -2.597 1
1 517 . 6 1 1 A 46 46 ASN H H 46 9.050 9.096 -0.046 1
1 518 . 6 1 1 A 46 46 ASN HA H 46 5.261 5.576 -0.315 1
1 523 . 6 1 1 A 46 46 ASN C C 46 172.845 174.434 -1.589 1
1 524 . 6 1 1 A 46 46 ASN CA C 46 51.895 51.873 0.022 1
1 525 . 6 1 1 A 46 46 ASN CB C 46 42.322 41.550 0.772 1
1 526 . 6 1 1 A 46 46 ASN N N 46 123.901 125.294 -1.393 1
1 528 . 6 1 1 A 47 47 CYS H H 47 9.039 9.049 -0.010 1
1 529 . 6 1 1 A 47 47 CYS HA H 47 5.160 5.319 -0.159 1
1 532 . 6 1 1 A 47 47 CYS C C 47 172.454 173.198 -0.744 1
1 533 . 6 1 1 A 47 47 CYS CA C 47 56.473 57.705 -1.232 1
1 534 . 6 1 1 A 47 47 CYS CB C 47 29.297 30.848 -1.551 1
1 535 . 6 1 1 A 47 47 CYS N N 47 119.663 120.080 -0.417 1
1 536 . 6 1 1 A 48 48 VAL H H 48 9.083 8.912 0.171 1
1 537 . 6 1 1 A 48 48 VAL HA H 48 4.344 4.719 -0.375 1
1 542 . 6 1 1 A 48 48 VAL C C 48 173.307 174.681 -1.374 1
1 543 . 6 1 1 A 48 48 VAL CA C 48 61.368 60.752 0.616 1
1 544 . 6 1 1 A 48 48 VAL CB C 48 35.345 35.935 -0.590 1
1 546 . 6 1 1 A 48 48 VAL N N 48 124.672 124.862 -0.190 1
1 547 . 6 1 1 A 49 49 GLY H H 49 9.019 9.099 -0.080 1
1 548 . 6 1 1 A 49 49 GLY HA2 H 49 3.460 4.203 -0.743 1
1 549 . 6 1 1 A 49 49 GLY HA3 H 49 4.539 4.205 0.334 1
1 550 . 6 1 1 A 49 49 GLY C C 49 171.278 172.116 -0.838 1
1 551 . 6 1 1 A 49 49 GLY CA C 49 45.075 44.538 0.537 1
1 552 . 6 1 1 A 49 49 GLY N N 49 113.131 115.460 -2.329 1
1 553 . 6 1 1 A 50 50 LEU H H 50 8.747 9.084 -0.337 1
1 554 . 6 1 1 A 50 50 LEU HA H 50 5.102 4.971 0.131 1
1 564 . 6 1 1 A 50 50 LEU CA C 50 51.417 51.326 0.091 1
1 565 . 6 1 1 A 50 50 LEU CB C 50 41.754 42.671 -0.917 1
1 569 . 6 1 1 A 50 50 LEU N N 50 124.471 126.304 -1.833 1
1 570 . 6 1 1 A 51 51 PRO HA H 51 4.106 4.299 -0.193 1
1 577 . 6 1 1 A 51 51 PRO C C 51 178.422 178.462 -0.040 1
1 578 . 6 1 1 A 51 51 PRO CA C 51 65.680 64.595 1.085 1
1 579 . 6 1 1 A 51 51 PRO CB C 51 31.939 32.036 -0.097 1
1 582 . 6 1 1 A 52 52 GLU H H 52 9.721 8.525 1.196 1
1 583 . 6 1 1 A 52 52 GLU HA H 52 4.176 4.072 0.104 1
1 588 . 6 1 1 A 52 52 GLU C C 52 176.146 177.863 -1.717 1
1 589 . 6 1 1 A 52 52 GLU CA C 52 59.158 59.303 -0.145 1
1 590 . 6 1 1 A 52 52 GLU CB C 52 28.442 29.354 -0.912 1
1 592 . 6 1 1 A 52 52 GLU N N 52 118.552 118.144 0.408 1
1 593 . 6 1 1 A 53 53 LEU H H 53 7.089 7.823 -0.734 1
1 594 . 6 1 1 A 53 53 LEU HA H 53 4.511 4.355 0.156 1
1 603 . 6 1 1 A 53 53 LEU C C 53 174.027 176.780 -2.753 1
1 604 . 6 1 1 A 53 53 LEU CA C 53 53.825 54.503 -0.678 1
1 605 . 6 1 1 A 53 53 LEU CB C 53 43.825 42.434 1.391 1
1 608 . 6 1 1 A 53 53 LEU N N 53 116.763 117.851 -1.088 1
1 609 . 6 1 1 A 54 54 GLN H H 54 7.964 7.738 0.226 1
1 610 . 6 1 1 A 54 54 GLN HA H 54 3.591 3.893 -0.302 1
1 616 . 6 1 1 A 54 54 GLN C C 54 172.604 174.897 -2.293 1
1 617 . 6 1 1 A 54 54 GLN CA C 54 56.961 57.230 -0.269 1
1 618 . 6 1 1 A 54 54 GLN CB C 54 26.545 27.927 -1.382 1
1 620 . 6 1 1 A 54 54 GLN N N 54 115.489 118.749 -3.260 1
1 622 . 6 1 1 A 55 55 LEU H H 55 7.139 7.532 -0.393 1
1 623 . 6 1 1 A 55 55 LEU HA H 55 4.750 4.835 -0.085 1
1 629 . 6 1 1 A 55 55 LEU C C 55 173.475 174.810 -1.335 1
1 630 . 6 1 1 A 55 55 LEU CA C 55 53.698 53.440 0.258 1
1 631 . 6 1 1 A 55 55 LEU CB C 55 47.859 45.102 2.757 1
1 633 . 6 1 1 A 55 55 LEU N N 55 116.422 119.653 -3.231 1
1 634 . 6 1 1 A 56 56 ILE H H 56 8.223 8.835 -0.612 1
1 635 . 6 1 1 A 56 56 ILE HA H 56 4.540 4.735 -0.195 1
1 643 . 6 1 1 A 56 56 ILE C C 56 173.938 174.804 -0.866 1
1 644 . 6 1 1 A 56 56 ILE CA C 56 61.020 60.145 0.875 1
1 645 . 6 1 1 A 56 56 ILE CB C 56 39.403 39.923 -0.520 1
1 648 . 6 1 1 A 56 56 ILE N N 56 122.792 126.817 -4.025 1
1 649 . 6 1 1 A 57 57 CYS H H 57 8.995 9.317 -0.322 1
1 650 . 6 1 1 A 57 57 CYS HA H 57 5.036 5.118 -0.082 1
1 653 . 6 1 1 A 57 57 CYS C C 57 170.483 172.703 -2.220 1
1 654 . 6 1 1 A 57 57 CYS CA C 57 56.484 57.441 -0.957 1
1 655 . 6 1 1 A 57 57 CYS CB C 57 30.545 30.394 0.151 1
1 656 . 6 1 1 A 57 57 CYS N N 57 121.575 127.389 -5.814 1
1 657 . 6 1 1 A 58 58 LEU H H 58 9.076 8.648 0.428 1
1 658 . 6 1 1 A 58 58 LEU HA H 58 5.472 4.920 0.552 1
1 668 . 6 1 1 A 58 58 LEU C C 58 174.009 174.827 -0.818 1
1 669 . 6 1 1 A 58 58 LEU CA C 58 52.851 54.111 -1.260 1
1 670 . 6 1 1 A 58 58 LEU CB C 58 42.177 43.544 -1.367 1
1 674 . 6 1 1 A 58 58 LEU N N 58 121.895 129.101 -7.206 1
1 675 . 6 1 1 A 59 59 VAL H H 59 8.966 8.682 0.284 1
1 676 . 6 1 1 A 59 59 VAL HA H 59 5.488 5.150 0.338 1
1 681 . 6 1 1 A 59 59 VAL C C 59 176.034 175.440 0.594 1
1 682 . 6 1 1 A 59 59 VAL CA C 59 59.820 60.897 -1.077 1
1 683 . 6 1 1 A 59 59 VAL CB C 59 34.786 34.538 0.248 1
1 685 . 6 1 1 A 59 59 VAL N N 59 121.702 128.412 -6.710 1
1 686 . 6 1 1 A 60 60 GLY H H 60 9.258 9.056 0.202 1
1 687 . 6 1 1 A 60 60 GLY HA2 H 60 4.673 4.364 0.309 1
1 688 . 6 1 1 A 60 60 GLY HA3 H 60 4.804 4.535 0.269 1
1 689 . 6 1 1 A 60 60 GLY C C 60 169.831 172.705 -2.874 1
1 690 . 6 1 1 A 60 60 GLY CA C 60 46.399 45.310 1.089 1
1 691 . 6 1 1 A 60 60 GLY N N 60 114.126 113.811 0.315 1
1 692 . 6 1 1 A 61 61 THR H H 61 8.834 8.202 0.632 1
1 693 . 6 1 1 A 61 61 THR HA H 61 4.418 4.860 -0.442 1
1 698 . 6 1 1 A 61 61 THR C C 61 171.985 174.882 -2.897 1
1 699 . 6 1 1 A 61 61 THR CA C 61 60.634 60.406 0.228 1
1 700 . 6 1 1 A 61 61 THR CB C 61 70.983 70.329 0.654 1
1 702 . 6 1 1 A 61 61 THR N N 61 114.856 110.336 4.520 1
1 703 . 6 1 1 A 62 62 GLU H H 62 8.502 8.455 0.047 1
1 704 . 6 1 1 A 62 62 GLU HA H 62 2.867 3.356 -0.489 1
1 709 . 6 1 1 A 62 62 GLU C C 62 174.650 175.907 -1.257 1
1 710 . 6 1 1 A 62 62 GLU CA C 62 58.785 58.401 0.384 1
1 711 . 6 1 1 A 62 62 GLU CB C 62 28.981 29.451 -0.470 1
1 713 . 6 1 1 A 62 62 GLU N N 62 129.915 123.604 6.311 1
1 714 . 6 1 1 A 63 63 ILE H H 63 6.928 7.825 -0.897 1
1 715 . 6 1 1 A 63 63 ILE HA H 63 4.038 4.459 -0.421 1
1 725 . 6 1 1 A 63 63 ILE C C 63 173.482 175.090 -1.608 1
1 726 . 6 1 1 A 63 63 ILE CA C 63 58.664 60.287 -1.623 1
1 727 . 6 1 1 A 63 63 ILE CB C 63 40.009 41.024 -1.015 1
1 731 . 6 1 1 A 63 63 ILE N N 63 117.075 117.873 -0.798 1
1 732 . 6 1 1 A 64 64 GLU H H 64 8.585 8.401 0.184 1
1 733 . 6 1 1 A 64 64 GLU HA H 64 3.427 3.771 -0.344 1
1 738 . 6 1 1 A 64 64 GLU C C 64 175.186 177.207 -2.021 1
1 739 . 6 1 1 A 64 64 GLU CA C 64 58.703 58.101 0.602 1
1 740 . 6 1 1 A 64 64 GLU CB C 64 28.999 28.980 0.019 1
1 742 . 6 1 1 A 64 64 GLU N N 64 126.422 127.174 -0.752 1
1 743 . 6 1 1 A 65 65 GLY H H 65 8.754 8.909 -0.155 1
1 744 . 6 1 1 A 65 65 GLY HA2 H 65 3.631 3.906 -0.275 1
1 745 . 6 1 1 A 65 65 GLY HA3 H 65 4.287 3.922 0.365 1
1 746 . 6 1 1 A 65 65 GLY C C 65 174.005 173.484 0.521 1
1 747 . 6 1 1 A 65 65 GLY CA C 65 44.954 45.226 -0.272 1
1 748 . 6 1 1 A 65 65 GLY N N 65 114.614 115.010 -0.396 1
1 749 . 6 1 1 A 66 66 GLU H H 66 7.760 7.689 0.071 1
1 750 . 6 1 1 A 66 66 GLU HA H 66 4.462 4.401 0.061 1
1 754 . 6 1 1 A 66 66 GLU C C 66 175.255 176.991 -1.736 1
1 755 . 6 1 1 A 66 66 GLU CA C 66 55.582 55.531 0.051 1
1 756 . 6 1 1 A 66 66 GLU CB C 66 30.654 29.907 0.747 1
1 758 . 6 1 1 A 66 66 GLU N N 66 119.292 121.312 -2.020 1
1 759 . 6 1 1 A 67 67 GLY H H 67 8.262 8.130 0.132 1
1 760 . 6 1 1 A 67 67 GLY HA2 H 67 3.875 3.762 0.113 1
1 761 . 6 1 1 A 67 67 GLY HA3 H 67 4.088 3.811 0.277 1
1 762 . 6 1 1 A 67 67 GLY C C 67 172.197 173.737 -1.540 1
1 763 . 6 1 1 A 67 67 GLY CA C 67 44.845 46.596 -1.751 1
1 764 . 6 1 1 A 67 67 GLY N N 67 106.161 109.434 -3.273 1
1 765 . 6 1 1 A 68 68 LEU H H 68 8.142 7.942 0.200 1
1 766 . 6 1 1 A 68 68 LEU HA H 68 4.491 4.579 -0.088 1
1 775 . 6 1 1 A 68 68 LEU C C 68 176.194 175.992 0.202 1
1 776 . 6 1 1 A 68 68 LEU CA C 68 55.123 53.907 1.216 1
1 777 . 6 1 1 A 68 68 LEU CB C 68 44.527 43.601 0.926 1
1 780 . 6 1 1 A 68 68 LEU N N 68 120.269 126.553 -6.284 1
1 781 . 6 1 1 A 69 69 GLN H H 69 9.253 7.683 1.570 1
1 782 . 6 1 1 A 69 69 GLN HA H 69 4.770 4.948 -0.178 1
1 788 . 6 1 1 A 69 69 GLN C C 69 173.607 175.220 -1.613 1
1 789 . 6 1 1 A 69 69 GLN CA C 69 54.736 54.795 -0.059 1
1 790 . 6 1 1 A 69 69 GLN CB C 69 33.782 31.141 2.641 1
1 792 . 6 1 1 A 69 69 GLN N N 69 119.336 118.954 0.382 1
1 794 . 6 1 1 A 70 70 THR H H 70 8.803 8.866 -0.063 1
1 795 . 6 1 1 A 70 70 THR HA H 70 5.033 5.262 -0.229 1
1 800 . 6 1 1 A 70 70 THR C C 70 172.596 174.204 -1.608 1
1 801 . 6 1 1 A 70 70 THR CA C 70 62.768 62.107 0.661 1
1 802 . 6 1 1 A 70 70 THR CB C 70 69.990 71.118 -1.128 1
1 804 . 6 1 1 A 70 70 THR N N 70 118.372 117.069 1.303 1
1 805 . 6 1 1 A 71 71 VAL H H 71 9.882 9.220 0.662 1
1 806 . 6 1 1 A 71 71 VAL HA H 71 5.239 5.408 -0.169 1
1 811 . 6 1 1 A 71 71 VAL C C 71 174.015 174.644 -0.629 1
1 812 . 6 1 1 A 71 71 VAL CA C 71 60.577 59.762 0.815 1
1 813 . 6 1 1 A 71 71 VAL CB C 71 34.149 35.759 -1.610 1
1 815 . 6 1 1 A 71 71 VAL N N 71 129.063 120.447 8.616 1
1 816 . 6 1 1 A 72 72 VAL H H 72 9.491 8.878 0.613 1
1 817 . 6 1 1 A 72 72 VAL HA H 72 4.672 4.582 0.090 1
1 825 . 6 1 1 A 72 72 VAL CA C 72 59.568 58.700 0.868 1
1 826 . 6 1 1 A 72 72 VAL CB C 72 34.057 35.599 -1.542 1
1 829 . 6 1 1 A 72 72 VAL N N 72 128.521 123.773 4.748 1
1 830 . 6 1 1 A 73 73 PRO HA H 73 5.368 4.501 0.867 1
1 836 . 6 1 1 A 73 73 PRO C C 73 175.079 175.965 -0.886 1
1 837 . 6 1 1 A 73 73 PRO CA C 73 61.324 63.140 -1.816 1
1 838 . 6 1 1 A 73 73 PRO CB C 73 33.089 32.184 0.905 1
1 841 . 6 1 1 A 74 74 THR H H 74 9.103 8.880 0.223 1
1 842 . 6 1 1 A 74 74 THR HA H 74 5.191 4.868 0.323 1
1 847 . 6 1 1 A 74 74 THR CA C 74 57.986 59.194 -1.208 1
1 848 . 6 1 1 A 74 74 THR CB C 74 72.212 72.041 0.171 1
1 850 . 6 1 1 A 74 74 THR N N 74 118.075 118.543 -0.468 1
1 851 . 6 1 1 A 75 75 PRO HA H 75 5.015 4.709 0.306 1
1 858 . 6 1 1 A 75 75 PRO C C 75 178.704 177.836 0.868 1
1 859 . 6 1 1 A 75 75 PRO CA C 75 63.038 62.498 0.540 1
1 860 . 6 1 1 A 75 75 PRO CB C 75 32.529 32.746 -0.217 1
1 863 . 6 1 1 A 76 76 ILE H H 76 8.221 8.896 -0.675 1
1 864 . 6 1 1 A 76 76 ILE HA H 76 4.218 4.000 0.218 1
1 873 . 6 1 1 A 76 76 ILE C C 76 172.375 176.603 -4.228 1
1 874 . 6 1 1 A 76 76 ILE CA C 76 63.509 63.200 0.309 1
1 875 . 6 1 1 A 76 76 ILE CB C 76 39.322 37.881 1.441 1
1 879 . 6 1 1 A 76 76 ILE N N 76 122.273 123.452 -1.179 1
1 880 . 6 1 1 A 77 77 THR H H 77 6.984 7.900 -0.916 1
1 881 . 6 1 1 A 77 77 THR HA H 77 4.227 4.528 -0.301 1
1 886 . 6 1 1 A 77 77 THR C C 77 173.531 174.354 -0.823 1
1 887 . 6 1 1 A 77 77 THR CA C 77 61.435 61.401 0.034 1
1 888 . 6 1 1 A 77 77 THR CB C 77 68.944 69.515 -0.571 1
1 890 . 6 1 1 A 77 77 THR N N 77 105.803 115.460 -9.657 1
1 891 . 6 1 1 A 78 78 ALA H H 78 7.647 7.375 0.272 1
1 892 . 6 1 1 A 78 78 ALA HA H 78 4.757 4.744 0.013 1
1 896 . 6 1 1 A 78 78 ALA C C 78 173.520 176.542 -3.022 1
1 897 . 6 1 1 A 78 78 ALA CA C 78 51.164 50.258 0.906 1
1 898 . 6 1 1 A 78 78 ALA CB C 78 20.011 22.401 -2.390 1
1 899 . 6 1 1 A 78 78 ALA N N 78 126.635 124.115 2.520 1
1 900 . 6 1 1 A 79 79 SER H H 79 7.884 8.689 -0.805 1
1 901 . 6 1 1 A 79 79 SER HA H 79 4.386 5.303 -0.917 1
1 903 . 6 1 1 A 79 79 SER C C 79 176.077 172.708 3.369 1
1 904 . 6 1 1 A 79 79 SER CA C 79 57.465 55.818 1.647 1
1 905 . 6 1 1 A 79 79 SER CB C 79 65.285 65.962 -0.677 1
1 906 . 6 1 1 A 79 79 SER N N 79 115.272 112.474 2.798 1
1 907 . 6 1 1 A 80 80 LEU H H 80 7.700 9.067 -1.367 1
1 908 . 6 1 1 A 80 80 LEU HA H 80 4.912 5.378 -0.466 1
1 915 . 6 1 1 A 80 80 LEU C C 80 173.927 174.926 -0.999 1
1 916 . 6 1 1 A 80 80 LEU CA C 80 53.829 53.486 0.343 1
1 917 . 6 1 1 A 80 80 LEU CB C 80 45.990 46.270 -0.280 1
1 920 . 6 1 1 A 80 80 LEU N N 80 121.507 124.847 -3.340 1
1 921 . 6 1 1 A 81 81 SER H H 81 7.885 8.686 -0.801 1
1 922 . 6 1 1 A 81 81 SER HA H 81 5.269 4.858 0.411 1
1 925 . 6 1 1 A 81 81 SER C C 81 175.756 174.426 1.330 1
1 926 . 6 1 1 A 81 81 SER CA C 81 55.507 57.224 -1.717 1
1 927 . 6 1 1 A 81 81 SER CB C 81 65.966 65.880 0.086 1
1 928 . 6 1 1 A 81 81 SER N N 81 118.323 116.902 1.421 1
1 929 . 6 1 1 A 82 82 HIS H H 82 8.935 8.814 0.121 1
1 930 . 6 1 1 A 82 82 HIS HA H 82 4.407 4.174 0.233 1
1 932 . 6 1 1 A 82 82 HIS C C 82 176.550 176.923 -0.373 1
1 933 . 6 1 1 A 82 82 HIS CA C 82 60.960 60.623 0.337 1
1 934 . 6 1 1 A 82 82 HIS CB C 82 30.755 30.108 0.647 1
1 935 . 6 1 1 A 82 82 HIS N N 82 124.042 120.978 3.064 1
1 936 . 6 1 1 A 83 83 ASN H H 83 8.435 8.352 0.083 1
1 937 . 6 1 1 A 83 83 ASN HA H 83 4.439 4.428 0.011 1
1 941 . 6 1 1 A 83 83 ASN C C 83 174.769 178.011 -3.242 1
1 942 . 6 1 1 A 83 83 ASN CA C 83 56.575 56.053 0.522 1
1 943 . 6 1 1 A 83 83 ASN CB C 83 38.731 38.260 0.471 1
1 944 . 6 1 1 A 83 83 ASN N N 83 118.543 118.311 0.232 1
1 946 . 6 1 1 A 84 84 ARG H H 84 7.716 8.592 -0.876 1
1 947 . 6 1 1 A 84 84 ARG HA H 84 4.183 4.240 -0.057 1
1 953 . 6 1 1 A 84 84 ARG C C 84 177.399 178.732 -1.333 1
1 954 . 6 1 1 A 84 84 ARG CA C 84 59.045 58.426 0.619 1
1 955 . 6 1 1 A 84 84 ARG CB C 84 29.992 29.834 0.158 1
1 957 . 6 1 1 A 84 84 ARG N N 84 121.312 120.041 1.271 1
1 958 . 6 1 1 A 85 85 ILE H H 85 8.354 8.141 0.213 1
1 959 . 6 1 1 A 85 85 ILE HA H 85 3.650 3.929 -0.279 1
1 967 . 6 1 1 A 85 85 ILE C C 85 176.098 177.832 -1.734 1
1 968 . 6 1 1 A 85 85 ILE CA C 85 66.704 64.222 2.482 1
1 969 . 6 1 1 A 85 85 ILE CB C 85 38.017 37.550 0.467 1
1 972 . 6 1 1 A 85 85 ILE N N 85 119.321 119.338 -0.017 1
1 973 . 6 1 1 A 86 86 ARG H H 86 7.690 8.345 -0.655 1
1 974 . 6 1 1 A 86 86 ARG HA H 86 3.704 3.877 -0.173 1
1 981 . 6 1 1 A 86 86 ARG C C 86 177.524 178.581 -1.057 1
1 982 . 6 1 1 A 86 86 ARG CA C 86 59.881 60.124 -0.243 1
1 983 . 6 1 1 A 86 86 ARG CB C 86 29.248 29.899 -0.651 1
1 986 . 6 1 1 A 86 86 ARG N N 86 118.362 120.948 -2.586 1
1 987 . 6 1 1 A 87 87 GLU H H 87 7.884 7.899 -0.015 1
1 988 . 6 1 1 A 87 87 GLU HA H 87 4.064 4.061 0.003 1
1 993 . 6 1 1 A 87 87 GLU C C 87 178.785 179.462 -0.677 1
1 994 . 6 1 1 A 87 87 GLU CA C 87 58.999 59.001 -0.002 1
1 995 . 6 1 1 A 87 87 GLU CB C 87 29.872 29.573 0.299 1
1 997 . 6 1 1 A 87 87 GLU N N 87 118.124 119.358 -1.234 1
1 998 . 6 1 1 A 88 88 ILE H H 88 8.715 7.791 0.924 1
1 999 . 6 1 1 A 88 88 ILE HA H 88 3.305 3.482 -0.177 1
1 1009 . 6 1 1 A 88 88 ILE C C 88 177.261 177.809 -0.548 1
1 1010 . 6 1 1 A 88 88 ILE CA C 88 65.822 65.610 0.212 1
1 1011 . 6 1 1 A 88 88 ILE CB C 88 37.370 37.520 -0.150 1
1 1015 . 6 1 1 A 88 88 ILE N N 88 122.929 120.541 2.388 1
1 1016 . 6 1 1 A 89 89 LEU H H 89 8.486 8.732 -0.246 1
1 1017 . 6 1 1 A 89 89 LEU HA H 89 3.932 3.846 0.086 1
1 1023 . 6 1 1 A 89 89 LEU C C 89 177.919 178.971 -1.052 1
1 1024 . 6 1 1 A 89 89 LEU CA C 89 59.060 58.339 0.721 1
1 1025 . 6 1 1 A 89 89 LEU CB C 89 41.129 41.743 -0.614 1
1 1028 . 6 1 1 A 89 89 LEU N N 89 122.696 119.715 2.981 1
1 1029 . 6 1 1 A 90 90 LYS H H 90 7.790 8.139 -0.349 1
1 1030 . 6 1 1 A 90 90 LYS HA H 90 4.061 3.935 0.126 1
1 1035 . 6 1 1 A 90 90 LYS C C 90 178.432 178.450 -0.018 1
1 1036 . 6 1 1 A 90 90 LYS CA C 90 59.840 59.416 0.424 1
1 1037 . 6 1 1 A 90 90 LYS CB C 90 32.582 32.204 0.378 1
1 1039 . 6 1 1 A 90 90 LYS N N 90 118.640 119.660 -1.020 1
1 1040 . 6 1 1 A 91 91 ALA H H 91 8.113 8.320 -0.207 1
1 1041 . 6 1 1 A 91 91 ALA HA H 91 4.151 4.031 0.120 1
1 1045 . 6 1 1 A 91 91 ALA C C 91 179.147 179.782 -0.635 1
1 1046 . 6 1 1 A 91 91 ALA CA C 91 54.942 55.315 -0.373 1
1 1047 . 6 1 1 A 91 91 ALA CB C 91 18.242 18.441 -0.199 1
1 1048 . 6 1 1 A 91 91 ALA N N 91 122.939 121.272 1.667 1
1 1049 . 6 1 1 A 92 92 SER H H 92 8.858 8.409 0.449 1
1 1050 . 6 1 1 A 92 92 SER HA H 92 4.898 4.186 0.712 1
1 1052 . 6 1 1 A 92 92 SER C C 92 172.440 176.255 -3.815 1
1 1053 . 6 1 1 A 92 92 SER CA C 92 61.913 61.145 0.768 1
1 1054 . 6 1 1 A 92 92 SER CB C 92 63.081 62.904 0.177 1
1 1055 . 6 1 1 A 92 92 SER N N 92 114.526 113.625 0.901 1
1 1056 . 6 1 1 A 93 93 ARG H H 93 7.704 8.457 -0.753 1
1 1057 . 6 1 1 A 93 93 ARG HA H 93 4.162 4.062 0.100 1
1 1059 . 6 1 1 A 93 93 ARG C C 93 177.757 177.757 0.000 1
1 1060 . 6 1 1 A 93 93 ARG CA C 93 59.544 59.003 0.541 1
1 1061 . 6 1 1 A 93 93 ARG CB C 93 30.343 29.890 0.453 1
1 1062 . 6 1 1 A 93 93 ARG N N 93 121.505 120.078 1.427 1
1 1063 . 6 1 1 A 94 94 LYS H H 94 7.456 8.072 -0.616 1
1 1064 . 6 1 1 A 94 94 LYS HA H 94 4.174 4.105 0.069 1
1 1071 . 6 1 1 A 94 94 LYS C C 94 178.861 179.003 -0.142 1
1 1072 . 6 1 1 A 94 94 LYS CA C 94 59.030 58.792 0.238 1
1 1073 . 6 1 1 A 94 94 LYS CB C 94 32.239 31.923 0.316 1
1 1077 . 6 1 1 A 94 94 LYS N N 94 119.072 118.412 0.660 1
1 1078 . 6 1 1 A 95 95 LEU H H 95 8.148 7.813 0.335 1
1 1079 . 6 1 1 A 95 95 LEU HA H 95 4.129 4.123 0.006 1
1 1088 . 6 1 1 A 95 95 LEU C C 95 177.274 178.511 -1.237 1
1 1089 . 6 1 1 A 95 95 LEU CA C 95 57.136 57.300 -0.164 1
1 1090 . 6 1 1 A 95 95 LEU CB C 95 41.908 41.888 0.020 1
1 1093 . 6 1 1 A 95 95 LEU N N 95 119.717 121.695 -1.978 1
1 1094 . 6 1 1 A 96 96 GLN H H 96 7.807 7.935 -0.128 1
1 1095 . 6 1 1 A 96 96 GLN HA H 96 4.242 4.370 -0.128 1
1 1102 . 6 1 1 A 96 96 GLN C C 96 175.371 176.263 -0.892 1
1 1103 . 6 1 1 A 96 96 GLN CA C 96 56.397 55.601 0.796 1
1 1104 . 6 1 1 A 96 96 GLN CB C 96 29.123 29.138 -0.015 1
1 1106 . 6 1 1 A 96 96 GLN N N 96 114.581 115.566 -0.985 1
1 1108 . 6 1 1 A 97 97 GLY H H 97 7.802 8.440 -0.638 1
1 1109 . 6 1 1 A 97 97 GLY HA2 H 97 3.839 3.946 -0.107 1
1 1110 . 6 1 1 A 97 97 GLY HA3 H 97 4.096 3.947 0.149 1
1 1111 . 6 1 1 A 97 97 GLY C C 97 172.636 173.594 -0.958 1
1 1112 . 6 1 1 A 97 97 GLY CA C 97 46.372 46.110 0.262 1
1 1113 . 6 1 1 A 97 97 GLY N N 97 106.959 109.051 -2.092 1
1 1114 . 6 1 1 A 98 98 ASP H H 98 8.156 8.202 -0.046 1
1 1115 . 6 1 1 A 98 98 ASP HA H 98 4.754 5.053 -0.299 1
1 1118 . 6 1 1 A 98 98 ASP CA C 98 52.882 51.229 1.653 1
1 1119 . 6 1 1 A 98 98 ASP CB C 98 41.603 41.683 -0.080 1
1 1120 . 6 1 1 A 98 98 ASP N N 98 118.447 120.917 -2.470 1
1 1121 . 6 1 1 A 99 99 PRO HA H 99 4.470 4.472 -0.002 1
1 1126 . 6 1 1 A 99 99 PRO C C 99 175.500 176.956 -1.456 1
1 1127 . 6 1 1 A 99 99 PRO CA C 99 63.601 63.944 -0.343 1
1 1128 . 6 1 1 A 99 99 PRO CB C 99 32.423 31.876 0.547 1
1 1130 . 6 1 1 A 100 100 ASP H H 100 8.527 8.332 0.195 1
1 1131 . 6 1 1 A 100 100 ASP HA H 100 4.778 4.944 -0.166 1
1 1134 . 6 1 1 A 100 100 ASP C C 100 174.931 176.469 -1.538 1
1 1135 . 6 1 1 A 100 100 ASP CA C 100 53.915 54.020 -0.105 1
1 1136 . 6 1 1 A 100 100 ASP CB C 100 40.665 43.142 -2.477 1
1 1137 . 6 1 1 A 100 100 ASP N N 100 119.340 117.899 1.441 1
1 1138 . 6 1 1 A 101 101 LEU H H 101 7.379 6.853 0.526 1
1 1139 . 6 1 1 A 101 101 LEU HA H 101 4.682 4.348 0.334 1
1 1148 . 6 1 1 A 101 101 LEU CA C 101 52.956 53.686 -0.730 1
1 1149 . 6 1 1 A 101 101 LEU CB C 101 43.393 42.236 1.157 1
1 1152 . 6 1 1 A 101 101 LEU N N 101 122.107 122.107 0.000 1
1 1153 . 6 1 1 A 102 102 PRO HA H 102 4.487 4.816 -0.329 1
1 1158 . 6 1 1 A 102 102 PRO C C 102 175.697 176.200 -0.503 1
1 1159 . 6 1 1 A 102 102 PRO CA C 102 63.113 62.519 0.594 1
1 1160 . 6 1 1 A 102 102 PRO CB C 102 32.138 31.781 0.357 1
1 1163 . 6 1 1 A 103 103 MET H H 103 9.011 8.773 0.238 1
1 1164 . 6 1 1 A 103 103 MET HA H 103 4.769 5.121 -0.352 1
1 1171 . 6 1 1 A 103 103 MET C C 103 174.080 175.473 -1.393 1
1 1172 . 6 1 1 A 103 103 MET CA C 103 54.737 54.735 0.002 1
1 1173 . 6 1 1 A 103 103 MET CB C 103 34.857 34.886 -0.029 1
1 1176 . 6 1 1 A 103 103 MET N N 103 123.334 123.578 -0.244 1
1 1177 . 6 1 1 A 104 104 SER H H 104 8.239 9.045 -0.806 1
1 1178 . 6 1 1 A 104 104 SER HA H 104 5.079 5.184 -0.105 1
1 1181 . 6 1 1 A 104 104 SER C C 104 171.795 172.364 -0.569 1
1 1182 . 6 1 1 A 104 104 SER CA C 104 57.641 56.515 1.126 1
1 1183 . 6 1 1 A 104 104 SER CB C 104 66.282 65.953 0.329 1
1 1184 . 6 1 1 A 104 104 SER N N 104 114.434 115.909 -1.475 1
1 1185 . 6 1 1 A 105 105 PHE H H 105 9.003 8.412 0.591 1
1 1186 . 6 1 1 A 105 105 PHE HA H 105 5.209 5.406 -0.197 1
1 1193 . 6 1 1 A 105 105 PHE C C 105 170.688 172.246 -1.558 1
1 1194 . 6 1 1 A 105 105 PHE CA C 105 56.917 55.948 0.969 1
1 1195 . 6 1 1 A 105 105 PHE CB C 105 41.350 41.812 -0.462 1
1 1196 . 6 1 1 A 105 105 PHE N N 105 116.224 119.697 -3.473 1
1 1197 . 6 1 1 A 106 106 THR H H 106 9.074 8.902 0.172 1
1 1198 . 6 1 1 A 106 106 THR HA H 106 4.664 4.707 -0.043 1
1 1203 . 6 1 1 A 106 106 THR C C 106 171.767 174.558 -2.791 1
1 1204 . 6 1 1 A 106 106 THR CA C 106 62.162 62.352 -0.190 1
1 1205 . 6 1 1 A 106 106 THR CB C 106 70.072 69.653 0.419 1
1 1207 . 6 1 1 A 106 106 THR N N 106 117.469 116.477 0.992 1
1 1208 . 6 1 1 A 107 107 LEU H H 107 9.804 9.282 0.522 1
1 1209 . 6 1 1 A 107 107 LEU HA H 107 4.750 4.766 -0.016 1
1 1219 . 6 1 1 A 107 107 LEU C C 107 172.742 176.182 -3.440 1
1 1220 . 6 1 1 A 107 107 LEU CA C 107 54.151 54.749 -0.598 1
1 1221 . 6 1 1 A 107 107 LEU CB C 107 44.486 42.578 1.908 1
1 1224 . 6 1 1 A 107 107 LEU N N 107 133.400 128.798 4.602 1
1 1225 . 6 1 1 A 108 108 ALA H H 108 8.435 8.729 -0.294 1
1 1226 . 6 1 1 A 108 108 ALA HA H 108 4.683 4.899 -0.216 1
1 1230 . 6 1 1 A 108 108 ALA C C 108 173.052 175.913 -2.861 1
1 1231 . 6 1 1 A 108 108 ALA CA C 108 49.308 50.842 -1.534 1
1 1232 . 6 1 1 A 108 108 ALA CB C 108 22.120 20.088 2.032 1
1 1233 . 6 1 1 A 108 108 ALA N N 108 131.422 127.237 4.185 1
1 1234 . 6 1 1 A 109 109 ILE H H 109 8.909 9.223 -0.314 1
1 1235 . 6 1 1 A 109 109 ILE HA H 109 4.063 4.981 -0.918 1
1 1245 . 6 1 1 A 109 109 ILE CA C 109 60.982 60.473 0.509 1
1 1246 . 6 1 1 A 109 109 ILE CB C 109 39.074 37.815 1.259 1
1 1250 . 6 1 1 A 109 109 ILE N N 109 124.415 124.137 0.278 1
1 1251 . 6 1 1 A 110 110 VAL H H 110 8.706 9.111 -0.405 1
1 1252 . 6 1 1 A 110 110 VAL HA H 110 4.324 5.031 -0.707 1
1 1260 . 6 1 1 A 110 110 VAL C C 110 175.700 174.404 1.296 1
1 1261 . 6 1 1 A 110 110 VAL CA C 110 62.316 60.600 1.716 1
1 1262 . 6 1 1 A 110 110 VAL CB C 110 31.876 33.477 -1.601 1
1 1264 . 6 1 1 A 110 110 VAL N N 110 127.457 124.006 3.451 1
1 1265 . 6 1 1 A 111 111 GLU H H 111 9.024 8.809 0.215 1
1 1266 . 6 1 1 A 111 111 GLU HA H 111 4.403 4.546 -0.143 1
1 1269 . 6 1 1 A 111 111 GLU C C 111 175.987 177.420 -1.433 1
1 1270 . 6 1 1 A 111 111 GLU CA C 111 56.842 56.069 0.773 1
1 1271 . 6 1 1 A 111 111 GLU CB C 111 31.044 31.181 -0.137 1
1 1272 . 6 1 1 A 111 111 GLU N N 111 129.768 127.837 1.931 1
1 1273 . 6 1 1 A 112 112 SER H H 112 9.143 8.770 0.373 1
1 1274 . 6 1 1 A 112 112 SER HA H 112 4.394 4.138 0.256 1
1 1276 . 6 1 1 A 112 112 SER C C 112 173.187 174.946 -1.759 1
1 1277 . 6 1 1 A 112 112 SER CA C 112 60.180 61.325 -1.145 1
1 1278 . 6 1 1 A 112 112 SER CB C 112 63.415 62.922 0.493 1
1 1279 . 6 1 1 A 112 112 SER N N 112 115.956 119.404 -3.448 1
1 1280 . 6 1 1 A 113 113 ASP H H 113 8.133 8.056 0.077 1
1 1281 . 6 1 1 A 113 113 ASP HA H 113 4.573 4.743 -0.170 1
1 1284 . 6 1 1 A 113 113 ASP C C 113 175.430 175.649 -0.219 1
1 1285 . 6 1 1 A 113 113 ASP CA C 113 54.115 53.505 0.610 1
1 1286 . 6 1 1 A 113 113 ASP CB C 113 40.011 40.871 -0.860 1
1 1287 . 6 1 1 A 113 113 ASP N N 113 118.343 119.466 -1.123 1
1 1288 . 6 1 1 A 114 114 SER H H 114 8.034 8.112 -0.078 1
1 1289 . 6 1 1 A 114 114 SER HA H 114 4.057 4.098 -0.041 1
1 1291 . 6 1 1 A 114 114 SER C C 114 172.209 173.560 -1.351 1
1 1292 . 6 1 1 A 114 114 SER CA C 114 60.179 59.504 0.675 1
1 1293 . 6 1 1 A 114 114 SER CB C 114 62.702 61.178 1.524 1
1 1294 . 6 1 1 A 114 114 SER N N 114 109.836 112.114 -2.278 1
1 1295 . 6 1 1 A 115 115 THR H H 115 7.711 7.477 0.234 1
1 1296 . 6 1 1 A 115 115 THR HA H 115 4.250 4.246 0.004 1
1 1300 . 6 1 1 A 115 115 THR C C 115 171.500 173.681 -2.181 1
1 1301 . 6 1 1 A 115 115 THR CA C 115 63.547 62.171 1.376 1
1 1302 . 6 1 1 A 115 115 THR CB C 115 69.595 69.072 0.523 1
1 1303 . 6 1 1 A 115 115 THR N N 115 117.407 115.870 1.537 1
1 1304 . 6 1 1 A 116 116 ILE H H 116 8.219 8.866 -0.647 1
1 1305 . 6 1 1 A 116 116 ILE HA H 116 4.769 4.793 -0.024 1
1 1315 . 6 1 1 A 116 116 ILE C C 116 174.434 175.132 -0.698 1
1 1316 . 6 1 1 A 116 116 ILE CA C 116 60.306 60.680 -0.374 1
1 1317 . 6 1 1 A 116 116 ILE CB C 116 40.686 37.808 2.878 1
1 1321 . 6 1 1 A 116 116 ILE N N 116 125.480 128.509 -3.029 1
1 1322 . 6 1 1 A 117 117 VAL H H 117 8.695 9.324 -0.629 1
1 1323 . 6 1 1 A 117 117 VAL HA H 117 4.315 4.558 -0.243 1
1 1328 . 6 1 1 A 117 117 VAL C C 117 172.243 174.435 -2.192 1
1 1329 . 6 1 1 A 117 117 VAL CA C 117 60.621 60.581 0.040 1
1 1330 . 6 1 1 A 117 117 VAL CB C 117 34.558 34.713 -0.155 1
1 1332 . 6 1 1 A 117 117 VAL N N 117 127.887 127.679 0.208 1
1 1333 . 6 1 1 A 118 118 TYR H H 118 8.270 8.497 -0.227 1
1 1334 . 6 1 1 A 118 118 TYR HA H 118 5.327 5.205 0.122 1
1 1342 . 6 1 1 A 118 118 TYR C C 118 174.250 175.030 -0.780 1
1 1343 . 6 1 1 A 118 118 TYR CA C 118 57.283 57.757 -0.474 1
1 1344 . 6 1 1 A 118 118 TYR CB C 118 39.262 40.008 -0.746 1
1 1345 . 6 1 1 A 118 118 TYR N N 118 124.822 126.816 -1.994 1
1 1346 . 6 1 1 A 119 119 TYR H H 119 9.207 9.175 0.032 1
1 1347 . 6 1 1 A 119 119 TYR HA H 119 4.821 5.261 -0.440 1
1 1354 . 6 1 1 A 119 119 TYR C C 119 171.994 173.581 -1.587 1
1 1355 . 6 1 1 A 119 119 TYR CA C 119 58.116 57.240 0.876 1
1 1356 . 6 1 1 A 119 119 TYR CB C 119 43.544 42.004 1.540 1
1 1357 . 6 1 1 A 119 119 TYR N N 119 125.153 123.800 1.353 1
1 1358 . 6 1 1 A 120 120 LYS H H 120 7.700 8.403 -0.703 1
1 1359 . 6 1 1 A 120 120 LYS HA H 120 4.558 4.480 0.078 1
1 1366 . 6 1 1 A 120 120 LYS C C 120 172.017 174.696 -2.679 1
1 1367 . 6 1 1 A 120 120 LYS CA C 120 57.217 56.336 0.881 1
1 1368 . 6 1 1 A 120 120 LYS CB C 120 33.914 32.898 1.016 1
1 1372 . 6 1 1 A 120 120 LYS N N 120 129.442 129.382 0.060 1
1 1373 . 6 1 1 A 121 121 LEU H H 121 8.112 8.585 -0.473 1
1 1374 . 6 1 1 A 121 121 LEU HA H 121 5.323 4.967 0.356 1
1 1384 . 6 1 1 A 121 121 LEU C C 121 175.733 174.376 1.357 1
1 1385 . 6 1 1 A 121 121 LEU CA C 121 52.716 52.979 -0.263 1
1 1386 . 6 1 1 A 121 121 LEU CB C 121 44.098 44.794 -0.696 1
1 1389 . 6 1 1 A 121 121 LEU N N 121 123.403 129.047 -5.644 1
1 1390 . 6 1 1 A 122 122 THR H H 122 8.338 8.893 -0.555 1
1 1391 . 6 1 1 A 122 122 THR HA H 122 5.097 4.846 0.251 1
1 1396 . 6 1 1 A 122 122 THR C C 122 173.221 172.287 0.934 1
1 1397 . 6 1 1 A 122 122 THR CA C 122 60.306 61.529 -1.223 1
1 1398 . 6 1 1 A 122 122 THR CB C 122 72.473 71.558 0.915 1
1 1400 . 6 1 1 A 122 122 THR N N 122 109.081 121.338 -12.257 1
1 7 . 7 1 1 A 2 2 GLU H H 2 8.994 8.578 0.416 1
1 8 . 7 1 1 A 2 2 GLU HA H 2 4.278 4.301 -0.023 1
1 13 . 7 1 1 A 2 2 GLU C C 2 175.315 178.365 -3.050 1
1 14 . 7 1 1 A 2 2 GLU CA C 2 57.318 57.568 -0.250 1
1 15 . 7 1 1 A 2 2 GLU CB C 2 29.221 30.208 -0.987 1
1 17 . 7 1 1 A 2 2 GLU N N 2 122.259 125.874 -3.615 1
1 18 . 7 1 1 A 3 3 ASP H H 3 8.048 8.861 -0.813 1
1 19 . 7 1 1 A 3 3 ASP HA H 3 4.580 4.701 -0.121 1
1 21 . 7 1 1 A 3 3 ASP C C 3 175.636 176.616 -0.980 1
1 22 . 7 1 1 A 3 3 ASP CA C 3 54.579 55.163 -0.584 1
1 23 . 7 1 1 A 3 3 ASP CB C 3 40.984 39.181 1.803 1
1 24 . 7 1 1 A 3 3 ASP N N 3 119.830 117.883 1.947 1
1 25 . 7 1 1 A 4 4 ALA H H 4 8.090 8.597 -0.507 1
1 26 . 7 1 1 A 4 4 ALA HA H 4 4.216 4.713 -0.497 1
1 30 . 7 1 1 A 4 4 ALA C C 4 177.157 177.954 -0.797 1
1 31 . 7 1 1 A 4 4 ALA CA C 4 53.620 51.457 2.163 1
1 32 . 7 1 1 A 4 4 ALA CB C 4 18.728 20.491 -1.763 1
1 33 . 7 1 1 A 4 4 ALA N N 4 123.957 121.518 2.439 1
1 34 . 7 1 1 A 5 5 TRP H H 5 7.941 8.431 -0.490 1
1 35 . 7 1 1 A 5 5 TRP HA H 5 4.559 4.571 -0.012 1
1 39 . 7 1 1 A 5 5 TRP C C 5 176.072 177.106 -1.034 1
1 40 . 7 1 1 A 5 5 TRP CA C 5 57.744 58.090 -0.346 1
1 41 . 7 1 1 A 5 5 TRP CB C 5 28.906 29.068 -0.162 1
1 42 . 7 1 1 A 5 5 TRP N N 5 118.408 120.224 -1.816 1
1 44 . 7 1 1 A 6 6 MET H H 6 7.679 8.040 -0.361 1
1 45 . 7 1 1 A 6 6 MET HA H 6 3.785 4.536 -0.751 1
1 52 . 7 1 1 A 6 6 MET C C 6 175.174 176.320 -1.146 1
1 53 . 7 1 1 A 6 6 MET CA C 6 57.724 55.884 1.840 1
1 54 . 7 1 1 A 6 6 MET CB C 6 31.640 34.986 -3.346 1
1 57 . 7 1 1 A 6 6 MET N N 6 121.538 119.545 1.993 1
1 58 . 7 1 1 A 7 7 GLY H H 7 7.247 8.031 -0.784 1
1 59 . 7 1 1 A 7 7 GLY HA2 H 7 3.455 4.135 -0.680 1
1 60 . 7 1 1 A 7 7 GLY HA3 H 7 3.578 4.197 -0.619 1
1 61 . 7 1 1 A 7 7 GLY C C 7 172.852 173.572 -0.720 1
1 62 . 7 1 1 A 7 7 GLY CA C 7 45.896 44.388 1.508 1
1 63 . 7 1 1 A 7 7 GLY N N 7 104.055 109.322 -5.267 1
1 64 . 7 1 1 A 8 8 THR H H 8 7.436 8.380 -0.944 1
1 65 . 7 1 1 A 8 8 THR HA H 8 4.428 4.549 -0.121 1
1 70 . 7 1 1 A 8 8 THR C C 8 172.973 173.669 -0.696 1
1 71 . 7 1 1 A 8 8 THR CA C 8 60.751 62.918 -2.167 1
1 72 . 7 1 1 A 8 8 THR CB C 8 69.637 71.364 -1.727 1
1 74 . 7 1 1 A 8 8 THR N N 8 107.669 115.906 -8.237 1
1 75 . 7 1 1 A 9 9 HIS H H 9 8.048 7.961 0.087 1
1 76 . 7 1 1 A 9 9 HIS HA H 9 4.654 4.841 -0.187 1
1 79 . 7 1 1 A 9 9 HIS CA C 9 56.163 54.473 1.690 1
1 80 . 7 1 1 A 9 9 HIS CB C 9 32.619 30.361 2.258 1
1 81 . 7 1 1 A 9 9 HIS N N 9 127.281 119.210 8.071 1
1 82 . 7 1 1 A 10 10 PRO HA H 10 4.257 4.319 -0.062 1
1 88 . 7 1 1 A 10 10 PRO C C 10 178.779 179.004 -0.225 1
1 89 . 7 1 1 A 10 10 PRO CA C 10 65.565 66.089 -0.524 1
1 90 . 7 1 1 A 10 10 PRO CB C 10 32.422 31.877 0.545 1
1 93 . 7 1 1 A 11 11 LYS H H 11 10.994 8.507 2.487 1
1 94 . 7 1 1 A 11 11 LYS HA H 11 4.282 4.178 0.104 1
1 100 . 7 1 1 A 11 11 LYS C C 11 177.279 178.833 -1.554 1
1 101 . 7 1 1 A 11 11 LYS CA C 11 56.859 59.517 -2.658 1
1 102 . 7 1 1 A 11 11 LYS CB C 11 31.279 32.233 -0.954 1
1 104 . 7 1 1 A 11 11 LYS N N 11 121.398 118.224 3.174 1
1 105 . 7 1 1 A 12 12 TYR H H 12 7.146 8.243 -1.097 1
1 106 . 7 1 1 A 12 12 TYR HA H 12 3.722 4.323 -0.601 1
1 113 . 7 1 1 A 12 12 TYR C C 12 176.265 177.518 -1.253 1
1 114 . 7 1 1 A 12 12 TYR CA C 12 61.189 61.432 -0.243 1
1 115 . 7 1 1 A 12 12 TYR CB C 12 37.796 38.481 -0.685 1
1 116 . 7 1 1 A 12 12 TYR N N 12 121.579 121.393 0.186 1
1 117 . 7 1 1 A 13 13 LEU H H 13 7.778 8.896 -1.118 1
1 118 . 7 1 1 A 13 13 LEU HA H 13 3.773 3.945 -0.172 1
1 127 . 7 1 1 A 13 13 LEU C C 13 178.462 178.633 -0.171 1
1 128 . 7 1 1 A 13 13 LEU CA C 13 57.942 58.144 -0.202 1
1 129 . 7 1 1 A 13 13 LEU CB C 13 41.064 41.524 -0.460 1
1 132 . 7 1 1 A 13 13 LEU N N 13 117.518 120.919 -3.401 1
1 133 . 7 1 1 A 14 14 GLU H H 14 7.867 8.881 -1.014 1
1 134 . 7 1 1 A 14 14 GLU HA H 14 3.935 3.980 -0.045 1
1 139 . 7 1 1 A 14 14 GLU C C 14 178.326 179.072 -0.746 1
1 140 . 7 1 1 A 14 14 GLU CA C 14 59.368 60.002 -0.634 1
1 141 . 7 1 1 A 14 14 GLU CB C 14 30.147 29.207 0.940 1
1 143 . 7 1 1 A 14 14 GLU N N 14 119.135 118.324 0.811 1
1 144 . 7 1 1 A 15 15 MET H H 15 7.773 7.646 0.127 1
1 145 . 7 1 1 A 15 15 MET HA H 15 3.936 4.074 -0.138 1
1 152 . 7 1 1 A 15 15 MET C C 15 177.886 178.023 -0.137 1
1 153 . 7 1 1 A 15 15 MET CA C 15 59.465 58.112 1.353 1
1 154 . 7 1 1 A 15 15 MET CB C 15 33.987 32.181 1.806 1
1 157 . 7 1 1 A 15 15 MET N N 15 117.884 119.819 -1.935 1
1 158 . 7 1 1 A 16 16 MET H H 16 8.145 8.542 -0.397 1
1 159 . 7 1 1 A 16 16 MET HA H 16 4.159 3.949 0.210 1
1 166 . 7 1 1 A 16 16 MET C C 16 177.835 178.456 -0.621 1
1 167 . 7 1 1 A 16 16 MET CA C 16 57.397 58.340 -0.943 1
1 168 . 7 1 1 A 16 16 MET CB C 16 31.867 32.070 -0.203 1
1 171 . 7 1 1 A 16 16 MET N N 16 119.555 117.502 2.053 1
1 172 . 7 1 1 A 17 17 GLU H H 17 7.761 8.186 -0.425 1
1 173 . 7 1 1 A 17 17 GLU HA H 17 4.117 3.979 0.138 1
1 176 . 7 1 1 A 17 17 GLU C C 17 175.994 176.205 -0.211 1
1 177 . 7 1 1 A 17 17 GLU CA C 17 57.392 58.900 -1.508 1
1 178 . 7 1 1 A 17 17 GLU CB C 17 29.432 29.745 -0.313 1
1 180 . 7 1 1 A 17 17 GLU N N 17 118.216 120.021 -1.805 1
1 181 . 7 1 1 A 18 18 LEU H H 18 7.201 7.204 -0.003 1
1 182 . 7 1 1 A 18 18 LEU HA H 18 4.111 4.345 -0.234 1
1 191 . 7 1 1 A 18 18 LEU C C 18 175.781 176.994 -1.213 1
1 192 . 7 1 1 A 18 18 LEU CA C 18 56.366 53.790 2.576 1
1 193 . 7 1 1 A 18 18 LEU CB C 18 42.030 43.632 -1.602 1
1 196 . 7 1 1 A 18 18 LEU N N 18 117.448 117.963 -0.515 1
1 197 . 7 1 1 A 19 19 ASP H H 19 7.789 9.001 -1.212 1
1 198 . 7 1 1 A 19 19 ASP HA H 19 4.360 4.859 -0.499 1
1 201 . 7 1 1 A 19 19 ASP C C 19 173.765 175.989 -2.224 1
1 202 . 7 1 1 A 19 19 ASP CA C 19 54.851 54.337 0.514 1
1 203 . 7 1 1 A 19 19 ASP CB C 19 39.115 41.154 -2.039 1
1 204 . 7 1 1 A 19 19 ASP N N 19 115.844 118.296 -2.452 1
1 205 . 7 1 1 A 20 20 ILE H H 20 8.142 7.225 0.917 1
1 206 . 7 1 1 A 20 20 ILE HA H 20 4.128 4.153 -0.025 1
1 216 . 7 1 1 A 20 20 ILE C C 20 174.710 176.411 -1.701 1
1 217 . 7 1 1 A 20 20 ILE CA C 20 60.465 61.903 -1.438 1
1 218 . 7 1 1 A 20 20 ILE CB C 20 40.407 38.516 1.891 1
1 222 . 7 1 1 A 20 20 ILE N N 20 117.287 115.512 1.775 1
1 223 . 7 1 1 A 21 21 GLY H H 21 8.207 8.117 0.090 1
1 224 . 7 1 1 A 21 21 GLY HA2 H 21 3.889 3.854 0.035 1
1 225 . 7 1 1 A 21 21 GLY HA3 H 21 3.924 3.874 0.050 1
1 226 . 7 1 1 A 21 21 GLY C C 21 172.162 173.899 -1.737 1
1 227 . 7 1 1 A 21 21 GLY CA C 21 45.017 46.842 -1.825 1
1 228 . 7 1 1 A 21 21 GLY N N 21 110.656 111.588 -0.932 1
1 229 . 7 1 1 A 22 22 ASP H H 22 7.727 8.253 -0.526 1
1 230 . 7 1 1 A 22 22 ASP HA H 22 4.794 4.926 -0.132 1
1 233 . 7 1 1 A 22 22 ASP C C 22 174.884 176.956 -2.072 1
1 234 . 7 1 1 A 22 22 ASP CA C 22 52.471 53.768 -1.297 1
1 235 . 7 1 1 A 22 22 ASP CB C 22 42.069 42.870 -0.801 1
1 236 . 7 1 1 A 22 22 ASP N N 22 119.305 123.669 -4.364 1
1 237 . 7 1 1 A 23 23 ALA H H 23 8.644 9.006 -0.362 1
1 238 . 7 1 1 A 23 23 ALA HA H 23 4.120 4.001 0.119 1
1 242 . 7 1 1 A 23 23 ALA C C 23 179.546 179.671 -0.125 1
1 243 . 7 1 1 A 23 23 ALA CA C 23 55.609 55.462 0.147 1
1 244 . 7 1 1 A 23 23 ALA CB C 23 18.573 18.381 0.192 1
1 245 . 7 1 1 A 23 23 ALA N N 23 122.468 128.981 -6.513 1
1 246 . 7 1 1 A 24 24 THR H H 24 8.238 7.365 0.873 1
1 247 . 7 1 1 A 24 24 THR HA H 24 4.184 4.064 0.120 1
1 252 . 7 1 1 A 24 24 THR C C 24 174.841 176.270 -1.429 1
1 253 . 7 1 1 A 24 24 THR CA C 24 66.241 66.535 -0.294 1
1 254 . 7 1 1 A 24 24 THR CB C 24 68.376 68.589 -0.213 1
1 256 . 7 1 1 A 24 24 THR N N 24 114.824 113.647 1.177 1
1 257 . 7 1 1 A 25 25 GLN H H 25 8.037 8.273 -0.236 1
1 258 . 7 1 1 A 25 25 GLN HA H 25 4.095 3.976 0.119 1
1 265 . 7 1 1 A 25 25 GLN C C 25 177.603 178.159 -0.556 1
1 266 . 7 1 1 A 25 25 GLN CA C 25 59.261 59.280 -0.019 1
1 267 . 7 1 1 A 25 25 GLN CB C 25 28.437 28.268 0.169 1
1 269 . 7 1 1 A 25 25 GLN N N 25 122.518 121.855 0.663 1
1 271 . 7 1 1 A 26 26 VAL H H 26 7.994 8.264 -0.270 1
1 272 . 7 1 1 A 26 26 VAL HA H 26 3.469 3.818 -0.349 1
1 280 . 7 1 1 A 26 26 VAL C C 26 175.552 177.821 -2.269 1
1 281 . 7 1 1 A 26 26 VAL CA C 26 66.909 65.831 1.078 1
1 282 . 7 1 1 A 26 26 VAL CB C 26 31.582 31.331 0.251 1
1 285 . 7 1 1 A 26 26 VAL N N 26 119.112 119.164 -0.052 1
1 286 . 7 1 1 A 27 27 TYR H H 27 8.003 8.136 -0.133 1
1 287 . 7 1 1 A 27 27 TYR HA H 27 4.357 4.359 -0.002 1
1 294 . 7 1 1 A 27 27 TYR C C 27 175.856 176.984 -1.128 1
1 295 . 7 1 1 A 27 27 TYR CA C 27 62.197 61.800 0.397 1
1 296 . 7 1 1 A 27 27 TYR CB C 27 38.394 38.874 -0.480 1
1 297 . 7 1 1 A 27 27 TYR N N 27 119.170 124.668 -5.498 1
1 298 . 7 1 1 A 28 28 VAL H H 28 8.087 8.104 -0.017 1
1 299 . 7 1 1 A 28 28 VAL HA H 28 3.652 3.451 0.201 1
1 307 . 7 1 1 A 28 28 VAL C C 28 176.134 177.968 -1.834 1
1 308 . 7 1 1 A 28 28 VAL CA C 28 66.247 66.271 -0.024 1
1 309 . 7 1 1 A 28 28 VAL CB C 28 31.241 31.343 -0.102 1
1 312 . 7 1 1 A 28 28 VAL N N 28 113.112 119.479 -6.367 1
1 313 . 7 1 1 A 29 29 ALA H H 29 7.853 8.674 -0.821 1
1 314 . 7 1 1 A 29 29 ALA HA H 29 3.913 4.074 -0.161 1
1 318 . 7 1 1 A 29 29 ALA C C 29 177.850 179.257 -1.407 1
1 319 . 7 1 1 A 29 29 ALA CA C 29 55.274 54.958 0.316 1
1 320 . 7 1 1 A 29 29 ALA CB C 29 17.876 18.283 -0.407 1
1 321 . 7 1 1 A 29 29 ALA N N 29 121.350 123.021 -1.671 1
1 322 . 7 1 1 A 30 30 PHE H H 30 8.724 8.543 0.181 1
1 323 . 7 1 1 A 30 30 PHE HA H 30 4.098 4.334 -0.236 1
1 327 . 7 1 1 A 30 30 PHE C C 30 175.035 177.242 -2.207 1
1 328 . 7 1 1 A 30 30 PHE CA C 30 61.264 61.616 -0.352 1
1 329 . 7 1 1 A 30 30 PHE CB C 30 38.926 39.461 -0.535 1
1 330 . 7 1 1 A 30 30 PHE N N 30 120.478 120.282 0.196 1
1 331 . 7 1 1 A 31 31 LEU H H 31 8.146 8.265 -0.119 1
1 332 . 7 1 1 A 31 31 LEU HA H 31 3.597 3.570 0.027 1
1 341 . 7 1 1 A 31 31 LEU C C 31 179.508 179.441 0.067 1
1 342 . 7 1 1 A 31 31 LEU CA C 31 57.884 58.085 -0.201 1
1 343 . 7 1 1 A 31 31 LEU CB C 31 41.829 42.068 -0.239 1
1 346 . 7 1 1 A 31 31 LEU N N 31 118.427 120.284 -1.857 1
1 347 . 7 1 1 A 32 32 VAL H H 32 7.627 7.653 -0.026 1
1 348 . 7 1 1 A 32 32 VAL HA H 32 3.464 3.930 -0.466 1
1 356 . 7 1 1 A 32 32 VAL C C 32 174.956 177.829 -2.873 1
1 357 . 7 1 1 A 32 32 VAL CA C 32 66.373 65.836 0.537 1
1 358 . 7 1 1 A 32 32 VAL CB C 32 31.121 31.516 -0.395 1
1 361 . 7 1 1 A 32 32 VAL N N 32 119.497 114.373 5.124 1
1 362 . 7 1 1 A 33 33 TYR H H 33 8.366 8.629 -0.263 1
1 363 . 7 1 1 A 33 33 TYR HA H 33 3.485 4.093 -0.608 1
1 370 . 7 1 1 A 33 33 TYR C C 33 174.883 176.996 -2.113 1
1 371 . 7 1 1 A 33 33 TYR CA C 33 62.866 61.423 1.443 1
1 372 . 7 1 1 A 33 33 TYR CB C 33 37.778 38.335 -0.557 1
1 373 . 7 1 1 A 33 33 TYR N N 33 121.842 124.261 -2.419 1
1 374 . 7 1 1 A 34 34 LEU H H 34 8.000 8.379 -0.379 1
1 375 . 7 1 1 A 34 34 LEU HA H 34 3.495 3.628 -0.133 1
1 385 . 7 1 1 A 34 34 LEU C C 34 178.240 179.132 -0.892 1
1 386 . 7 1 1 A 34 34 LEU CA C 34 57.453 57.242 0.211 1
1 387 . 7 1 1 A 34 34 LEU CB C 34 41.828 41.113 0.715 1
1 390 . 7 1 1 A 34 34 LEU N N 34 116.692 119.771 -3.079 1
1 391 . 7 1 1 A 35 35 ASP H H 35 7.688 7.979 -0.291 1
1 392 . 7 1 1 A 35 35 ASP HA H 35 4.302 4.338 -0.036 1
1 395 . 7 1 1 A 35 35 ASP C C 35 177.507 178.564 -1.057 1
1 396 . 7 1 1 A 35 35 ASP CA C 35 58.196 57.736 0.460 1
1 397 . 7 1 1 A 35 35 ASP CB C 35 43.070 41.334 1.736 1
1 398 . 7 1 1 A 35 35 ASP N N 35 120.507 120.017 0.490 1
1 399 . 7 1 1 A 36 36 LEU H H 36 8.482 8.545 -0.063 1
1 400 . 7 1 1 A 36 36 LEU HA H 36 3.328 3.797 -0.469 1
1 410 . 7 1 1 A 36 36 LEU C C 36 176.774 179.060 -2.286 1
1 411 . 7 1 1 A 36 36 LEU CA C 36 57.461 57.877 -0.416 1
1 412 . 7 1 1 A 36 36 LEU CB C 36 41.344 41.298 0.046 1
1 416 . 7 1 1 A 36 36 LEU N N 36 117.671 120.589 -2.918 1
1 417 . 7 1 1 A 37 37 MET H H 37 7.822 7.906 -0.084 1
1 418 . 7 1 1 A 37 37 MET HA H 37 4.401 3.918 0.483 1
1 425 . 7 1 1 A 37 37 MET C C 37 177.862 177.651 0.211 1
1 426 . 7 1 1 A 37 37 MET CA C 37 56.434 58.685 -2.251 1
1 427 . 7 1 1 A 37 37 MET CB C 37 31.573 32.999 -1.426 1
1 430 . 7 1 1 A 37 37 MET N N 37 112.952 116.601 -3.649 1
1 431 . 7 1 1 A 38 38 GLU H H 38 8.667 8.242 0.425 1
1 432 . 7 1 1 A 38 38 GLU HA H 38 4.457 4.123 0.334 1
1 436 . 7 1 1 A 38 38 GLU C C 38 176.582 177.004 -0.422 1
1 437 . 7 1 1 A 38 38 GLU CA C 38 57.659 57.366 0.293 1
1 438 . 7 1 1 A 38 38 GLU CB C 38 29.936 29.859 0.077 1
1 440 . 7 1 1 A 38 38 GLU N N 38 116.463 117.584 -1.121 1
1 441 . 7 1 1 A 39 39 SER H H 39 7.657 8.182 -0.525 1
1 442 . 7 1 1 A 39 39 SER HA H 39 4.658 4.584 0.074 1
1 445 . 7 1 1 A 39 39 SER C C 39 175.661 176.162 -0.501 1
1 446 . 7 1 1 A 39 39 SER CA C 39 60.449 59.629 0.820 1
1 447 . 7 1 1 A 39 39 SER CB C 39 63.341 64.327 -0.986 1
1 448 . 7 1 1 A 39 39 SER N N 39 113.870 115.255 -1.385 1
1 449 . 7 1 1 A 40 40 LYS H H 40 8.165 7.227 0.938 1
1 450 . 7 1 1 A 40 40 LYS HA H 40 4.454 3.843 0.611 1
1 458 . 7 1 1 A 40 40 LYS C C 40 174.970 176.075 -1.105 1
1 459 . 7 1 1 A 40 40 LYS CA C 40 55.753 56.233 -0.480 1
1 460 . 7 1 1 A 40 40 LYS CB C 40 32.337 32.044 0.293 1
1 464 . 7 1 1 A 40 40 LYS N N 40 116.671 119.884 -3.213 1
1 465 . 7 1 1 A 41 41 SER H H 41 7.017 7.474 -0.457 1
1 466 . 7 1 1 A 41 41 SER HA H 41 4.209 4.251 -0.042 1
1 469 . 7 1 1 A 41 41 SER C C 41 173.770 173.437 0.333 1
1 470 . 7 1 1 A 41 41 SER CA C 41 58.435 58.758 -0.323 1
1 471 . 7 1 1 A 41 41 SER CB C 41 61.700 60.661 1.039 1
1 472 . 7 1 1 A 41 41 SER N N 41 109.989 113.565 -3.576 1
1 473 . 7 1 1 A 42 42 TRP H H 42 8.876 7.787 1.089 1
1 474 . 7 1 1 A 42 42 TRP HA H 42 4.698 4.755 -0.057 1
1 478 . 7 1 1 A 42 42 TRP C C 42 174.477 177.638 -3.161 1
1 479 . 7 1 1 A 42 42 TRP CA C 42 59.443 57.374 2.069 1
1 480 . 7 1 1 A 42 42 TRP CB C 42 28.203 30.561 -2.358 1
1 481 . 7 1 1 A 42 42 TRP N N 42 121.116 122.051 -0.935 1
1 483 . 7 1 1 A 43 43 HIS H H 43 8.132 8.444 -0.312 1
1 484 . 7 1 1 A 43 43 HIS HA H 43 4.445 4.368 0.077 1
1 488 . 7 1 1 A 43 43 HIS C C 43 174.405 174.474 -0.069 1
1 489 . 7 1 1 A 43 43 HIS CA C 43 58.556 59.956 -1.400 1
1 490 . 7 1 1 A 43 43 HIS CB C 43 29.430 30.285 -0.855 1
1 491 . 7 1 1 A 43 43 HIS N N 43 119.397 122.177 -2.780 1
1 492 . 7 1 1 A 44 44 GLU H H 44 8.140 7.590 0.550 1
1 493 . 7 1 1 A 44 44 GLU HA H 44 4.432 4.610 -0.178 1
1 497 . 7 1 1 A 44 44 GLU C C 44 173.010 174.392 -1.382 1
1 498 . 7 1 1 A 44 44 GLU CA C 44 56.421 56.070 0.351 1
1 499 . 7 1 1 A 44 44 GLU CB C 44 33.285 33.168 0.117 1
1 501 . 7 1 1 A 44 44 GLU N N 44 116.181 118.045 -1.864 1
1 502 . 7 1 1 A 45 45 VAL H H 45 8.428 8.774 -0.346 1
1 503 . 7 1 1 A 45 45 VAL HA H 45 4.492 4.949 -0.457 1
1 511 . 7 1 1 A 45 45 VAL C C 45 172.339 174.974 -2.635 1
1 512 . 7 1 1 A 45 45 VAL CA C 45 63.071 60.955 2.116 1
1 513 . 7 1 1 A 45 45 VAL CB C 45 35.145 35.229 -0.084 1
1 516 . 7 1 1 A 45 45 VAL N N 45 123.272 126.224 -2.952 1
1 517 . 7 1 1 A 46 46 ASN H H 46 9.050 9.381 -0.331 1
1 518 . 7 1 1 A 46 46 ASN HA H 46 5.261 5.503 -0.242 1
1 523 . 7 1 1 A 46 46 ASN C C 46 172.845 173.801 -0.956 1
1 524 . 7 1 1 A 46 46 ASN CA C 46 51.895 51.293 0.602 1
1 525 . 7 1 1 A 46 46 ASN CB C 46 42.322 42.586 -0.264 1
1 526 . 7 1 1 A 46 46 ASN N N 46 123.901 123.194 0.707 1
1 528 . 7 1 1 A 47 47 CYS H H 47 9.039 8.451 0.588 1
1 529 . 7 1 1 A 47 47 CYS HA H 47 5.160 5.190 -0.030 1
1 532 . 7 1 1 A 47 47 CYS C C 47 172.454 173.617 -1.163 1
1 533 . 7 1 1 A 47 47 CYS CA C 47 56.473 57.205 -0.732 1
1 534 . 7 1 1 A 47 47 CYS CB C 47 29.297 28.831 0.466 1
1 535 . 7 1 1 A 47 47 CYS N N 47 119.663 119.191 0.472 1
1 536 . 7 1 1 A 48 48 VAL H H 48 9.083 9.566 -0.483 1
1 537 . 7 1 1 A 48 48 VAL HA H 48 4.344 4.719 -0.375 1
1 542 . 7 1 1 A 48 48 VAL C C 48 173.307 175.038 -1.731 1
1 543 . 7 1 1 A 48 48 VAL CA C 48 61.368 60.874 0.494 1
1 544 . 7 1 1 A 48 48 VAL CB C 48 35.345 33.889 1.456 1
1 546 . 7 1 1 A 48 48 VAL N N 48 124.672 125.863 -1.191 1
1 547 . 7 1 1 A 49 49 GLY H H 49 9.019 9.099 -0.080 1
1 548 . 7 1 1 A 49 49 GLY HA2 H 49 3.460 4.126 -0.666 1
1 549 . 7 1 1 A 49 49 GLY HA3 H 49 4.539 4.129 0.410 1
1 550 . 7 1 1 A 49 49 GLY C C 49 171.278 172.063 -0.785 1
1 551 . 7 1 1 A 49 49 GLY CA C 49 45.075 44.704 0.371 1
1 552 . 7 1 1 A 49 49 GLY N N 49 113.131 115.553 -2.422 1
1 553 . 7 1 1 A 50 50 LEU H H 50 8.747 8.921 -0.174 1
1 554 . 7 1 1 A 50 50 LEU HA H 50 5.102 4.793 0.309 1
1 564 . 7 1 1 A 50 50 LEU CA C 50 51.417 51.219 0.198 1
1 565 . 7 1 1 A 50 50 LEU CB C 50 41.754 43.177 -1.423 1
1 569 . 7 1 1 A 50 50 LEU N N 50 124.471 126.079 -1.608 1
1 570 . 7 1 1 A 51 51 PRO HA H 51 4.106 4.224 -0.118 1
1 577 . 7 1 1 A 51 51 PRO C C 51 178.422 178.928 -0.506 1
1 578 . 7 1 1 A 51 51 PRO CA C 51 65.680 65.266 0.414 1
1 579 . 7 1 1 A 51 51 PRO CB C 51 31.939 31.855 0.084 1
1 582 . 7 1 1 A 52 52 GLU H H 52 9.721 8.671 1.050 1
1 583 . 7 1 1 A 52 52 GLU HA H 52 4.176 4.069 0.107 1
1 588 . 7 1 1 A 52 52 GLU C C 52 176.146 177.677 -1.531 1
1 589 . 7 1 1 A 52 52 GLU CA C 52 59.158 59.348 -0.190 1
1 590 . 7 1 1 A 52 52 GLU CB C 52 28.442 29.493 -1.051 1
1 592 . 7 1 1 A 52 52 GLU N N 52 118.552 117.436 1.116 1
1 593 . 7 1 1 A 53 53 LEU H H 53 7.089 7.346 -0.257 1
1 594 . 7 1 1 A 53 53 LEU HA H 53 4.511 4.353 0.158 1
1 603 . 7 1 1 A 53 53 LEU C C 53 174.027 176.200 -2.173 1
1 604 . 7 1 1 A 53 53 LEU CA C 53 53.825 54.661 -0.836 1
1 605 . 7 1 1 A 53 53 LEU CB C 53 43.825 42.460 1.365 1
1 608 . 7 1 1 A 53 53 LEU N N 53 116.763 117.953 -1.190 1
1 609 . 7 1 1 A 54 54 GLN H H 54 7.964 7.757 0.207 1
1 610 . 7 1 1 A 54 54 GLN HA H 54 3.591 3.868 -0.277 1
1 616 . 7 1 1 A 54 54 GLN C C 54 172.604 174.129 -1.525 1
1 617 . 7 1 1 A 54 54 GLN CA C 54 56.961 56.971 -0.010 1
1 618 . 7 1 1 A 54 54 GLN CB C 54 26.545 26.136 0.409 1
1 620 . 7 1 1 A 54 54 GLN N N 54 115.489 116.357 -0.868 1
1 622 . 7 1 1 A 55 55 LEU H H 55 7.139 7.445 -0.306 1
1 623 . 7 1 1 A 55 55 LEU HA H 55 4.750 4.906 -0.156 1
1 629 . 7 1 1 A 55 55 LEU C C 55 173.475 175.748 -2.273 1
1 630 . 7 1 1 A 55 55 LEU CA C 55 53.698 52.771 0.927 1
1 631 . 7 1 1 A 55 55 LEU CB C 55 47.859 44.662 3.197 1
1 633 . 7 1 1 A 55 55 LEU N N 55 116.422 114.876 1.546 1
1 634 . 7 1 1 A 56 56 ILE H H 56 8.223 8.583 -0.360 1
1 635 . 7 1 1 A 56 56 ILE HA H 56 4.540 5.241 -0.701 1
1 643 . 7 1 1 A 56 56 ILE C C 56 173.938 174.349 -0.411 1
1 644 . 7 1 1 A 56 56 ILE CA C 56 61.020 59.623 1.397 1
1 645 . 7 1 1 A 56 56 ILE CB C 56 39.403 41.008 -1.605 1
1 648 . 7 1 1 A 56 56 ILE N N 56 122.792 120.000 2.792 1
1 649 . 7 1 1 A 57 57 CYS H H 57 8.995 9.039 -0.044 1
1 650 . 7 1 1 A 57 57 CYS HA H 57 5.036 5.143 -0.107 1
1 653 . 7 1 1 A 57 57 CYS C C 57 170.483 172.763 -2.280 1
1 654 . 7 1 1 A 57 57 CYS CA C 57 56.484 56.760 -0.276 1
1 655 . 7 1 1 A 57 57 CYS CB C 57 30.545 31.560 -1.015 1
1 656 . 7 1 1 A 57 57 CYS N N 57 121.575 122.733 -1.158 1
1 657 . 7 1 1 A 58 58 LEU H H 58 9.076 8.826 0.250 1
1 658 . 7 1 1 A 58 58 LEU HA H 58 5.472 5.551 -0.079 1
1 668 . 7 1 1 A 58 58 LEU C C 58 174.009 175.949 -1.940 1
1 669 . 7 1 1 A 58 58 LEU CA C 58 52.851 53.528 -0.677 1
1 670 . 7 1 1 A 58 58 LEU CB C 58 42.177 43.571 -1.394 1
1 674 . 7 1 1 A 58 58 LEU N N 58 121.895 122.159 -0.264 1
1 675 . 7 1 1 A 59 59 VAL H H 59 8.966 8.748 0.218 1
1 676 . 7 1 1 A 59 59 VAL HA H 59 5.488 5.734 -0.246 1
1 681 . 7 1 1 A 59 59 VAL C C 59 176.034 175.570 0.464 1
1 682 . 7 1 1 A 59 59 VAL CA C 59 59.820 60.601 -0.781 1
1 683 . 7 1 1 A 59 59 VAL CB C 59 34.786 35.312 -0.526 1
1 685 . 7 1 1 A 59 59 VAL N N 59 121.702 124.217 -2.515 1
1 686 . 7 1 1 A 60 60 GLY H H 60 9.258 8.117 1.141 1
1 687 . 7 1 1 A 60 60 GLY HA2 H 60 4.673 4.321 0.352 1
1 688 . 7 1 1 A 60 60 GLY HA3 H 60 4.804 4.332 0.472 1
1 689 . 7 1 1 A 60 60 GLY C C 60 169.831 172.298 -2.467 1
1 690 . 7 1 1 A 60 60 GLY CA C 60 46.399 46.277 0.122 1
1 691 . 7 1 1 A 60 60 GLY N N 60 114.126 112.070 2.056 1
1 692 . 7 1 1 A 61 61 THR H H 61 8.834 8.356 0.478 1
1 693 . 7 1 1 A 61 61 THR HA H 61 4.418 5.047 -0.629 1
1 698 . 7 1 1 A 61 61 THR C C 61 171.985 174.882 -2.897 1
1 699 . 7 1 1 A 61 61 THR CA C 61 60.634 60.654 -0.020 1
1 700 . 7 1 1 A 61 61 THR CB C 61 70.983 70.726 0.257 1
1 702 . 7 1 1 A 61 61 THR N N 61 114.856 113.389 1.467 1
1 703 . 7 1 1 A 62 62 GLU H H 62 8.502 8.845 -0.343 1
1 704 . 7 1 1 A 62 62 GLU HA H 62 2.867 3.537 -0.670 1
1 709 . 7 1 1 A 62 62 GLU C C 62 174.650 175.863 -1.213 1
1 710 . 7 1 1 A 62 62 GLU CA C 62 58.785 58.717 0.068 1
1 711 . 7 1 1 A 62 62 GLU CB C 62 28.981 29.406 -0.425 1
1 713 . 7 1 1 A 62 62 GLU N N 62 129.915 123.936 5.979 1
1 714 . 7 1 1 A 63 63 ILE H H 63 6.928 7.932 -1.004 1
1 715 . 7 1 1 A 63 63 ILE HA H 63 4.038 4.541 -0.503 1
1 725 . 7 1 1 A 63 63 ILE C C 63 173.482 175.100 -1.618 1
1 726 . 7 1 1 A 63 63 ILE CA C 63 58.664 59.863 -1.199 1
1 727 . 7 1 1 A 63 63 ILE CB C 63 40.009 41.252 -1.243 1
1 731 . 7 1 1 A 63 63 ILE N N 63 117.075 117.885 -0.810 1
1 732 . 7 1 1 A 64 64 GLU H H 64 8.585 8.355 0.230 1
1 733 . 7 1 1 A 64 64 GLU HA H 64 3.427 3.540 -0.113 1
1 738 . 7 1 1 A 64 64 GLU C C 64 175.186 177.003 -1.817 1
1 739 . 7 1 1 A 64 64 GLU CA C 64 58.703 57.975 0.728 1
1 740 . 7 1 1 A 64 64 GLU CB C 64 28.999 28.765 0.234 1
1 742 . 7 1 1 A 64 64 GLU N N 64 126.422 126.482 -0.060 1
1 743 . 7 1 1 A 65 65 GLY H H 65 8.754 8.807 -0.053 1
1 744 . 7 1 1 A 65 65 GLY HA2 H 65 3.631 3.938 -0.307 1
1 745 . 7 1 1 A 65 65 GLY HA3 H 65 4.287 3.951 0.336 1
1 746 . 7 1 1 A 65 65 GLY C C 65 174.005 174.901 -0.896 1
1 747 . 7 1 1 A 65 65 GLY CA C 65 44.954 45.021 -0.067 1
1 748 . 7 1 1 A 65 65 GLY N N 65 114.614 115.681 -1.067 1
1 749 . 7 1 1 A 66 66 GLU H H 66 7.760 7.833 -0.073 1
1 750 . 7 1 1 A 66 66 GLU HA H 66 4.462 4.564 -0.102 1
1 754 . 7 1 1 A 66 66 GLU C C 66 175.255 175.693 -0.438 1
1 755 . 7 1 1 A 66 66 GLU CA C 66 55.582 55.733 -0.151 1
1 756 . 7 1 1 A 66 66 GLU CB C 66 30.654 31.515 -0.861 1
1 758 . 7 1 1 A 66 66 GLU N N 66 119.292 120.379 -1.087 1
1 759 . 7 1 1 A 67 67 GLY H H 67 8.262 8.359 -0.097 1
1 760 . 7 1 1 A 67 67 GLY HA2 H 67 3.875 4.118 -0.243 1
1 761 . 7 1 1 A 67 67 GLY HA3 H 67 4.088 4.118 -0.030 1
1 762 . 7 1 1 A 67 67 GLY C C 67 172.197 173.485 -1.288 1
1 763 . 7 1 1 A 67 67 GLY CA C 67 44.845 45.794 -0.949 1
1 764 . 7 1 1 A 67 67 GLY N N 67 106.161 108.288 -2.127 1
1 765 . 7 1 1 A 68 68 LEU H H 68 8.142 7.779 0.363 1
1 766 . 7 1 1 A 68 68 LEU HA H 68 4.491 4.802 -0.311 1
1 775 . 7 1 1 A 68 68 LEU C C 68 176.194 175.182 1.012 1
1 776 . 7 1 1 A 68 68 LEU CA C 68 55.123 53.135 1.988 1
1 777 . 7 1 1 A 68 68 LEU CB C 68 44.527 45.090 -0.563 1
1 780 . 7 1 1 A 68 68 LEU N N 68 120.269 116.467 3.802 1
1 781 . 7 1 1 A 69 69 GLN H H 69 9.253 8.592 0.661 1
1 782 . 7 1 1 A 69 69 GLN HA H 69 4.770 4.695 0.075 1
1 788 . 7 1 1 A 69 69 GLN C C 69 173.607 174.147 -0.540 1
1 789 . 7 1 1 A 69 69 GLN CA C 69 54.736 55.909 -1.173 1
1 790 . 7 1 1 A 69 69 GLN CB C 69 33.782 31.993 1.789 1
1 792 . 7 1 1 A 69 69 GLN N N 69 119.336 121.915 -2.579 1
1 794 . 7 1 1 A 70 70 THR H H 70 8.803 8.847 -0.044 1
1 795 . 7 1 1 A 70 70 THR HA H 70 5.033 5.377 -0.344 1
1 800 . 7 1 1 A 70 70 THR C C 70 172.596 173.906 -1.310 1
1 801 . 7 1 1 A 70 70 THR CA C 70 62.768 61.684 1.084 1
1 802 . 7 1 1 A 70 70 THR CB C 70 69.990 71.513 -1.523 1
1 804 . 7 1 1 A 70 70 THR N N 70 118.372 121.048 -2.676 1
1 805 . 7 1 1 A 71 71 VAL H H 71 9.882 9.320 0.562 1
1 806 . 7 1 1 A 71 71 VAL HA H 71 5.239 5.601 -0.362 1
1 811 . 7 1 1 A 71 71 VAL C C 71 174.015 175.005 -0.990 1
1 812 . 7 1 1 A 71 71 VAL CA C 71 60.577 59.754 0.823 1
1 813 . 7 1 1 A 71 71 VAL CB C 71 34.149 34.938 -0.789 1
1 815 . 7 1 1 A 71 71 VAL N N 71 129.063 120.611 8.452 1
1 816 . 7 1 1 A 72 72 VAL H H 72 9.491 8.694 0.797 1
1 817 . 7 1 1 A 72 72 VAL HA H 72 4.672 4.940 -0.268 1
1 825 . 7 1 1 A 72 72 VAL CA C 72 59.568 58.580 0.988 1
1 826 . 7 1 1 A 72 72 VAL CB C 72 34.057 34.217 -0.160 1
1 829 . 7 1 1 A 72 72 VAL N N 72 128.521 120.165 8.356 1
1 830 . 7 1 1 A 73 73 PRO HA H 73 5.368 4.561 0.807 1
1 836 . 7 1 1 A 73 73 PRO C C 73 175.079 175.992 -0.913 1
1 837 . 7 1 1 A 73 73 PRO CA C 73 61.324 63.031 -1.707 1
1 838 . 7 1 1 A 73 73 PRO CB C 73 33.089 31.941 1.148 1
1 841 . 7 1 1 A 74 74 THR H H 74 9.103 8.946 0.157 1
1 842 . 7 1 1 A 74 74 THR HA H 74 5.191 4.854 0.337 1
1 847 . 7 1 1 A 74 74 THR CA C 74 57.986 59.179 -1.193 1
1 848 . 7 1 1 A 74 74 THR CB C 74 72.212 71.858 0.354 1
1 850 . 7 1 1 A 74 74 THR N N 74 118.075 118.880 -0.805 1
1 851 . 7 1 1 A 75 75 PRO HA H 75 5.015 4.889 0.126 1
1 858 . 7 1 1 A 75 75 PRO C C 75 178.704 177.418 1.286 1
1 859 . 7 1 1 A 75 75 PRO CA C 75 63.038 62.457 0.581 1
1 860 . 7 1 1 A 75 75 PRO CB C 75 32.529 32.831 -0.302 1
1 863 . 7 1 1 A 76 76 ILE H H 76 8.221 8.289 -0.068 1
1 864 . 7 1 1 A 76 76 ILE HA H 76 4.218 3.813 0.405 1
1 873 . 7 1 1 A 76 76 ILE C C 76 172.375 177.176 -4.801 1
1 874 . 7 1 1 A 76 76 ILE CA C 76 63.509 63.942 -0.433 1
1 875 . 7 1 1 A 76 76 ILE CB C 76 39.322 37.721 1.601 1
1 879 . 7 1 1 A 76 76 ILE N N 76 122.273 122.521 -0.248 1
1 880 . 7 1 1 A 77 77 THR H H 77 6.984 7.546 -0.562 1
1 881 . 7 1 1 A 77 77 THR HA H 77 4.227 4.365 -0.138 1
1 886 . 7 1 1 A 77 77 THR C C 77 173.531 174.207 -0.676 1
1 887 . 7 1 1 A 77 77 THR CA C 77 61.435 63.418 -1.983 1
1 888 . 7 1 1 A 77 77 THR CB C 77 68.944 69.177 -0.233 1
1 890 . 7 1 1 A 77 77 THR N N 77 105.803 114.265 -8.462 1
1 891 . 7 1 1 A 78 78 ALA H H 78 7.647 7.639 0.008 1
1 892 . 7 1 1 A 78 78 ALA HA H 78 4.757 4.421 0.336 1
1 896 . 7 1 1 A 78 78 ALA C C 78 173.520 177.251 -3.731 1
1 897 . 7 1 1 A 78 78 ALA CA C 78 51.164 51.581 -0.417 1
1 898 . 7 1 1 A 78 78 ALA CB C 78 20.011 21.543 -1.532 1
1 899 . 7 1 1 A 78 78 ALA N N 78 126.635 123.707 2.928 1
1 900 . 7 1 1 A 79 79 SER H H 79 7.884 8.574 -0.690 1
1 901 . 7 1 1 A 79 79 SER HA H 79 4.386 5.217 -0.831 1
1 903 . 7 1 1 A 79 79 SER C C 79 176.077 172.923 3.154 1
1 904 . 7 1 1 A 79 79 SER CA C 79 57.465 56.188 1.277 1
1 905 . 7 1 1 A 79 79 SER CB C 79 65.285 65.799 -0.514 1
1 906 . 7 1 1 A 79 79 SER N N 79 115.272 112.608 2.664 1
1 907 . 7 1 1 A 80 80 LEU H H 80 7.700 8.796 -1.096 1
1 908 . 7 1 1 A 80 80 LEU HA H 80 4.912 5.253 -0.341 1
1 915 . 7 1 1 A 80 80 LEU C C 80 173.927 174.421 -0.494 1
1 916 . 7 1 1 A 80 80 LEU CA C 80 53.829 53.746 0.083 1
1 917 . 7 1 1 A 80 80 LEU CB C 80 45.990 46.996 -1.006 1
1 920 . 7 1 1 A 80 80 LEU N N 80 121.507 123.678 -2.171 1
1 921 . 7 1 1 A 81 81 SER H H 81 7.885 8.951 -1.066 1
1 922 . 7 1 1 A 81 81 SER HA H 81 5.269 5.049 0.220 1
1 925 . 7 1 1 A 81 81 SER C C 81 175.756 174.710 1.046 1
1 926 . 7 1 1 A 81 81 SER CA C 81 55.507 57.543 -2.036 1
1 927 . 7 1 1 A 81 81 SER CB C 81 65.966 67.213 -1.247 1
1 928 . 7 1 1 A 81 81 SER N N 81 118.323 121.891 -3.568 1
1 929 . 7 1 1 A 82 82 HIS H H 82 8.935 8.896 0.039 1
1 930 . 7 1 1 A 82 82 HIS HA H 82 4.407 4.439 -0.032 1
1 932 . 7 1 1 A 82 82 HIS C C 82 176.550 177.020 -0.470 1
1 933 . 7 1 1 A 82 82 HIS CA C 82 60.960 58.867 2.093 1
1 934 . 7 1 1 A 82 82 HIS CB C 82 30.755 29.386 1.369 1
1 935 . 7 1 1 A 82 82 HIS N N 82 124.042 122.078 1.964 1
1 936 . 7 1 1 A 83 83 ASN H H 83 8.435 8.234 0.201 1
1 937 . 7 1 1 A 83 83 ASN HA H 83 4.439 4.224 0.215 1
1 941 . 7 1 1 A 83 83 ASN C C 83 174.769 177.427 -2.658 1
1 942 . 7 1 1 A 83 83 ASN CA C 83 56.575 56.580 -0.005 1
1 943 . 7 1 1 A 83 83 ASN CB C 83 38.731 38.882 -0.151 1
1 944 . 7 1 1 A 83 83 ASN N N 83 118.543 119.755 -1.212 1
1 946 . 7 1 1 A 84 84 ARG H H 84 7.716 7.853 -0.137 1
1 947 . 7 1 1 A 84 84 ARG HA H 84 4.183 4.593 -0.410 1
1 953 . 7 1 1 A 84 84 ARG C C 84 177.399 178.352 -0.953 1
1 954 . 7 1 1 A 84 84 ARG CA C 84 59.045 59.441 -0.396 1
1 955 . 7 1 1 A 84 84 ARG CB C 84 29.992 29.902 0.090 1
1 957 . 7 1 1 A 84 84 ARG N N 84 121.312 119.581 1.731 1
1 958 . 7 1 1 A 85 85 ILE H H 85 8.354 7.912 0.442 1
1 959 . 7 1 1 A 85 85 ILE HA H 85 3.650 3.987 -0.337 1
1 967 . 7 1 1 A 85 85 ILE C C 85 176.098 178.063 -1.965 1
1 968 . 7 1 1 A 85 85 ILE CA C 85 66.704 64.635 2.069 1
1 969 . 7 1 1 A 85 85 ILE CB C 85 38.017 37.702 0.315 1
1 972 . 7 1 1 A 85 85 ILE N N 85 119.321 118.797 0.524 1
1 973 . 7 1 1 A 86 86 ARG H H 86 7.690 7.934 -0.244 1
1 974 . 7 1 1 A 86 86 ARG HA H 86 3.704 3.927 -0.223 1
1 981 . 7 1 1 A 86 86 ARG C C 86 177.524 178.702 -1.178 1
1 982 . 7 1 1 A 86 86 ARG CA C 86 59.881 59.777 0.104 1
1 983 . 7 1 1 A 86 86 ARG CB C 86 29.248 29.758 -0.510 1
1 986 . 7 1 1 A 86 86 ARG N N 86 118.362 121.764 -3.402 1
1 987 . 7 1 1 A 87 87 GLU H H 87 7.884 7.646 0.238 1
1 988 . 7 1 1 A 87 87 GLU HA H 87 4.064 4.065 -0.001 1
1 993 . 7 1 1 A 87 87 GLU C C 87 178.785 179.554 -0.769 1
1 994 . 7 1 1 A 87 87 GLU CA C 87 58.999 58.901 0.098 1
1 995 . 7 1 1 A 87 87 GLU CB C 87 29.872 29.711 0.161 1
1 997 . 7 1 1 A 87 87 GLU N N 87 118.124 118.828 -0.704 1
1 998 . 7 1 1 A 88 88 ILE H H 88 8.715 7.769 0.946 1
1 999 . 7 1 1 A 88 88 ILE HA H 88 3.305 3.521 -0.216 1
1 1009 . 7 1 1 A 88 88 ILE C C 88 177.261 178.083 -0.822 1
1 1010 . 7 1 1 A 88 88 ILE CA C 88 65.822 64.898 0.924 1
1 1011 . 7 1 1 A 88 88 ILE CB C 88 37.370 37.355 0.015 1
1 1015 . 7 1 1 A 88 88 ILE N N 88 122.929 120.328 2.601 1
1 1016 . 7 1 1 A 89 89 LEU H H 89 8.486 8.695 -0.209 1
1 1017 . 7 1 1 A 89 89 LEU HA H 89 3.932 3.910 0.022 1
1 1023 . 7 1 1 A 89 89 LEU C C 89 177.919 179.090 -1.171 1
1 1024 . 7 1 1 A 89 89 LEU CA C 89 59.060 58.262 0.798 1
1 1025 . 7 1 1 A 89 89 LEU CB C 89 41.129 41.582 -0.453 1
1 1028 . 7 1 1 A 89 89 LEU N N 89 122.696 120.567 2.129 1
1 1029 . 7 1 1 A 90 90 LYS H H 90 7.790 7.999 -0.209 1
1 1030 . 7 1 1 A 90 90 LYS HA H 90 4.061 3.962 0.099 1
1 1035 . 7 1 1 A 90 90 LYS C C 90 178.432 178.678 -0.246 1
1 1036 . 7 1 1 A 90 90 LYS CA C 90 59.840 59.335 0.505 1
1 1037 . 7 1 1 A 90 90 LYS CB C 90 32.582 32.278 0.304 1
1 1039 . 7 1 1 A 90 90 LYS N N 90 118.640 119.880 -1.240 1
1 1040 . 7 1 1 A 91 91 ALA H H 91 8.113 8.173 -0.060 1
1 1041 . 7 1 1 A 91 91 ALA HA H 91 4.151 4.077 0.074 1
1 1045 . 7 1 1 A 91 91 ALA C C 91 179.147 180.105 -0.958 1
1 1046 . 7 1 1 A 91 91 ALA CA C 91 54.942 55.287 -0.345 1
1 1047 . 7 1 1 A 91 91 ALA CB C 91 18.242 18.529 -0.287 1
1 1048 . 7 1 1 A 91 91 ALA N N 91 122.939 121.762 1.177 1
1 1049 . 7 1 1 A 92 92 SER H H 92 8.858 8.852 0.006 1
1 1050 . 7 1 1 A 92 92 SER HA H 92 4.898 4.145 0.753 1
1 1052 . 7 1 1 A 92 92 SER C C 92 172.440 177.165 -4.725 1
1 1053 . 7 1 1 A 92 92 SER CA C 92 61.913 61.852 0.061 1
1 1054 . 7 1 1 A 92 92 SER CB C 92 63.081 62.715 0.366 1
1 1055 . 7 1 1 A 92 92 SER N N 92 114.526 112.683 1.843 1
1 1056 . 7 1 1 A 93 93 ARG H H 93 7.704 7.914 -0.210 1
1 1057 . 7 1 1 A 93 93 ARG HA H 93 4.162 4.099 0.063 1
1 1059 . 7 1 1 A 93 93 ARG C C 93 177.757 178.668 -0.911 1
1 1060 . 7 1 1 A 93 93 ARG CA C 93 59.544 58.856 0.688 1
1 1061 . 7 1 1 A 93 93 ARG CB C 93 30.343 29.560 0.783 1
1 1062 . 7 1 1 A 93 93 ARG N N 93 121.505 121.754 -0.249 1
1 1063 . 7 1 1 A 94 94 LYS H H 94 7.456 7.933 -0.477 1
1 1064 . 7 1 1 A 94 94 LYS HA H 94 4.174 4.109 0.065 1
1 1071 . 7 1 1 A 94 94 LYS C C 94 178.861 178.840 0.021 1
1 1072 . 7 1 1 A 94 94 LYS CA C 94 59.030 59.170 -0.140 1
1 1073 . 7 1 1 A 94 94 LYS CB C 94 32.239 31.977 0.262 1
1 1077 . 7 1 1 A 94 94 LYS N N 94 119.072 120.366 -1.294 1
1 1078 . 7 1 1 A 95 95 LEU H H 95 8.148 7.848 0.300 1
1 1079 . 7 1 1 A 95 95 LEU HA H 95 4.129 4.174 -0.045 1
1 1088 . 7 1 1 A 95 95 LEU C C 95 177.274 178.809 -1.535 1
1 1089 . 7 1 1 A 95 95 LEU CA C 95 57.136 55.819 1.317 1
1 1090 . 7 1 1 A 95 95 LEU CB C 95 41.908 42.010 -0.102 1
1 1093 . 7 1 1 A 95 95 LEU N N 95 119.717 119.320 0.397 1
1 1094 . 7 1 1 A 96 96 GLN H H 96 7.807 7.427 0.380 1
1 1095 . 7 1 1 A 96 96 GLN HA H 96 4.242 4.355 -0.113 1
1 1102 . 7 1 1 A 96 96 GLN C C 96 175.371 175.987 -0.616 1
1 1103 . 7 1 1 A 96 96 GLN CA C 96 56.397 56.496 -0.099 1
1 1104 . 7 1 1 A 96 96 GLN CB C 96 29.123 29.342 -0.219 1
1 1106 . 7 1 1 A 96 96 GLN N N 96 114.581 118.579 -3.998 1
1 1108 . 7 1 1 A 97 97 GLY H H 97 7.802 7.693 0.109 1
1 1109 . 7 1 1 A 97 97 GLY HA2 H 97 3.839 4.051 -0.212 1
1 1110 . 7 1 1 A 97 97 GLY HA3 H 97 4.096 4.051 0.045 1
1 1111 . 7 1 1 A 97 97 GLY C C 97 172.636 173.098 -0.462 1
1 1112 . 7 1 1 A 97 97 GLY CA C 97 46.372 45.439 0.933 1
1 1113 . 7 1 1 A 97 97 GLY N N 97 106.959 107.171 -0.212 1
1 1114 . 7 1 1 A 98 98 ASP H H 98 8.156 7.711 0.445 1
1 1115 . 7 1 1 A 98 98 ASP HA H 98 4.754 5.170 -0.416 1
1 1118 . 7 1 1 A 98 98 ASP CA C 98 52.882 51.538 1.344 1
1 1119 . 7 1 1 A 98 98 ASP CB C 98 41.603 43.269 -1.666 1
1 1120 . 7 1 1 A 98 98 ASP N N 98 118.447 116.008 2.439 1
1 1121 . 7 1 1 A 99 99 PRO HA H 99 4.470 4.495 -0.025 1
1 1126 . 7 1 1 A 99 99 PRO C C 99 175.500 176.292 -0.792 1
1 1127 . 7 1 1 A 99 99 PRO CA C 99 63.601 63.990 -0.389 1
1 1128 . 7 1 1 A 99 99 PRO CB C 99 32.423 32.515 -0.092 1
1 1130 . 7 1 1 A 100 100 ASP H H 100 8.527 8.272 0.255 1
1 1131 . 7 1 1 A 100 100 ASP HA H 100 4.778 4.918 -0.140 1
1 1134 . 7 1 1 A 100 100 ASP C C 100 174.931 176.135 -1.204 1
1 1135 . 7 1 1 A 100 100 ASP CA C 100 53.915 53.642 0.273 1
1 1136 . 7 1 1 A 100 100 ASP CB C 100 40.665 42.495 -1.830 1
1 1137 . 7 1 1 A 100 100 ASP N N 100 119.340 116.509 2.831 1
1 1138 . 7 1 1 A 101 101 LEU H H 101 7.379 6.987 0.392 1
1 1139 . 7 1 1 A 101 101 LEU HA H 101 4.682 4.559 0.123 1
1 1148 . 7 1 1 A 101 101 LEU CA C 101 52.956 53.089 -0.133 1
1 1149 . 7 1 1 A 101 101 LEU CB C 101 43.393 41.750 1.643 1
1 1152 . 7 1 1 A 101 101 LEU N N 101 122.107 116.757 5.350 1
1 1153 . 7 1 1 A 102 102 PRO HA H 102 4.487 4.627 -0.140 1
1 1158 . 7 1 1 A 102 102 PRO C C 102 175.697 175.485 0.212 1
1 1159 . 7 1 1 A 102 102 PRO CA C 102 63.113 62.906 0.207 1
1 1160 . 7 1 1 A 102 102 PRO CB C 102 32.138 31.737 0.401 1
1 1163 . 7 1 1 A 103 103 MET H H 103 9.011 8.744 0.267 1
1 1164 . 7 1 1 A 103 103 MET HA H 103 4.769 4.998 -0.229 1
1 1171 . 7 1 1 A 103 103 MET C C 103 174.080 174.224 -0.144 1
1 1172 . 7 1 1 A 103 103 MET CA C 103 54.737 53.498 1.239 1
1 1173 . 7 1 1 A 103 103 MET CB C 103 34.857 35.183 -0.326 1
1 1176 . 7 1 1 A 103 103 MET N N 103 123.334 122.543 0.791 1
1 1177 . 7 1 1 A 104 104 SER H H 104 8.239 8.579 -0.340 1
1 1178 . 7 1 1 A 104 104 SER HA H 104 5.079 4.897 0.182 1
1 1181 . 7 1 1 A 104 104 SER C C 104 171.795 172.630 -0.835 1
1 1182 . 7 1 1 A 104 104 SER CA C 104 57.641 57.696 -0.055 1
1 1183 . 7 1 1 A 104 104 SER CB C 104 66.282 67.379 -1.097 1
1 1184 . 7 1 1 A 104 104 SER N N 104 114.434 117.033 -2.599 1
1 1185 . 7 1 1 A 105 105 PHE H H 105 9.003 8.303 0.700 1
1 1186 . 7 1 1 A 105 105 PHE HA H 105 5.209 5.296 -0.087 1
1 1193 . 7 1 1 A 105 105 PHE C C 105 170.688 172.004 -1.316 1
1 1194 . 7 1 1 A 105 105 PHE CA C 105 56.917 55.879 1.038 1
1 1195 . 7 1 1 A 105 105 PHE CB C 105 41.350 41.324 0.026 1
1 1196 . 7 1 1 A 105 105 PHE N N 105 116.224 118.685 -2.461 1
1 1197 . 7 1 1 A 106 106 THR H H 106 9.074 9.055 0.019 1
1 1198 . 7 1 1 A 106 106 THR HA H 106 4.664 4.877 -0.213 1
1 1203 . 7 1 1 A 106 106 THR C C 106 171.767 174.499 -2.732 1
1 1204 . 7 1 1 A 106 106 THR CA C 106 62.162 61.581 0.581 1
1 1205 . 7 1 1 A 106 106 THR CB C 106 70.072 70.461 -0.389 1
1 1207 . 7 1 1 A 106 106 THR N N 106 117.469 116.125 1.344 1
1 1208 . 7 1 1 A 107 107 LEU H H 107 9.804 9.421 0.383 1
1 1209 . 7 1 1 A 107 107 LEU HA H 107 4.750 4.760 -0.010 1
1 1219 . 7 1 1 A 107 107 LEU C C 107 172.742 175.932 -3.190 1
1 1220 . 7 1 1 A 107 107 LEU CA C 107 54.151 54.885 -0.734 1
1 1221 . 7 1 1 A 107 107 LEU CB C 107 44.486 42.363 2.123 1
1 1224 . 7 1 1 A 107 107 LEU N N 107 133.400 128.340 5.060 1
1 1225 . 7 1 1 A 108 108 ALA H H 108 8.435 8.967 -0.532 1
1 1226 . 7 1 1 A 108 108 ALA HA H 108 4.683 4.422 0.261 1
1 1230 . 7 1 1 A 108 108 ALA C C 108 173.052 175.815 -2.763 1
1 1231 . 7 1 1 A 108 108 ALA CA C 108 49.308 50.611 -1.303 1
1 1232 . 7 1 1 A 108 108 ALA CB C 108 22.120 19.874 2.246 1
1 1233 . 7 1 1 A 108 108 ALA N N 108 131.422 127.140 4.282 1
1 1234 . 7 1 1 A 109 109 ILE H H 109 8.909 9.077 -0.168 1
1 1235 . 7 1 1 A 109 109 ILE HA H 109 4.063 5.294 -1.231 1
1 1245 . 7 1 1 A 109 109 ILE CA C 109 60.982 60.165 0.817 1
1 1246 . 7 1 1 A 109 109 ILE CB C 109 39.074 38.412 0.662 1
1 1250 . 7 1 1 A 109 109 ILE N N 109 124.415 123.907 0.508 1
1 1251 . 7 1 1 A 110 110 VAL H H 110 8.706 9.310 -0.604 1
1 1252 . 7 1 1 A 110 110 VAL HA H 110 4.324 5.245 -0.921 1
1 1260 . 7 1 1 A 110 110 VAL C C 110 175.700 174.163 1.537 1
1 1261 . 7 1 1 A 110 110 VAL CA C 110 62.316 58.947 3.369 1
1 1262 . 7 1 1 A 110 110 VAL CB C 110 31.876 34.825 -2.949 1
1 1264 . 7 1 1 A 110 110 VAL N N 110 127.457 122.516 4.941 1
1 1265 . 7 1 1 A 111 111 GLU H H 111 9.024 9.042 -0.018 1
1 1266 . 7 1 1 A 111 111 GLU HA H 111 4.403 4.579 -0.176 1
1 1269 . 7 1 1 A 111 111 GLU C C 111 175.987 177.762 -1.775 1
1 1270 . 7 1 1 A 111 111 GLU CA C 111 56.842 56.414 0.428 1
1 1271 . 7 1 1 A 111 111 GLU CB C 111 31.044 31.964 -0.920 1
1 1272 . 7 1 1 A 111 111 GLU N N 111 129.768 124.984 4.784 1
1 1273 . 7 1 1 A 112 112 SER H H 112 9.143 8.912 0.231 1
1 1274 . 7 1 1 A 112 112 SER HA H 112 4.394 4.301 0.093 1
1 1276 . 7 1 1 A 112 112 SER C C 112 173.187 175.703 -2.516 1
1 1277 . 7 1 1 A 112 112 SER CA C 112 60.180 60.487 -0.307 1
1 1278 . 7 1 1 A 112 112 SER CB C 112 63.415 62.994 0.421 1
1 1279 . 7 1 1 A 112 112 SER N N 112 115.956 121.811 -5.855 1
1 1280 . 7 1 1 A 113 113 ASP H H 113 8.133 8.064 0.069 1
1 1281 . 7 1 1 A 113 113 ASP HA H 113 4.573 4.558 0.015 1
1 1284 . 7 1 1 A 113 113 ASP C C 113 175.430 176.628 -1.198 1
1 1285 . 7 1 1 A 113 113 ASP CA C 113 54.115 56.186 -2.071 1
1 1286 . 7 1 1 A 113 113 ASP CB C 113 40.011 41.978 -1.967 1
1 1287 . 7 1 1 A 113 113 ASP N N 113 118.343 121.772 -3.429 1
1 1288 . 7 1 1 A 114 114 SER H H 114 8.034 7.885 0.149 1
1 1289 . 7 1 1 A 114 114 SER HA H 114 4.057 4.608 -0.551 1
1 1291 . 7 1 1 A 114 114 SER C C 114 172.209 174.523 -2.314 1
1 1292 . 7 1 1 A 114 114 SER CA C 114 60.179 58.572 1.607 1
1 1293 . 7 1 1 A 114 114 SER CB C 114 62.702 65.101 -2.399 1
1 1294 . 7 1 1 A 114 114 SER N N 114 109.836 108.211 1.625 1
1 1295 . 7 1 1 A 115 115 THR H H 115 7.711 7.851 -0.140 1
1 1296 . 7 1 1 A 115 115 THR HA H 115 4.250 4.158 0.092 1
1 1300 . 7 1 1 A 115 115 THR C C 115 171.500 174.250 -2.750 1
1 1301 . 7 1 1 A 115 115 THR CA C 115 63.547 64.122 -0.575 1
1 1302 . 7 1 1 A 115 115 THR CB C 115 69.595 69.302 0.293 1
1 1303 . 7 1 1 A 115 115 THR N N 115 117.407 117.653 -0.246 1
1 1304 . 7 1 1 A 116 116 ILE H H 116 8.219 8.630 -0.411 1
1 1305 . 7 1 1 A 116 116 ILE HA H 116 4.769 4.990 -0.221 1
1 1315 . 7 1 1 A 116 116 ILE C C 116 174.434 174.724 -0.290 1
1 1316 . 7 1 1 A 116 116 ILE CA C 116 60.306 59.627 0.679 1
1 1317 . 7 1 1 A 116 116 ILE CB C 116 40.686 39.846 0.840 1
1 1321 . 7 1 1 A 116 116 ILE N N 116 125.480 128.130 -2.650 1
1 1322 . 7 1 1 A 117 117 VAL H H 117 8.695 9.572 -0.877 1
1 1323 . 7 1 1 A 117 117 VAL HA H 117 4.315 4.773 -0.458 1
1 1328 . 7 1 1 A 117 117 VAL C C 117 172.243 174.532 -2.289 1
1 1329 . 7 1 1 A 117 117 VAL CA C 117 60.621 60.904 -0.283 1
1 1330 . 7 1 1 A 117 117 VAL CB C 117 34.558 34.053 0.505 1
1 1332 . 7 1 1 A 117 117 VAL N N 117 127.887 127.153 0.734 1
1 1333 . 7 1 1 A 118 118 TYR H H 118 8.270 8.957 -0.687 1
1 1334 . 7 1 1 A 118 118 TYR HA H 118 5.327 5.423 -0.096 1
1 1342 . 7 1 1 A 118 118 TYR C C 118 174.250 174.659 -0.409 1
1 1343 . 7 1 1 A 118 118 TYR CA C 118 57.283 57.026 0.257 1
1 1344 . 7 1 1 A 118 118 TYR CB C 118 39.262 39.133 0.129 1
1 1345 . 7 1 1 A 118 118 TYR N N 118 124.822 126.832 -2.010 1
1 1346 . 7 1 1 A 119 119 TYR H H 119 9.207 9.328 -0.121 1
1 1347 . 7 1 1 A 119 119 TYR HA H 119 4.821 5.292 -0.471 1
1 1354 . 7 1 1 A 119 119 TYR C C 119 171.994 174.055 -2.061 1
1 1355 . 7 1 1 A 119 119 TYR CA C 119 58.116 56.649 1.467 1
1 1356 . 7 1 1 A 119 119 TYR CB C 119 43.544 41.821 1.723 1
1 1357 . 7 1 1 A 119 119 TYR N N 119 125.153 125.343 -0.190 1
1 1358 . 7 1 1 A 120 120 LYS H H 120 7.700 8.395 -0.695 1
1 1359 . 7 1 1 A 120 120 LYS HA H 120 4.558 4.524 0.034 1
1 1366 . 7 1 1 A 120 120 LYS C C 120 172.017 174.731 -2.714 1
1 1367 . 7 1 1 A 120 120 LYS CA C 120 57.217 56.328 0.889 1
1 1368 . 7 1 1 A 120 120 LYS CB C 120 33.914 32.904 1.010 1
1 1372 . 7 1 1 A 120 120 LYS N N 120 129.442 129.694 -0.252 1
1 1373 . 7 1 1 A 121 121 LEU H H 121 8.112 8.742 -0.630 1
1 1374 . 7 1 1 A 121 121 LEU HA H 121 5.323 4.939 0.384 1
1 1384 . 7 1 1 A 121 121 LEU C C 121 175.733 174.640 1.093 1
1 1385 . 7 1 1 A 121 121 LEU CA C 121 52.716 53.185 -0.469 1
1 1386 . 7 1 1 A 121 121 LEU CB C 121 44.098 44.950 -0.852 1
1 1389 . 7 1 1 A 121 121 LEU N N 121 123.403 129.018 -5.615 1
1 1390 . 7 1 1 A 122 122 THR H H 122 8.338 9.098 -0.760 1
1 1391 . 7 1 1 A 122 122 THR HA H 122 5.097 5.153 -0.056 1
1 1396 . 7 1 1 A 122 122 THR C C 122 173.221 172.284 0.937 1
1 1397 . 7 1 1 A 122 122 THR CA C 122 60.306 61.187 -0.881 1
1 1398 . 7 1 1 A 122 122 THR CB C 122 72.473 71.490 0.983 1
1 1400 . 7 1 1 A 122 122 THR N N 122 109.081 122.485 -13.404 1
1 7 . 8 1 1 A 2 2 GLU H H 2 8.994 7.967 1.027 1
1 8 . 8 1 1 A 2 2 GLU HA H 2 4.278 4.693 -0.415 1
1 13 . 8 1 1 A 2 2 GLU C C 2 175.315 176.607 -1.292 1
1 14 . 8 1 1 A 2 2 GLU CA C 2 57.318 55.673 1.645 1
1 15 . 8 1 1 A 2 2 GLU CB C 2 29.221 30.593 -1.372 1
1 17 . 8 1 1 A 2 2 GLU N N 2 122.259 117.348 4.911 1
1 18 . 8 1 1 A 3 3 ASP H H 3 8.048 7.745 0.303 1
1 19 . 8 1 1 A 3 3 ASP HA H 3 4.580 4.985 -0.405 1
1 21 . 8 1 1 A 3 3 ASP C C 3 175.636 176.812 -1.176 1
1 22 . 8 1 1 A 3 3 ASP CA C 3 54.579 54.811 -0.232 1
1 23 . 8 1 1 A 3 3 ASP CB C 3 40.984 43.037 -2.053 1
1 24 . 8 1 1 A 3 3 ASP N N 3 119.830 117.856 1.974 1
1 25 . 8 1 1 A 4 4 ALA H H 4 8.090 7.942 0.148 1
1 26 . 8 1 1 A 4 4 ALA HA H 4 4.216 5.077 -0.861 1
1 30 . 8 1 1 A 4 4 ALA C C 4 177.157 177.124 0.033 1
1 31 . 8 1 1 A 4 4 ALA CA C 4 53.620 52.934 0.686 1
1 32 . 8 1 1 A 4 4 ALA CB C 4 18.728 17.496 1.232 1
1 33 . 8 1 1 A 4 4 ALA N N 4 123.957 121.226 2.731 1
1 34 . 8 1 1 A 5 5 TRP H H 5 7.941 8.194 -0.253 1
1 35 . 8 1 1 A 5 5 TRP HA H 5 4.559 4.610 -0.051 1
1 39 . 8 1 1 A 5 5 TRP C C 5 176.072 177.610 -1.538 1
1 40 . 8 1 1 A 5 5 TRP CA C 5 57.744 59.084 -1.340 1
1 41 . 8 1 1 A 5 5 TRP CB C 5 28.906 30.463 -1.557 1
1 42 . 8 1 1 A 5 5 TRP N N 5 118.408 119.688 -1.280 1
1 44 . 8 1 1 A 6 6 MET H H 6 7.679 7.773 -0.094 1
1 45 . 8 1 1 A 6 6 MET HA H 6 3.785 4.698 -0.913 1
1 52 . 8 1 1 A 6 6 MET C C 6 175.174 176.538 -1.364 1
1 53 . 8 1 1 A 6 6 MET CA C 6 57.724 56.284 1.440 1
1 54 . 8 1 1 A 6 6 MET CB C 6 31.640 35.243 -3.603 1
1 57 . 8 1 1 A 6 6 MET N N 6 121.538 115.261 6.277 1
1 58 . 8 1 1 A 7 7 GLY H H 7 7.247 7.976 -0.729 1
1 59 . 8 1 1 A 7 7 GLY HA2 H 7 3.455 4.071 -0.616 1
1 60 . 8 1 1 A 7 7 GLY HA3 H 7 3.578 4.133 -0.555 1
1 61 . 8 1 1 A 7 7 GLY C C 7 172.852 172.925 -0.073 1
1 62 . 8 1 1 A 7 7 GLY CA C 7 45.896 44.232 1.664 1
1 63 . 8 1 1 A 7 7 GLY N N 7 104.055 108.009 -3.954 1
1 64 . 8 1 1 A 8 8 THR H H 8 7.436 8.452 -1.016 1
1 65 . 8 1 1 A 8 8 THR HA H 8 4.428 4.536 -0.108 1
1 70 . 8 1 1 A 8 8 THR C C 8 172.973 173.099 -0.126 1
1 71 . 8 1 1 A 8 8 THR CA C 8 60.751 61.178 -0.427 1
1 72 . 8 1 1 A 8 8 THR CB C 8 69.637 69.961 -0.324 1
1 74 . 8 1 1 A 8 8 THR N N 8 107.669 114.848 -7.179 1
1 75 . 8 1 1 A 9 9 HIS H H 9 8.048 7.723 0.325 1
1 76 . 8 1 1 A 9 9 HIS HA H 9 4.654 5.082 -0.428 1
1 79 . 8 1 1 A 9 9 HIS CA C 9 56.163 53.146 3.017 1
1 80 . 8 1 1 A 9 9 HIS CB C 9 32.619 30.863 1.756 1
1 81 . 8 1 1 A 9 9 HIS N N 9 127.281 121.831 5.450 1
1 82 . 8 1 1 A 10 10 PRO HA H 10 4.257 4.258 -0.001 1
1 88 . 8 1 1 A 10 10 PRO C C 10 178.779 179.184 -0.405 1
1 89 . 8 1 1 A 10 10 PRO CA C 10 65.565 66.035 -0.470 1
1 90 . 8 1 1 A 10 10 PRO CB C 10 32.422 31.983 0.439 1
1 93 . 8 1 1 A 11 11 LYS H H 11 10.994 8.448 2.546 1
1 94 . 8 1 1 A 11 11 LYS HA H 11 4.282 4.186 0.096 1
1 100 . 8 1 1 A 11 11 LYS C C 11 177.279 178.920 -1.641 1
1 101 . 8 1 1 A 11 11 LYS CA C 11 56.859 59.692 -2.833 1
1 102 . 8 1 1 A 11 11 LYS CB C 11 31.279 32.513 -1.234 1
1 104 . 8 1 1 A 11 11 LYS N N 11 121.398 118.305 3.093 1
1 105 . 8 1 1 A 12 12 TYR H H 12 7.146 8.181 -1.035 1
1 106 . 8 1 1 A 12 12 TYR HA H 12 3.722 4.365 -0.643 1
1 113 . 8 1 1 A 12 12 TYR C C 12 176.265 177.562 -1.297 1
1 114 . 8 1 1 A 12 12 TYR CA C 12 61.189 61.450 -0.261 1
1 115 . 8 1 1 A 12 12 TYR CB C 12 37.796 38.675 -0.879 1
1 116 . 8 1 1 A 12 12 TYR N N 12 121.579 121.075 0.504 1
1 117 . 8 1 1 A 13 13 LEU H H 13 7.778 9.108 -1.330 1
1 118 . 8 1 1 A 13 13 LEU HA H 13 3.773 3.943 -0.170 1
1 127 . 8 1 1 A 13 13 LEU C C 13 178.462 179.239 -0.777 1
1 128 . 8 1 1 A 13 13 LEU CA C 13 57.942 58.303 -0.361 1
1 129 . 8 1 1 A 13 13 LEU CB C 13 41.064 41.758 -0.694 1
1 132 . 8 1 1 A 13 13 LEU N N 13 117.518 120.012 -2.494 1
1 133 . 8 1 1 A 14 14 GLU H H 14 7.867 8.443 -0.576 1
1 134 . 8 1 1 A 14 14 GLU HA H 14 3.935 3.925 0.010 1
1 139 . 8 1 1 A 14 14 GLU C C 14 178.326 178.737 -0.411 1
1 140 . 8 1 1 A 14 14 GLU CA C 14 59.368 59.740 -0.372 1
1 141 . 8 1 1 A 14 14 GLU CB C 14 30.147 29.183 0.964 1
1 143 . 8 1 1 A 14 14 GLU N N 14 119.135 118.883 0.252 1
1 144 . 8 1 1 A 15 15 MET H H 15 7.773 7.863 -0.090 1
1 145 . 8 1 1 A 15 15 MET HA H 15 3.936 4.147 -0.211 1
1 152 . 8 1 1 A 15 15 MET C C 15 177.886 178.177 -0.291 1
1 153 . 8 1 1 A 15 15 MET CA C 15 59.465 58.102 1.363 1
1 154 . 8 1 1 A 15 15 MET CB C 15 33.987 32.308 1.679 1
1 157 . 8 1 1 A 15 15 MET N N 15 117.884 119.332 -1.448 1
1 158 . 8 1 1 A 16 16 MET H H 16 8.145 8.552 -0.407 1
1 159 . 8 1 1 A 16 16 MET HA H 16 4.159 4.112 0.047 1
1 166 . 8 1 1 A 16 16 MET C C 16 177.835 178.376 -0.541 1
1 167 . 8 1 1 A 16 16 MET CA C 16 57.397 57.609 -0.212 1
1 168 . 8 1 1 A 16 16 MET CB C 16 31.867 31.017 0.850 1
1 171 . 8 1 1 A 16 16 MET N N 16 119.555 118.260 1.295 1
1 172 . 8 1 1 A 17 17 GLU H H 17 7.761 8.271 -0.510 1
1 173 . 8 1 1 A 17 17 GLU HA H 17 4.117 4.029 0.088 1
1 176 . 8 1 1 A 17 17 GLU C C 17 175.994 177.266 -1.272 1
1 177 . 8 1 1 A 17 17 GLU CA C 17 57.392 58.664 -1.272 1
1 178 . 8 1 1 A 17 17 GLU CB C 17 29.432 29.437 -0.005 1
1 180 . 8 1 1 A 17 17 GLU N N 17 118.216 120.010 -1.794 1
1 181 . 8 1 1 A 18 18 LEU H H 18 7.201 7.150 0.051 1
1 182 . 8 1 1 A 18 18 LEU HA H 18 4.111 4.139 -0.028 1
1 191 . 8 1 1 A 18 18 LEU C C 18 175.781 177.084 -1.303 1
1 192 . 8 1 1 A 18 18 LEU CA C 18 56.366 55.336 1.030 1
1 193 . 8 1 1 A 18 18 LEU CB C 18 42.030 42.210 -0.180 1
1 196 . 8 1 1 A 18 18 LEU N N 18 117.448 122.273 -4.825 1
1 197 . 8 1 1 A 19 19 ASP H H 19 7.789 8.728 -0.939 1
1 198 . 8 1 1 A 19 19 ASP HA H 19 4.360 4.700 -0.340 1
1 201 . 8 1 1 A 19 19 ASP C C 19 173.765 176.398 -2.633 1
1 202 . 8 1 1 A 19 19 ASP CA C 19 54.851 54.411 0.440 1
1 203 . 8 1 1 A 19 19 ASP CB C 19 39.115 39.542 -0.427 1
1 204 . 8 1 1 A 19 19 ASP N N 19 115.844 122.908 -7.064 1
1 205 . 8 1 1 A 20 20 ILE H H 20 8.142 8.099 0.043 1
1 206 . 8 1 1 A 20 20 ILE HA H 20 4.128 4.290 -0.162 1
1 216 . 8 1 1 A 20 20 ILE C C 20 174.710 176.594 -1.884 1
1 217 . 8 1 1 A 20 20 ILE CA C 20 60.465 62.389 -1.924 1
1 218 . 8 1 1 A 20 20 ILE CB C 20 40.407 39.925 0.482 1
1 222 . 8 1 1 A 20 20 ILE N N 20 117.287 117.724 -0.437 1
1 223 . 8 1 1 A 21 21 GLY H H 21 8.207 8.087 0.120 1
1 224 . 8 1 1 A 21 21 GLY HA2 H 21 3.889 3.881 0.008 1
1 225 . 8 1 1 A 21 21 GLY HA3 H 21 3.924 3.898 0.026 1
1 226 . 8 1 1 A 21 21 GLY C C 21 172.162 174.437 -2.275 1
1 227 . 8 1 1 A 21 21 GLY CA C 21 45.017 46.614 -1.597 1
1 228 . 8 1 1 A 21 21 GLY N N 21 110.656 109.756 0.900 1
1 229 . 8 1 1 A 22 22 ASP H H 22 7.727 8.077 -0.350 1
1 230 . 8 1 1 A 22 22 ASP HA H 22 4.794 4.819 -0.025 1
1 233 . 8 1 1 A 22 22 ASP C C 22 174.884 176.906 -2.022 1
1 234 . 8 1 1 A 22 22 ASP CA C 22 52.471 53.674 -1.203 1
1 235 . 8 1 1 A 22 22 ASP CB C 22 42.069 42.238 -0.169 1
1 236 . 8 1 1 A 22 22 ASP N N 22 119.305 119.628 -0.323 1
1 237 . 8 1 1 A 23 23 ALA H H 23 8.644 8.993 -0.349 1
1 238 . 8 1 1 A 23 23 ALA HA H 23 4.120 4.038 0.082 1
1 242 . 8 1 1 A 23 23 ALA C C 23 179.546 179.893 -0.347 1
1 243 . 8 1 1 A 23 23 ALA CA C 23 55.609 55.628 -0.019 1
1 244 . 8 1 1 A 23 23 ALA CB C 23 18.573 18.411 0.162 1
1 245 . 8 1 1 A 23 23 ALA N N 23 122.468 129.414 -6.946 1
1 246 . 8 1 1 A 24 24 THR H H 24 8.238 7.648 0.590 1
1 247 . 8 1 1 A 24 24 THR HA H 24 4.184 4.057 0.127 1
1 252 . 8 1 1 A 24 24 THR C C 24 174.841 176.794 -1.953 1
1 253 . 8 1 1 A 24 24 THR CA C 24 66.241 66.747 -0.506 1
1 254 . 8 1 1 A 24 24 THR CB C 24 68.376 68.472 -0.096 1
1 256 . 8 1 1 A 24 24 THR N N 24 114.824 113.558 1.266 1
1 257 . 8 1 1 A 25 25 GLN H H 25 8.037 8.431 -0.394 1
1 258 . 8 1 1 A 25 25 GLN HA H 25 4.095 4.022 0.073 1
1 265 . 8 1 1 A 25 25 GLN C C 25 177.603 178.680 -1.077 1
1 266 . 8 1 1 A 25 25 GLN CA C 25 59.261 58.780 0.481 1
1 267 . 8 1 1 A 25 25 GLN CB C 25 28.437 28.255 0.182 1
1 269 . 8 1 1 A 25 25 GLN N N 25 122.518 119.886 2.632 1
1 271 . 8 1 1 A 26 26 VAL H H 26 7.994 8.502 -0.508 1
1 272 . 8 1 1 A 26 26 VAL HA H 26 3.469 3.748 -0.279 1
1 280 . 8 1 1 A 26 26 VAL C C 26 175.552 177.920 -2.368 1
1 281 . 8 1 1 A 26 26 VAL CA C 26 66.909 65.690 1.219 1
1 282 . 8 1 1 A 26 26 VAL CB C 26 31.582 31.387 0.195 1
1 285 . 8 1 1 A 26 26 VAL N N 26 119.112 116.892 2.220 1
1 286 . 8 1 1 A 27 27 TYR H H 27 8.003 8.175 -0.172 1
1 287 . 8 1 1 A 27 27 TYR HA H 27 4.357 4.422 -0.065 1
1 294 . 8 1 1 A 27 27 TYR C C 27 175.856 176.992 -1.136 1
1 295 . 8 1 1 A 27 27 TYR CA C 27 62.197 61.735 0.462 1
1 296 . 8 1 1 A 27 27 TYR CB C 27 38.394 38.850 -0.456 1
1 297 . 8 1 1 A 27 27 TYR N N 27 119.170 124.625 -5.455 1
1 298 . 8 1 1 A 28 28 VAL H H 28 8.087 8.681 -0.594 1
1 299 . 8 1 1 A 28 28 VAL HA H 28 3.652 3.389 0.263 1
1 307 . 8 1 1 A 28 28 VAL C C 28 176.134 178.004 -1.870 1
1 308 . 8 1 1 A 28 28 VAL CA C 28 66.247 66.276 -0.029 1
1 309 . 8 1 1 A 28 28 VAL CB C 28 31.241 31.322 -0.081 1
1 312 . 8 1 1 A 28 28 VAL N N 28 113.112 119.299 -6.187 1
1 313 . 8 1 1 A 29 29 ALA H H 29 7.853 8.769 -0.916 1
1 314 . 8 1 1 A 29 29 ALA HA H 29 3.913 4.042 -0.129 1
1 318 . 8 1 1 A 29 29 ALA C C 29 177.850 179.104 -1.254 1
1 319 . 8 1 1 A 29 29 ALA CA C 29 55.274 54.985 0.289 1
1 320 . 8 1 1 A 29 29 ALA CB C 29 17.876 18.516 -0.640 1
1 321 . 8 1 1 A 29 29 ALA N N 29 121.350 122.678 -1.328 1
1 322 . 8 1 1 A 30 30 PHE H H 30 8.724 8.486 0.238 1
1 323 . 8 1 1 A 30 30 PHE HA H 30 4.098 4.231 -0.133 1
1 327 . 8 1 1 A 30 30 PHE C C 30 175.035 176.954 -1.919 1
1 328 . 8 1 1 A 30 30 PHE CA C 30 61.264 61.718 -0.454 1
1 329 . 8 1 1 A 30 30 PHE CB C 30 38.926 39.414 -0.488 1
1 330 . 8 1 1 A 30 30 PHE N N 30 120.478 120.118 0.360 1
1 331 . 8 1 1 A 31 31 LEU H H 31 8.146 7.899 0.247 1
1 332 . 8 1 1 A 31 31 LEU HA H 31 3.597 3.702 -0.105 1
1 341 . 8 1 1 A 31 31 LEU C C 31 179.508 179.106 0.402 1
1 342 . 8 1 1 A 31 31 LEU CA C 31 57.884 58.026 -0.142 1
1 343 . 8 1 1 A 31 31 LEU CB C 31 41.829 41.936 -0.107 1
1 346 . 8 1 1 A 31 31 LEU N N 31 118.427 120.634 -2.207 1
1 347 . 8 1 1 A 32 32 VAL H H 32 7.627 7.673 -0.046 1
1 348 . 8 1 1 A 32 32 VAL HA H 32 3.464 3.770 -0.306 1
1 356 . 8 1 1 A 32 32 VAL C C 32 174.956 177.607 -2.651 1
1 357 . 8 1 1 A 32 32 VAL CA C 32 66.373 65.496 0.877 1
1 358 . 8 1 1 A 32 32 VAL CB C 32 31.121 31.566 -0.445 1
1 361 . 8 1 1 A 32 32 VAL N N 32 119.497 114.798 4.699 1
1 362 . 8 1 1 A 33 33 TYR H H 33 8.366 8.664 -0.298 1
1 363 . 8 1 1 A 33 33 TYR HA H 33 3.485 3.946 -0.461 1
1 370 . 8 1 1 A 33 33 TYR C C 33 174.883 176.959 -2.076 1
1 371 . 8 1 1 A 33 33 TYR CA C 33 62.866 61.325 1.541 1
1 372 . 8 1 1 A 33 33 TYR CB C 33 37.778 38.333 -0.555 1
1 373 . 8 1 1 A 33 33 TYR N N 33 121.842 124.157 -2.315 1
1 374 . 8 1 1 A 34 34 LEU H H 34 8.000 8.378 -0.378 1
1 375 . 8 1 1 A 34 34 LEU HA H 34 3.495 3.618 -0.123 1
1 385 . 8 1 1 A 34 34 LEU C C 34 178.240 179.103 -0.863 1
1 386 . 8 1 1 A 34 34 LEU CA C 34 57.453 57.163 0.290 1
1 387 . 8 1 1 A 34 34 LEU CB C 34 41.828 40.801 1.027 1
1 390 . 8 1 1 A 34 34 LEU N N 34 116.692 119.266 -2.574 1
1 391 . 8 1 1 A 35 35 ASP H H 35 7.688 7.877 -0.189 1
1 392 . 8 1 1 A 35 35 ASP HA H 35 4.302 4.304 -0.002 1
1 395 . 8 1 1 A 35 35 ASP C C 35 177.507 178.310 -0.803 1
1 396 . 8 1 1 A 35 35 ASP CA C 35 58.196 57.612 0.584 1
1 397 . 8 1 1 A 35 35 ASP CB C 35 43.070 41.203 1.867 1
1 398 . 8 1 1 A 35 35 ASP N N 35 120.507 119.989 0.518 1
1 399 . 8 1 1 A 36 36 LEU H H 36 8.482 8.472 0.010 1
1 400 . 8 1 1 A 36 36 LEU HA H 36 3.328 3.737 -0.409 1
1 410 . 8 1 1 A 36 36 LEU C C 36 176.774 178.716 -1.942 1
1 411 . 8 1 1 A 36 36 LEU CA C 36 57.461 57.707 -0.246 1
1 412 . 8 1 1 A 36 36 LEU CB C 36 41.344 41.432 -0.088 1
1 416 . 8 1 1 A 36 36 LEU N N 36 117.671 120.084 -2.413 1
1 417 . 8 1 1 A 37 37 MET H H 37 7.822 8.287 -0.465 1
1 418 . 8 1 1 A 37 37 MET HA H 37 4.401 3.840 0.561 1
1 425 . 8 1 1 A 37 37 MET C C 37 177.862 178.785 -0.923 1
1 426 . 8 1 1 A 37 37 MET CA C 37 56.434 58.717 -2.283 1
1 427 . 8 1 1 A 37 37 MET CB C 37 31.573 32.520 -0.947 1
1 430 . 8 1 1 A 37 37 MET N N 37 112.952 116.058 -3.106 1
1 431 . 8 1 1 A 38 38 GLU H H 38 8.667 7.668 0.999 1
1 432 . 8 1 1 A 38 38 GLU HA H 38 4.457 4.179 0.278 1
1 436 . 8 1 1 A 38 38 GLU C C 38 176.582 177.051 -0.469 1
1 437 . 8 1 1 A 38 38 GLU CA C 38 57.659 58.545 -0.886 1
1 438 . 8 1 1 A 38 38 GLU CB C 38 29.936 30.236 -0.300 1
1 440 . 8 1 1 A 38 38 GLU N N 38 116.463 119.311 -2.848 1
1 441 . 8 1 1 A 39 39 SER H H 39 7.657 8.065 -0.408 1
1 442 . 8 1 1 A 39 39 SER HA H 39 4.658 4.696 -0.038 1
1 445 . 8 1 1 A 39 39 SER C C 39 175.661 175.791 -0.130 1
1 446 . 8 1 1 A 39 39 SER CA C 39 60.449 59.565 0.884 1
1 447 . 8 1 1 A 39 39 SER CB C 39 63.341 64.610 -1.269 1
1 448 . 8 1 1 A 39 39 SER N N 39 113.870 115.054 -1.184 1
1 449 . 8 1 1 A 40 40 LYS H H 40 8.165 7.380 0.785 1
1 450 . 8 1 1 A 40 40 LYS HA H 40 4.454 4.332 0.122 1
1 458 . 8 1 1 A 40 40 LYS C C 40 174.970 176.109 -1.139 1
1 459 . 8 1 1 A 40 40 LYS CA C 40 55.753 55.640 0.113 1
1 460 . 8 1 1 A 40 40 LYS CB C 40 32.337 33.380 -1.043 1
1 464 . 8 1 1 A 40 40 LYS N N 40 116.671 118.065 -1.394 1
1 465 . 8 1 1 A 41 41 SER H H 41 7.017 7.907 -0.890 1
1 466 . 8 1 1 A 41 41 SER HA H 41 4.209 4.098 0.111 1
1 469 . 8 1 1 A 41 41 SER C C 41 173.770 173.493 0.277 1
1 470 . 8 1 1 A 41 41 SER CA C 41 58.435 59.028 -0.593 1
1 471 . 8 1 1 A 41 41 SER CB C 41 61.700 61.493 0.207 1
1 472 . 8 1 1 A 41 41 SER N N 41 109.989 114.528 -4.539 1
1 473 . 8 1 1 A 42 42 TRP H H 42 8.876 8.132 0.744 1
1 474 . 8 1 1 A 42 42 TRP HA H 42 4.698 4.884 -0.186 1
1 478 . 8 1 1 A 42 42 TRP C C 42 174.477 177.631 -3.154 1
1 479 . 8 1 1 A 42 42 TRP CA C 42 59.443 57.064 2.379 1
1 480 . 8 1 1 A 42 42 TRP CB C 42 28.203 30.597 -2.394 1
1 481 . 8 1 1 A 42 42 TRP N N 42 121.116 125.725 -4.609 1
1 483 . 8 1 1 A 43 43 HIS H H 43 8.132 8.763 -0.631 1
1 484 . 8 1 1 A 43 43 HIS HA H 43 4.445 4.440 0.005 1
1 488 . 8 1 1 A 43 43 HIS C C 43 174.405 174.384 0.021 1
1 489 . 8 1 1 A 43 43 HIS CA C 43 58.556 58.953 -0.397 1
1 490 . 8 1 1 A 43 43 HIS CB C 43 29.430 30.759 -1.329 1
1 491 . 8 1 1 A 43 43 HIS N N 43 119.397 121.475 -2.078 1
1 492 . 8 1 1 A 44 44 GLU H H 44 8.140 7.609 0.531 1
1 493 . 8 1 1 A 44 44 GLU HA H 44 4.432 4.640 -0.208 1
1 497 . 8 1 1 A 44 44 GLU C C 44 173.010 174.419 -1.409 1
1 498 . 8 1 1 A 44 44 GLU CA C 44 56.421 56.199 0.222 1
1 499 . 8 1 1 A 44 44 GLU CB C 44 33.285 33.437 -0.152 1
1 501 . 8 1 1 A 44 44 GLU N N 44 116.181 118.022 -1.841 1
1 502 . 8 1 1 A 45 45 VAL H H 45 8.428 8.768 -0.340 1
1 503 . 8 1 1 A 45 45 VAL HA H 45 4.492 5.196 -0.704 1
1 511 . 8 1 1 A 45 45 VAL C C 45 172.339 174.667 -2.328 1
1 512 . 8 1 1 A 45 45 VAL CA C 45 63.071 61.062 2.009 1
1 513 . 8 1 1 A 45 45 VAL CB C 45 35.145 34.809 0.336 1
1 516 . 8 1 1 A 45 45 VAL N N 45 123.272 125.909 -2.637 1
1 517 . 8 1 1 A 46 46 ASN H H 46 9.050 8.925 0.125 1
1 518 . 8 1 1 A 46 46 ASN HA H 46 5.261 5.410 -0.149 1
1 523 . 8 1 1 A 46 46 ASN C C 46 172.845 173.728 -0.883 1
1 524 . 8 1 1 A 46 46 ASN CA C 46 51.895 51.796 0.099 1
1 525 . 8 1 1 A 46 46 ASN CB C 46 42.322 42.263 0.059 1
1 526 . 8 1 1 A 46 46 ASN N N 46 123.901 124.324 -0.423 1
1 528 . 8 1 1 A 47 47 CYS H H 47 9.039 9.076 -0.037 1
1 529 . 8 1 1 A 47 47 CYS HA H 47 5.160 5.449 -0.289 1
1 532 . 8 1 1 A 47 47 CYS C C 47 172.454 173.365 -0.911 1
1 533 . 8 1 1 A 47 47 CYS CA C 47 56.473 57.129 -0.656 1
1 534 . 8 1 1 A 47 47 CYS CB C 47 29.297 29.475 -0.178 1
1 535 . 8 1 1 A 47 47 CYS N N 47 119.663 118.608 1.055 1
1 536 . 8 1 1 A 48 48 VAL H H 48 9.083 8.956 0.127 1
1 537 . 8 1 1 A 48 48 VAL HA H 48 4.344 4.751 -0.407 1
1 542 . 8 1 1 A 48 48 VAL C C 48 173.307 174.878 -1.571 1
1 543 . 8 1 1 A 48 48 VAL CA C 48 61.368 60.694 0.674 1
1 544 . 8 1 1 A 48 48 VAL CB C 48 35.345 35.678 -0.333 1
1 546 . 8 1 1 A 48 48 VAL N N 48 124.672 123.883 0.789 1
1 547 . 8 1 1 A 49 49 GLY H H 49 9.019 9.017 0.002 1
1 548 . 8 1 1 A 49 49 GLY HA2 H 49 3.460 4.148 -0.688 1
1 549 . 8 1 1 A 49 49 GLY HA3 H 49 4.539 4.149 0.390 1
1 550 . 8 1 1 A 49 49 GLY C C 49 171.278 172.478 -1.200 1
1 551 . 8 1 1 A 49 49 GLY CA C 49 45.075 44.520 0.555 1
1 552 . 8 1 1 A 49 49 GLY N N 49 113.131 115.417 -2.286 1
1 553 . 8 1 1 A 50 50 LEU H H 50 8.747 9.135 -0.388 1
1 554 . 8 1 1 A 50 50 LEU HA H 50 5.102 4.942 0.160 1
1 564 . 8 1 1 A 50 50 LEU CA C 50 51.417 51.288 0.129 1
1 565 . 8 1 1 A 50 50 LEU CB C 50 41.754 42.536 -0.782 1
1 569 . 8 1 1 A 50 50 LEU N N 50 124.471 127.598 -3.127 1
1 570 . 8 1 1 A 51 51 PRO HA H 51 4.106 4.406 -0.300 1
1 577 . 8 1 1 A 51 51 PRO C C 51 178.422 177.660 0.762 1
1 578 . 8 1 1 A 51 51 PRO CA C 51 65.680 64.392 1.288 1
1 579 . 8 1 1 A 51 51 PRO CB C 51 31.939 31.782 0.157 1
1 582 . 8 1 1 A 52 52 GLU H H 52 9.721 8.356 1.365 1
1 583 . 8 1 1 A 52 52 GLU HA H 52 4.176 4.105 0.071 1
1 588 . 8 1 1 A 52 52 GLU C C 52 176.146 178.186 -2.040 1
1 589 . 8 1 1 A 52 52 GLU CA C 52 59.158 59.496 -0.338 1
1 590 . 8 1 1 A 52 52 GLU CB C 52 28.442 29.574 -1.132 1
1 592 . 8 1 1 A 52 52 GLU N N 52 118.552 118.228 0.324 1
1 593 . 8 1 1 A 53 53 LEU H H 53 7.089 7.868 -0.779 1
1 594 . 8 1 1 A 53 53 LEU HA H 53 4.511 4.490 0.021 1
1 603 . 8 1 1 A 53 53 LEU C C 53 174.027 176.402 -2.375 1
1 604 . 8 1 1 A 53 53 LEU CA C 53 53.825 54.732 -0.907 1
1 605 . 8 1 1 A 53 53 LEU CB C 53 43.825 43.276 0.549 1
1 608 . 8 1 1 A 53 53 LEU N N 53 116.763 119.611 -2.848 1
1 609 . 8 1 1 A 54 54 GLN H H 54 7.964 7.718 0.246 1
1 610 . 8 1 1 A 54 54 GLN HA H 54 3.591 3.886 -0.295 1
1 616 . 8 1 1 A 54 54 GLN C C 54 172.604 173.976 -1.372 1
1 617 . 8 1 1 A 54 54 GLN CA C 54 56.961 57.072 -0.111 1
1 618 . 8 1 1 A 54 54 GLN CB C 54 26.545 26.314 0.231 1
1 620 . 8 1 1 A 54 54 GLN N N 54 115.489 117.215 -1.726 1
1 622 . 8 1 1 A 55 55 LEU H H 55 7.139 7.626 -0.487 1
1 623 . 8 1 1 A 55 55 LEU HA H 55 4.750 4.739 0.011 1
1 629 . 8 1 1 A 55 55 LEU C C 55 173.475 175.344 -1.869 1
1 630 . 8 1 1 A 55 55 LEU CA C 55 53.698 53.129 0.569 1
1 631 . 8 1 1 A 55 55 LEU CB C 55 47.859 43.633 4.226 1
1 633 . 8 1 1 A 55 55 LEU N N 55 116.422 115.419 1.003 1
1 634 . 8 1 1 A 56 56 ILE H H 56 8.223 8.806 -0.583 1
1 635 . 8 1 1 A 56 56 ILE HA H 56 4.540 5.048 -0.508 1
1 643 . 8 1 1 A 56 56 ILE C C 56 173.938 174.641 -0.703 1
1 644 . 8 1 1 A 56 56 ILE CA C 56 61.020 60.458 0.562 1
1 645 . 8 1 1 A 56 56 ILE CB C 56 39.403 39.510 -0.107 1
1 648 . 8 1 1 A 56 56 ILE N N 56 122.792 121.794 0.998 1
1 649 . 8 1 1 A 57 57 CYS H H 57 8.995 8.921 0.074 1
1 650 . 8 1 1 A 57 57 CYS HA H 57 5.036 5.122 -0.086 1
1 653 . 8 1 1 A 57 57 CYS C C 57 170.483 173.150 -2.667 1
1 654 . 8 1 1 A 57 57 CYS CA C 57 56.484 57.798 -1.314 1
1 655 . 8 1 1 A 57 57 CYS CB C 57 30.545 30.729 -0.184 1
1 656 . 8 1 1 A 57 57 CYS N N 57 121.575 126.382 -4.807 1
1 657 . 8 1 1 A 58 58 LEU H H 58 9.076 8.460 0.616 1
1 658 . 8 1 1 A 58 58 LEU HA H 58 5.472 5.670 -0.198 1
1 668 . 8 1 1 A 58 58 LEU C C 58 174.009 176.098 -2.089 1
1 669 . 8 1 1 A 58 58 LEU CA C 58 52.851 53.655 -0.804 1
1 670 . 8 1 1 A 58 58 LEU CB C 58 42.177 42.961 -0.784 1
1 674 . 8 1 1 A 58 58 LEU N N 58 121.895 126.415 -4.520 1
1 675 . 8 1 1 A 59 59 VAL H H 59 8.966 8.597 0.369 1
1 676 . 8 1 1 A 59 59 VAL HA H 59 5.488 5.261 0.227 1
1 681 . 8 1 1 A 59 59 VAL C C 59 176.034 175.445 0.589 1
1 682 . 8 1 1 A 59 59 VAL CA C 59 59.820 60.903 -1.083 1
1 683 . 8 1 1 A 59 59 VAL CB C 59 34.786 34.815 -0.029 1
1 685 . 8 1 1 A 59 59 VAL N N 59 121.702 124.706 -3.004 1
1 686 . 8 1 1 A 60 60 GLY H H 60 9.258 8.531 0.727 1
1 687 . 8 1 1 A 60 60 GLY HA2 H 60 4.673 4.412 0.261 1
1 688 . 8 1 1 A 60 60 GLY HA3 H 60 4.804 4.617 0.187 1
1 689 . 8 1 1 A 60 60 GLY C C 60 169.831 172.848 -3.017 1
1 690 . 8 1 1 A 60 60 GLY CA C 60 46.399 45.518 0.881 1
1 691 . 8 1 1 A 60 60 GLY N N 60 114.126 113.376 0.750 1
1 692 . 8 1 1 A 61 61 THR H H 61 8.834 8.211 0.623 1
1 693 . 8 1 1 A 61 61 THR HA H 61 4.418 4.999 -0.581 1
1 698 . 8 1 1 A 61 61 THR C C 61 171.985 175.000 -3.015 1
1 699 . 8 1 1 A 61 61 THR CA C 61 60.634 60.555 0.079 1
1 700 . 8 1 1 A 61 61 THR CB C 61 70.983 70.411 0.572 1
1 702 . 8 1 1 A 61 61 THR N N 61 114.856 110.546 4.310 1
1 703 . 8 1 1 A 62 62 GLU H H 62 8.502 8.693 -0.191 1
1 704 . 8 1 1 A 62 62 GLU HA H 62 2.867 3.749 -0.882 1
1 709 . 8 1 1 A 62 62 GLU C C 62 174.650 176.018 -1.368 1
1 710 . 8 1 1 A 62 62 GLU CA C 62 58.785 58.567 0.218 1
1 711 . 8 1 1 A 62 62 GLU CB C 62 28.981 29.580 -0.599 1
1 713 . 8 1 1 A 62 62 GLU N N 62 129.915 123.912 6.003 1
1 714 . 8 1 1 A 63 63 ILE H H 63 6.928 7.957 -1.029 1
1 715 . 8 1 1 A 63 63 ILE HA H 63 4.038 4.322 -0.284 1
1 725 . 8 1 1 A 63 63 ILE C C 63 173.482 175.068 -1.586 1
1 726 . 8 1 1 A 63 63 ILE CA C 63 58.664 60.375 -1.711 1
1 727 . 8 1 1 A 63 63 ILE CB C 63 40.009 39.751 0.258 1
1 731 . 8 1 1 A 63 63 ILE N N 63 117.075 118.017 -0.942 1
1 732 . 8 1 1 A 64 64 GLU H H 64 8.585 8.430 0.155 1
1 733 . 8 1 1 A 64 64 GLU HA H 64 3.427 4.024 -0.597 1
1 738 . 8 1 1 A 64 64 GLU C C 64 175.186 176.911 -1.725 1
1 739 . 8 1 1 A 64 64 GLU CA C 64 58.703 57.252 1.451 1
1 740 . 8 1 1 A 64 64 GLU CB C 64 28.999 28.862 0.137 1
1 742 . 8 1 1 A 64 64 GLU N N 64 126.422 127.780 -1.358 1
1 743 . 8 1 1 A 65 65 GLY H H 65 8.754 8.671 0.083 1
1 744 . 8 1 1 A 65 65 GLY HA2 H 65 3.631 3.938 -0.307 1
1 745 . 8 1 1 A 65 65 GLY HA3 H 65 4.287 3.950 0.337 1
1 746 . 8 1 1 A 65 65 GLY C C 65 174.005 174.868 -0.863 1
1 747 . 8 1 1 A 65 65 GLY CA C 65 44.954 45.361 -0.407 1
1 748 . 8 1 1 A 65 65 GLY N N 65 114.614 112.484 2.130 1
1 749 . 8 1 1 A 66 66 GLU H H 66 7.760 7.527 0.233 1
1 750 . 8 1 1 A 66 66 GLU HA H 66 4.462 4.676 -0.214 1
1 754 . 8 1 1 A 66 66 GLU C C 66 175.255 175.880 -0.625 1
1 755 . 8 1 1 A 66 66 GLU CA C 66 55.582 55.403 0.179 1
1 756 . 8 1 1 A 66 66 GLU CB C 66 30.654 31.327 -0.673 1
1 758 . 8 1 1 A 66 66 GLU N N 66 119.292 120.230 -0.938 1
1 759 . 8 1 1 A 67 67 GLY H H 67 8.262 8.000 0.262 1
1 760 . 8 1 1 A 67 67 GLY HA2 H 67 3.875 4.071 -0.196 1
1 761 . 8 1 1 A 67 67 GLY HA3 H 67 4.088 4.081 0.007 1
1 762 . 8 1 1 A 67 67 GLY C C 67 172.197 174.279 -2.082 1
1 763 . 8 1 1 A 67 67 GLY CA C 67 44.845 46.133 -1.288 1
1 764 . 8 1 1 A 67 67 GLY N N 67 106.161 109.935 -3.774 1
1 765 . 8 1 1 A 68 68 LEU H H 68 8.142 7.998 0.144 1
1 766 . 8 1 1 A 68 68 LEU HA H 68 4.491 4.119 0.372 1
1 775 . 8 1 1 A 68 68 LEU C C 68 176.194 175.911 0.283 1
1 776 . 8 1 1 A 68 68 LEU CA C 68 55.123 55.941 -0.818 1
1 777 . 8 1 1 A 68 68 LEU CB C 68 44.527 41.727 2.800 1
1 780 . 8 1 1 A 68 68 LEU N N 68 120.269 121.550 -1.281 1
1 781 . 8 1 1 A 69 69 GLN H H 69 9.253 8.276 0.977 1
1 782 . 8 1 1 A 69 69 GLN HA H 69 4.770 4.948 -0.178 1
1 788 . 8 1 1 A 69 69 GLN C C 69 173.607 174.314 -0.707 1
1 789 . 8 1 1 A 69 69 GLN CA C 69 54.736 54.576 0.160 1
1 790 . 8 1 1 A 69 69 GLN CB C 69 33.782 31.192 2.590 1
1 792 . 8 1 1 A 69 69 GLN N N 69 119.336 123.741 -4.405 1
1 794 . 8 1 1 A 70 70 THR H H 70 8.803 9.050 -0.247 1
1 795 . 8 1 1 A 70 70 THR HA H 70 5.033 5.131 -0.098 1
1 800 . 8 1 1 A 70 70 THR C C 70 172.596 173.685 -1.089 1
1 801 . 8 1 1 A 70 70 THR CA C 70 62.768 61.753 1.015 1
1 802 . 8 1 1 A 70 70 THR CB C 70 69.990 71.233 -1.243 1
1 804 . 8 1 1 A 70 70 THR N N 70 118.372 119.748 -1.376 1
1 805 . 8 1 1 A 71 71 VAL H H 71 9.882 9.455 0.427 1
1 806 . 8 1 1 A 71 71 VAL HA H 71 5.239 5.370 -0.131 1
1 811 . 8 1 1 A 71 71 VAL C C 71 174.015 174.870 -0.855 1
1 812 . 8 1 1 A 71 71 VAL CA C 71 60.577 60.538 0.039 1
1 813 . 8 1 1 A 71 71 VAL CB C 71 34.149 34.183 -0.034 1
1 815 . 8 1 1 A 71 71 VAL N N 71 129.063 122.226 6.837 1
1 816 . 8 1 1 A 72 72 VAL H H 72 9.491 8.803 0.688 1
1 817 . 8 1 1 A 72 72 VAL HA H 72 4.672 4.511 0.161 1
1 825 . 8 1 1 A 72 72 VAL CA C 72 59.568 58.890 0.678 1
1 826 . 8 1 1 A 72 72 VAL CB C 72 34.057 34.777 -0.720 1
1 829 . 8 1 1 A 72 72 VAL N N 72 128.521 126.135 2.386 1
1 830 . 8 1 1 A 73 73 PRO HA H 73 5.368 4.534 0.834 1
1 836 . 8 1 1 A 73 73 PRO C C 73 175.079 175.881 -0.802 1
1 837 . 8 1 1 A 73 73 PRO CA C 73 61.324 63.027 -1.703 1
1 838 . 8 1 1 A 73 73 PRO CB C 73 33.089 31.906 1.183 1
1 841 . 8 1 1 A 74 74 THR H H 74 9.103 8.845 0.258 1
1 842 . 8 1 1 A 74 74 THR HA H 74 5.191 4.818 0.373 1
1 847 . 8 1 1 A 74 74 THR CA C 74 57.986 59.037 -1.051 1
1 848 . 8 1 1 A 74 74 THR CB C 74 72.212 72.176 0.036 1
1 850 . 8 1 1 A 74 74 THR N N 74 118.075 118.806 -0.731 1
1 851 . 8 1 1 A 75 75 PRO HA H 75 5.015 4.670 0.345 1
1 858 . 8 1 1 A 75 75 PRO C C 75 178.704 177.570 1.134 1
1 859 . 8 1 1 A 75 75 PRO CA C 75 63.038 62.477 0.561 1
1 860 . 8 1 1 A 75 75 PRO CB C 75 32.529 32.714 -0.185 1
1 863 . 8 1 1 A 76 76 ILE H H 76 8.221 8.040 0.181 1
1 864 . 8 1 1 A 76 76 ILE HA H 76 4.218 3.788 0.430 1
1 873 . 8 1 1 A 76 76 ILE C C 76 172.375 176.553 -4.178 1
1 874 . 8 1 1 A 76 76 ILE CA C 76 63.509 64.135 -0.626 1
1 875 . 8 1 1 A 76 76 ILE CB C 76 39.322 37.981 1.341 1
1 879 . 8 1 1 A 76 76 ILE N N 76 122.273 122.385 -0.112 1
1 880 . 8 1 1 A 77 77 THR H H 77 6.984 7.813 -0.829 1
1 881 . 8 1 1 A 77 77 THR HA H 77 4.227 4.450 -0.223 1
1 886 . 8 1 1 A 77 77 THR C C 77 173.531 174.124 -0.593 1
1 887 . 8 1 1 A 77 77 THR CA C 77 61.435 61.860 -0.425 1
1 888 . 8 1 1 A 77 77 THR CB C 77 68.944 69.461 -0.517 1
1 890 . 8 1 1 A 77 77 THR N N 77 105.803 114.219 -8.416 1
1 891 . 8 1 1 A 78 78 ALA H H 78 7.647 7.453 0.194 1
1 892 . 8 1 1 A 78 78 ALA HA H 78 4.757 4.658 0.099 1
1 896 . 8 1 1 A 78 78 ALA C C 78 173.520 177.111 -3.591 1
1 897 . 8 1 1 A 78 78 ALA CA C 78 51.164 50.808 0.356 1
1 898 . 8 1 1 A 78 78 ALA CB C 78 20.011 22.027 -2.016 1
1 899 . 8 1 1 A 78 78 ALA N N 78 126.635 123.467 3.168 1
1 900 . 8 1 1 A 79 79 SER H H 79 7.884 8.483 -0.599 1
1 901 . 8 1 1 A 79 79 SER HA H 79 4.386 4.950 -0.564 1
1 903 . 8 1 1 A 79 79 SER C C 79 176.077 173.616 2.461 1
1 904 . 8 1 1 A 79 79 SER CA C 79 57.465 56.930 0.535 1
1 905 . 8 1 1 A 79 79 SER CB C 79 65.285 65.131 0.154 1
1 906 . 8 1 1 A 79 79 SER N N 79 115.272 113.716 1.556 1
1 907 . 8 1 1 A 80 80 LEU H H 80 7.700 8.718 -1.018 1
1 908 . 8 1 1 A 80 80 LEU HA H 80 4.912 5.071 -0.159 1
1 915 . 8 1 1 A 80 80 LEU C C 80 173.927 174.701 -0.774 1
1 916 . 8 1 1 A 80 80 LEU CA C 80 53.829 54.027 -0.198 1
1 917 . 8 1 1 A 80 80 LEU CB C 80 45.990 46.215 -0.225 1
1 920 . 8 1 1 A 80 80 LEU N N 80 121.507 123.673 -2.166 1
1 921 . 8 1 1 A 81 81 SER H H 81 7.885 8.643 -0.758 1
1 922 . 8 1 1 A 81 81 SER HA H 81 5.269 4.764 0.505 1
1 925 . 8 1 1 A 81 81 SER C C 81 175.756 174.915 0.841 1
1 926 . 8 1 1 A 81 81 SER CA C 81 55.507 57.120 -1.613 1
1 927 . 8 1 1 A 81 81 SER CB C 81 65.966 65.852 0.114 1
1 928 . 8 1 1 A 81 81 SER N N 81 118.323 118.806 -0.483 1
1 929 . 8 1 1 A 82 82 HIS H H 82 8.935 8.807 0.128 1
1 930 . 8 1 1 A 82 82 HIS HA H 82 4.407 4.376 0.031 1
1 932 . 8 1 1 A 82 82 HIS C C 82 176.550 177.249 -0.699 1
1 933 . 8 1 1 A 82 82 HIS CA C 82 60.960 58.814 2.146 1
1 934 . 8 1 1 A 82 82 HIS CB C 82 30.755 29.021 1.734 1
1 935 . 8 1 1 A 82 82 HIS N N 82 124.042 118.287 5.755 1
1 936 . 8 1 1 A 83 83 ASN H H 83 8.435 8.203 0.232 1
1 937 . 8 1 1 A 83 83 ASN HA H 83 4.439 4.265 0.174 1
1 941 . 8 1 1 A 83 83 ASN C C 83 174.769 177.511 -2.742 1
1 942 . 8 1 1 A 83 83 ASN CA C 83 56.575 56.483 0.092 1
1 943 . 8 1 1 A 83 83 ASN CB C 83 38.731 38.703 0.028 1
1 944 . 8 1 1 A 83 83 ASN N N 83 118.543 120.210 -1.667 1
1 946 . 8 1 1 A 84 84 ARG H H 84 7.716 8.292 -0.576 1
1 947 . 8 1 1 A 84 84 ARG HA H 84 4.183 4.108 0.075 1
1 953 . 8 1 1 A 84 84 ARG C C 84 177.399 178.322 -0.923 1
1 954 . 8 1 1 A 84 84 ARG CA C 84 59.045 59.139 -0.094 1
1 955 . 8 1 1 A 84 84 ARG CB C 84 29.992 29.802 0.190 1
1 957 . 8 1 1 A 84 84 ARG N N 84 121.312 119.239 2.073 1
1 958 . 8 1 1 A 85 85 ILE H H 85 8.354 8.061 0.293 1
1 959 . 8 1 1 A 85 85 ILE HA H 85 3.650 4.297 -0.647 1
1 967 . 8 1 1 A 85 85 ILE C C 85 176.098 178.044 -1.946 1
1 968 . 8 1 1 A 85 85 ILE CA C 85 66.704 63.804 2.900 1
1 969 . 8 1 1 A 85 85 ILE CB C 85 38.017 37.499 0.518 1
1 972 . 8 1 1 A 85 85 ILE N N 85 119.321 120.113 -0.792 1
1 973 . 8 1 1 A 86 86 ARG H H 86 7.690 8.534 -0.844 1
1 974 . 8 1 1 A 86 86 ARG HA H 86 3.704 3.934 -0.230 1
1 981 . 8 1 1 A 86 86 ARG C C 86 177.524 179.160 -1.636 1
1 982 . 8 1 1 A 86 86 ARG CA C 86 59.881 60.127 -0.246 1
1 983 . 8 1 1 A 86 86 ARG CB C 86 29.248 29.962 -0.714 1
1 986 . 8 1 1 A 86 86 ARG N N 86 118.362 121.812 -3.450 1
1 987 . 8 1 1 A 87 87 GLU H H 87 7.884 7.655 0.229 1
1 988 . 8 1 1 A 87 87 GLU HA H 87 4.064 4.131 -0.067 1
1 993 . 8 1 1 A 87 87 GLU C C 87 178.785 179.488 -0.703 1
1 994 . 8 1 1 A 87 87 GLU CA C 87 58.999 58.848 0.151 1
1 995 . 8 1 1 A 87 87 GLU CB C 87 29.872 30.067 -0.195 1
1 997 . 8 1 1 A 87 87 GLU N N 87 118.124 119.662 -1.538 1
1 998 . 8 1 1 A 88 88 ILE H H 88 8.715 7.910 0.805 1
1 999 . 8 1 1 A 88 88 ILE HA H 88 3.305 3.558 -0.253 1
1 1009 . 8 1 1 A 88 88 ILE C C 88 177.261 178.269 -1.008 1
1 1010 . 8 1 1 A 88 88 ILE CA C 88 65.822 65.680 0.142 1
1 1011 . 8 1 1 A 88 88 ILE CB C 88 37.370 37.538 -0.168 1
1 1015 . 8 1 1 A 88 88 ILE N N 88 122.929 121.254 1.675 1
1 1016 . 8 1 1 A 89 89 LEU H H 89 8.486 8.836 -0.350 1
1 1017 . 8 1 1 A 89 89 LEU HA H 89 3.932 3.929 0.003 1
1 1023 . 8 1 1 A 89 89 LEU C C 89 177.919 178.958 -1.039 1
1 1024 . 8 1 1 A 89 89 LEU CA C 89 59.060 58.314 0.746 1
1 1025 . 8 1 1 A 89 89 LEU CB C 89 41.129 41.852 -0.723 1
1 1028 . 8 1 1 A 89 89 LEU N N 89 122.696 120.616 2.080 1
1 1029 . 8 1 1 A 90 90 LYS H H 90 7.790 8.165 -0.375 1
1 1030 . 8 1 1 A 90 90 LYS HA H 90 4.061 3.948 0.113 1
1 1035 . 8 1 1 A 90 90 LYS C C 90 178.432 178.754 -0.322 1
1 1036 . 8 1 1 A 90 90 LYS CA C 90 59.840 59.643 0.197 1
1 1037 . 8 1 1 A 90 90 LYS CB C 90 32.582 32.371 0.211 1
1 1039 . 8 1 1 A 90 90 LYS N N 90 118.640 118.561 0.079 1
1 1040 . 8 1 1 A 91 91 ALA H H 91 8.113 8.321 -0.208 1
1 1041 . 8 1 1 A 91 91 ALA HA H 91 4.151 4.109 0.042 1
1 1045 . 8 1 1 A 91 91 ALA C C 91 179.147 179.874 -0.727 1
1 1046 . 8 1 1 A 91 91 ALA CA C 91 54.942 55.281 -0.339 1
1 1047 . 8 1 1 A 91 91 ALA CB C 91 18.242 18.624 -0.382 1
1 1048 . 8 1 1 A 91 91 ALA N N 91 122.939 121.709 1.230 1
1 1049 . 8 1 1 A 92 92 SER H H 92 8.858 8.649 0.209 1
1 1050 . 8 1 1 A 92 92 SER HA H 92 4.898 4.165 0.733 1
1 1052 . 8 1 1 A 92 92 SER C C 92 172.440 176.768 -4.328 1
1 1053 . 8 1 1 A 92 92 SER CA C 92 61.913 61.515 0.398 1
1 1054 . 8 1 1 A 92 92 SER CB C 92 63.081 62.505 0.576 1
1 1055 . 8 1 1 A 92 92 SER N N 92 114.526 113.036 1.490 1
1 1056 . 8 1 1 A 93 93 ARG H H 93 7.704 8.529 -0.825 1
1 1057 . 8 1 1 A 93 93 ARG HA H 93 4.162 4.113 0.049 1
1 1059 . 8 1 1 A 93 93 ARG C C 93 177.757 178.246 -0.489 1
1 1060 . 8 1 1 A 93 93 ARG CA C 93 59.544 58.563 0.981 1
1 1061 . 8 1 1 A 93 93 ARG CB C 93 30.343 29.774 0.569 1
1 1062 . 8 1 1 A 93 93 ARG N N 93 121.505 122.266 -0.761 1
1 1063 . 8 1 1 A 94 94 LYS H H 94 7.456 7.695 -0.239 1
1 1064 . 8 1 1 A 94 94 LYS HA H 94 4.174 4.152 0.022 1
1 1071 . 8 1 1 A 94 94 LYS C C 94 178.861 178.542 0.319 1
1 1072 . 8 1 1 A 94 94 LYS CA C 94 59.030 58.920 0.110 1
1 1073 . 8 1 1 A 94 94 LYS CB C 94 32.239 31.790 0.449 1
1 1077 . 8 1 1 A 94 94 LYS N N 94 119.072 119.508 -0.436 1
1 1078 . 8 1 1 A 95 95 LEU H H 95 8.148 7.911 0.237 1
1 1079 . 8 1 1 A 95 95 LEU HA H 95 4.129 4.125 0.004 1
1 1088 . 8 1 1 A 95 95 LEU C C 95 177.274 178.178 -0.904 1
1 1089 . 8 1 1 A 95 95 LEU CA C 95 57.136 57.352 -0.216 1
1 1090 . 8 1 1 A 95 95 LEU CB C 95 41.908 41.835 0.073 1
1 1093 . 8 1 1 A 95 95 LEU N N 95 119.717 120.786 -1.069 1
1 1094 . 8 1 1 A 96 96 GLN H H 96 7.807 7.782 0.025 1
1 1095 . 8 1 1 A 96 96 GLN HA H 96 4.242 4.384 -0.142 1
1 1102 . 8 1 1 A 96 96 GLN C C 96 175.371 176.262 -0.891 1
1 1103 . 8 1 1 A 96 96 GLN CA C 96 56.397 55.484 0.913 1
1 1104 . 8 1 1 A 96 96 GLN CB C 96 29.123 29.109 0.014 1
1 1106 . 8 1 1 A 96 96 GLN N N 96 114.581 115.430 -0.849 1
1 1108 . 8 1 1 A 97 97 GLY H H 97 7.802 7.903 -0.101 1
1 1109 . 8 1 1 A 97 97 GLY HA2 H 97 3.839 3.911 -0.072 1
1 1110 . 8 1 1 A 97 97 GLY HA3 H 97 4.096 3.912 0.184 1
1 1111 . 8 1 1 A 97 97 GLY C C 97 172.636 174.342 -1.706 1
1 1112 . 8 1 1 A 97 97 GLY CA C 97 46.372 46.866 -0.494 1
1 1113 . 8 1 1 A 97 97 GLY N N 97 106.959 109.415 -2.456 1
1 1114 . 8 1 1 A 98 98 ASP H H 98 8.156 8.094 0.062 1
1 1115 . 8 1 1 A 98 98 ASP HA H 98 4.754 5.036 -0.282 1
1 1118 . 8 1 1 A 98 98 ASP CA C 98 52.882 50.976 1.906 1
1 1119 . 8 1 1 A 98 98 ASP CB C 98 41.603 41.157 0.446 1
1 1120 . 8 1 1 A 98 98 ASP N N 98 118.447 119.741 -1.294 1
1 1121 . 8 1 1 A 99 99 PRO HA H 99 4.470 4.453 0.017 1
1 1126 . 8 1 1 A 99 99 PRO C C 99 175.500 177.085 -1.585 1
1 1127 . 8 1 1 A 99 99 PRO CA C 99 63.601 65.181 -1.580 1
1 1128 . 8 1 1 A 99 99 PRO CB C 99 32.423 31.846 0.577 1
1 1130 . 8 1 1 A 100 100 ASP H H 100 8.527 7.700 0.827 1
1 1131 . 8 1 1 A 100 100 ASP HA H 100 4.778 4.816 -0.038 1
1 1134 . 8 1 1 A 100 100 ASP C C 100 174.931 174.411 0.520 1
1 1135 . 8 1 1 A 100 100 ASP CA C 100 53.915 53.661 0.254 1
1 1136 . 8 1 1 A 100 100 ASP CB C 100 40.665 41.074 -0.409 1
1 1137 . 8 1 1 A 100 100 ASP N N 100 119.340 115.183 4.157 1
1 1138 . 8 1 1 A 101 101 LEU H H 101 7.379 8.651 -1.272 1
1 1139 . 8 1 1 A 101 101 LEU HA H 101 4.682 4.737 -0.055 1
1 1148 . 8 1 1 A 101 101 LEU CA C 101 52.956 51.683 1.273 1
1 1149 . 8 1 1 A 101 101 LEU CB C 101 43.393 41.913 1.480 1
1 1152 . 8 1 1 A 101 101 LEU N N 101 122.107 125.269 -3.162 1
1 1153 . 8 1 1 A 102 102 PRO HA H 102 4.487 4.466 0.021 1
1 1158 . 8 1 1 A 102 102 PRO C C 102 175.697 175.683 0.014 1
1 1159 . 8 1 1 A 102 102 PRO CA C 102 63.113 63.286 -0.173 1
1 1160 . 8 1 1 A 102 102 PRO CB C 102 32.138 31.983 0.155 1
1 1163 . 8 1 1 A 103 103 MET H H 103 9.011 8.647 0.364 1
1 1164 . 8 1 1 A 103 103 MET HA H 103 4.769 5.060 -0.291 1
1 1171 . 8 1 1 A 103 103 MET C C 103 174.080 174.162 -0.082 1
1 1172 . 8 1 1 A 103 103 MET CA C 103 54.737 54.030 0.707 1
1 1173 . 8 1 1 A 103 103 MET CB C 103 34.857 35.713 -0.856 1
1 1176 . 8 1 1 A 103 103 MET N N 103 123.334 122.989 0.345 1
1 1177 . 8 1 1 A 104 104 SER H H 104 8.239 9.108 -0.869 1
1 1178 . 8 1 1 A 104 104 SER HA H 104 5.079 5.409 -0.330 1
1 1181 . 8 1 1 A 104 104 SER C C 104 171.795 172.740 -0.945 1
1 1182 . 8 1 1 A 104 104 SER CA C 104 57.641 56.116 1.525 1
1 1183 . 8 1 1 A 104 104 SER CB C 104 66.282 66.307 -0.025 1
1 1184 . 8 1 1 A 104 104 SER N N 104 114.434 118.669 -4.235 1
1 1185 . 8 1 1 A 105 105 PHE H H 105 9.003 8.751 0.252 1
1 1186 . 8 1 1 A 105 105 PHE HA H 105 5.209 5.423 -0.214 1
1 1193 . 8 1 1 A 105 105 PHE C C 105 170.688 172.248 -1.560 1
1 1194 . 8 1 1 A 105 105 PHE CA C 105 56.917 55.866 1.051 1
1 1195 . 8 1 1 A 105 105 PHE CB C 105 41.350 41.945 -0.595 1
1 1196 . 8 1 1 A 105 105 PHE N N 105 116.224 119.545 -3.321 1
1 1197 . 8 1 1 A 106 106 THR H H 106 9.074 8.684 0.390 1
1 1198 . 8 1 1 A 106 106 THR HA H 106 4.664 4.952 -0.288 1
1 1203 . 8 1 1 A 106 106 THR C C 106 171.767 174.665 -2.898 1
1 1204 . 8 1 1 A 106 106 THR CA C 106 62.162 61.968 0.194 1
1 1205 . 8 1 1 A 106 106 THR CB C 106 70.072 69.852 0.220 1
1 1207 . 8 1 1 A 106 106 THR N N 106 117.469 116.413 1.056 1
1 1208 . 8 1 1 A 107 107 LEU H H 107 9.804 9.319 0.485 1
1 1209 . 8 1 1 A 107 107 LEU HA H 107 4.750 4.740 0.010 1
1 1219 . 8 1 1 A 107 107 LEU C C 107 172.742 176.579 -3.837 1
1 1220 . 8 1 1 A 107 107 LEU CA C 107 54.151 54.581 -0.430 1
1 1221 . 8 1 1 A 107 107 LEU CB C 107 44.486 42.651 1.835 1
1 1224 . 8 1 1 A 107 107 LEU N N 107 133.400 128.222 5.178 1
1 1225 . 8 1 1 A 108 108 ALA H H 108 8.435 8.876 -0.441 1
1 1226 . 8 1 1 A 108 108 ALA HA H 108 4.683 4.561 0.122 1
1 1230 . 8 1 1 A 108 108 ALA C C 108 173.052 175.354 -2.302 1
1 1231 . 8 1 1 A 108 108 ALA CA C 108 49.308 50.202 -0.894 1
1 1232 . 8 1 1 A 108 108 ALA CB C 108 22.120 19.998 2.122 1
1 1233 . 8 1 1 A 108 108 ALA N N 108 131.422 125.964 5.458 1
1 1234 . 8 1 1 A 109 109 ILE H H 109 8.909 9.327 -0.418 1
1 1235 . 8 1 1 A 109 109 ILE HA H 109 4.063 4.927 -0.864 1
1 1245 . 8 1 1 A 109 109 ILE CA C 109 60.982 60.527 0.455 1
1 1246 . 8 1 1 A 109 109 ILE CB C 109 39.074 37.785 1.289 1
1 1250 . 8 1 1 A 109 109 ILE N N 109 124.415 123.824 0.591 1
1 1251 . 8 1 1 A 110 110 VAL H H 110 8.706 9.394 -0.688 1
1 1252 . 8 1 1 A 110 110 VAL HA H 110 4.324 4.460 -0.136 1
1 1260 . 8 1 1 A 110 110 VAL C C 110 175.700 175.326 0.374 1
1 1261 . 8 1 1 A 110 110 VAL CA C 110 62.316 61.175 1.141 1
1 1262 . 8 1 1 A 110 110 VAL CB C 110 31.876 32.825 -0.949 1
1 1264 . 8 1 1 A 110 110 VAL N N 110 127.457 128.590 -1.133 1
1 1265 . 8 1 1 A 111 111 GLU H H 111 9.024 8.717 0.307 1
1 1266 . 8 1 1 A 111 111 GLU HA H 111 4.403 4.401 0.002 1
1 1269 . 8 1 1 A 111 111 GLU C C 111 175.987 177.837 -1.850 1
1 1270 . 8 1 1 A 111 111 GLU CA C 111 56.842 56.932 -0.090 1
1 1271 . 8 1 1 A 111 111 GLU CB C 111 31.044 31.557 -0.513 1
1 1272 . 8 1 1 A 111 111 GLU N N 111 129.768 128.673 1.095 1
1 1273 . 8 1 1 A 112 112 SER H H 112 9.143 9.055 0.088 1
1 1274 . 8 1 1 A 112 112 SER HA H 112 4.394 4.282 0.112 1
1 1276 . 8 1 1 A 112 112 SER C C 112 173.187 176.054 -2.867 1
1 1277 . 8 1 1 A 112 112 SER CA C 112 60.180 61.517 -1.337 1
1 1278 . 8 1 1 A 112 112 SER CB C 112 63.415 63.072 0.343 1
1 1279 . 8 1 1 A 112 112 SER N N 112 115.956 122.159 -6.203 1
1 1280 . 8 1 1 A 113 113 ASP H H 113 8.133 7.854 0.279 1
1 1281 . 8 1 1 A 113 113 ASP HA H 113 4.573 4.477 0.096 1
1 1284 . 8 1 1 A 113 113 ASP C C 113 175.430 176.990 -1.560 1
1 1285 . 8 1 1 A 113 113 ASP CA C 113 54.115 56.939 -2.824 1
1 1286 . 8 1 1 A 113 113 ASP CB C 113 40.011 41.600 -1.589 1
1 1287 . 8 1 1 A 113 113 ASP N N 113 118.343 122.468 -4.125 1
1 1288 . 8 1 1 A 114 114 SER H H 114 8.034 7.650 0.384 1
1 1289 . 8 1 1 A 114 114 SER HA H 114 4.057 4.679 -0.622 1
1 1291 . 8 1 1 A 114 114 SER C C 114 172.209 173.444 -1.235 1
1 1292 . 8 1 1 A 114 114 SER CA C 114 60.179 58.246 1.933 1
1 1293 . 8 1 1 A 114 114 SER CB C 114 62.702 65.183 -2.481 1
1 1294 . 8 1 1 A 114 114 SER N N 114 109.836 111.840 -2.004 1
1 1295 . 8 1 1 A 115 115 THR H H 115 7.711 7.603 0.108 1
1 1296 . 8 1 1 A 115 115 THR HA H 115 4.250 4.461 -0.211 1
1 1300 . 8 1 1 A 115 115 THR C C 115 171.500 173.940 -2.440 1
1 1301 . 8 1 1 A 115 115 THR CA C 115 63.547 62.112 1.435 1
1 1302 . 8 1 1 A 115 115 THR CB C 115 69.595 69.714 -0.119 1
1 1303 . 8 1 1 A 115 115 THR N N 115 117.407 116.777 0.630 1
1 1304 . 8 1 1 A 116 116 ILE H H 116 8.219 9.223 -1.004 1
1 1305 . 8 1 1 A 116 116 ILE HA H 116 4.769 4.762 0.007 1
1 1315 . 8 1 1 A 116 116 ILE C C 116 174.434 175.019 -0.585 1
1 1316 . 8 1 1 A 116 116 ILE CA C 116 60.306 59.720 0.586 1
1 1317 . 8 1 1 A 116 116 ILE CB C 116 40.686 38.228 2.458 1
1 1321 . 8 1 1 A 116 116 ILE N N 116 125.480 129.133 -3.653 1
1 1322 . 8 1 1 A 117 117 VAL H H 117 8.695 9.371 -0.676 1
1 1323 . 8 1 1 A 117 117 VAL HA H 117 4.315 4.560 -0.245 1
1 1328 . 8 1 1 A 117 117 VAL C C 117 172.243 174.592 -2.349 1
1 1329 . 8 1 1 A 117 117 VAL CA C 117 60.621 61.248 -0.627 1
1 1330 . 8 1 1 A 117 117 VAL CB C 117 34.558 33.382 1.176 1
1 1332 . 8 1 1 A 117 117 VAL N N 117 127.887 127.462 0.425 1
1 1333 . 8 1 1 A 118 118 TYR H H 118 8.270 8.930 -0.660 1
1 1334 . 8 1 1 A 118 118 TYR HA H 118 5.327 5.397 -0.070 1
1 1342 . 8 1 1 A 118 118 TYR C C 118 174.250 175.062 -0.812 1
1 1343 . 8 1 1 A 118 118 TYR CA C 118 57.283 58.430 -1.147 1
1 1344 . 8 1 1 A 118 118 TYR CB C 118 39.262 39.922 -0.660 1
1 1345 . 8 1 1 A 118 118 TYR N N 118 124.822 127.010 -2.188 1
1 1346 . 8 1 1 A 119 119 TYR H H 119 9.207 9.289 -0.082 1
1 1347 . 8 1 1 A 119 119 TYR HA H 119 4.821 5.187 -0.366 1
1 1354 . 8 1 1 A 119 119 TYR C C 119 171.994 173.454 -1.460 1
1 1355 . 8 1 1 A 119 119 TYR CA C 119 58.116 57.538 0.578 1
1 1356 . 8 1 1 A 119 119 TYR CB C 119 43.544 42.122 1.422 1
1 1357 . 8 1 1 A 119 119 TYR N N 119 125.153 123.556 1.597 1
1 1358 . 8 1 1 A 120 120 LYS H H 120 7.700 8.535 -0.835 1
1 1359 . 8 1 1 A 120 120 LYS HA H 120 4.558 4.594 -0.036 1
1 1366 . 8 1 1 A 120 120 LYS C C 120 172.017 174.858 -2.841 1
1 1367 . 8 1 1 A 120 120 LYS CA C 120 57.217 56.253 0.964 1
1 1368 . 8 1 1 A 120 120 LYS CB C 120 33.914 33.332 0.582 1
1 1372 . 8 1 1 A 120 120 LYS N N 120 129.442 128.747 0.695 1
1 1373 . 8 1 1 A 121 121 LEU H H 121 8.112 8.576 -0.464 1
1 1374 . 8 1 1 A 121 121 LEU HA H 121 5.323 5.010 0.313 1
1 1384 . 8 1 1 A 121 121 LEU C C 121 175.733 174.716 1.017 1
1 1385 . 8 1 1 A 121 121 LEU CA C 121 52.716 53.258 -0.542 1
1 1386 . 8 1 1 A 121 121 LEU CB C 121 44.098 44.927 -0.829 1
1 1389 . 8 1 1 A 121 121 LEU N N 121 123.403 129.016 -5.613 1
1 1390 . 8 1 1 A 122 122 THR H H 122 8.338 9.090 -0.752 1
1 1391 . 8 1 1 A 122 122 THR HA H 122 5.097 4.683 0.414 1
1 1396 . 8 1 1 A 122 122 THR C C 122 173.221 173.581 -0.360 1
1 1397 . 8 1 1 A 122 122 THR CA C 122 60.306 61.459 -1.153 1
1 1398 . 8 1 1 A 122 122 THR CB C 122 72.473 71.471 1.002 1
1 1400 . 8 1 1 A 122 122 THR N N 122 109.081 122.504 -13.423 1
1 7 . 9 1 1 A 2 2 GLU H H 2 8.994 8.549 0.445 1
1 8 . 9 1 1 A 2 2 GLU HA H 2 4.278 4.830 -0.552 1
1 13 . 9 1 1 A 2 2 GLU C C 2 175.315 176.583 -1.268 1
1 14 . 9 1 1 A 2 2 GLU CA C 2 57.318 55.697 1.621 1
1 15 . 9 1 1 A 2 2 GLU CB C 2 29.221 30.433 -1.212 1
1 17 . 9 1 1 A 2 2 GLU N N 2 122.259 119.810 2.449 1
1 18 . 9 1 1 A 3 3 ASP H H 3 8.048 8.247 -0.199 1
1 19 . 9 1 1 A 3 3 ASP HA H 3 4.580 4.831 -0.251 1
1 21 . 9 1 1 A 3 3 ASP C C 3 175.636 175.913 -0.277 1
1 22 . 9 1 1 A 3 3 ASP CA C 3 54.579 53.470 1.109 1
1 23 . 9 1 1 A 3 3 ASP CB C 3 40.984 42.642 -1.658 1
1 24 . 9 1 1 A 3 3 ASP N N 3 119.830 117.830 2.000 1
1 25 . 9 1 1 A 4 4 ALA H H 4 8.090 7.776 0.314 1
1 26 . 9 1 1 A 4 4 ALA HA H 4 4.216 4.387 -0.171 1
1 30 . 9 1 1 A 4 4 ALA C C 4 177.157 177.454 -0.297 1
1 31 . 9 1 1 A 4 4 ALA CA C 4 53.620 51.531 2.089 1
1 32 . 9 1 1 A 4 4 ALA CB C 4 18.728 17.649 1.079 1
1 33 . 9 1 1 A 4 4 ALA N N 4 123.957 122.993 0.964 1
1 34 . 9 1 1 A 5 5 TRP H H 5 7.941 7.868 0.073 1
1 35 . 9 1 1 A 5 5 TRP HA H 5 4.559 4.837 -0.278 1
1 39 . 9 1 1 A 5 5 TRP C C 5 176.072 176.637 -0.565 1
1 40 . 9 1 1 A 5 5 TRP CA C 5 57.744 56.852 0.892 1
1 41 . 9 1 1 A 5 5 TRP CB C 5 28.906 31.724 -2.818 1
1 42 . 9 1 1 A 5 5 TRP N N 5 118.408 120.882 -2.474 1
1 44 . 9 1 1 A 6 6 MET H H 6 7.679 7.197 0.482 1
1 45 . 9 1 1 A 6 6 MET HA H 6 3.785 4.296 -0.511 1
1 52 . 9 1 1 A 6 6 MET C C 6 175.174 177.252 -2.078 1
1 53 . 9 1 1 A 6 6 MET CA C 6 57.724 54.301 3.423 1
1 54 . 9 1 1 A 6 6 MET CB C 6 31.640 32.798 -1.158 1
1 57 . 9 1 1 A 6 6 MET N N 6 121.538 116.132 5.406 1
1 58 . 9 1 1 A 7 7 GLY H H 7 7.247 7.917 -0.670 1
1 59 . 9 1 1 A 7 7 GLY HA2 H 7 3.455 3.765 -0.310 1
1 60 . 9 1 1 A 7 7 GLY HA3 H 7 3.578 3.901 -0.323 1
1 61 . 9 1 1 A 7 7 GLY C C 7 172.852 175.058 -2.206 1
1 62 . 9 1 1 A 7 7 GLY CA C 7 45.896 46.383 -0.487 1
1 63 . 9 1 1 A 7 7 GLY N N 7 104.055 109.474 -5.419 1
1 64 . 9 1 1 A 8 8 THR H H 8 7.436 7.508 -0.072 1
1 65 . 9 1 1 A 8 8 THR HA H 8 4.428 4.682 -0.254 1
1 70 . 9 1 1 A 8 8 THR C C 8 172.973 174.061 -1.088 1
1 71 . 9 1 1 A 8 8 THR CA C 8 60.751 61.650 -0.899 1
1 72 . 9 1 1 A 8 8 THR CB C 8 69.637 69.785 -0.148 1
1 74 . 9 1 1 A 8 8 THR N N 8 107.669 112.141 -4.472 1
1 75 . 9 1 1 A 9 9 HIS H H 9 8.048 7.596 0.452 1
1 76 . 9 1 1 A 9 9 HIS HA H 9 4.654 5.241 -0.587 1
1 79 . 9 1 1 A 9 9 HIS CA C 9 56.163 55.062 1.101 1
1 80 . 9 1 1 A 9 9 HIS CB C 9 32.619 31.042 1.577 1
1 81 . 9 1 1 A 9 9 HIS N N 9 127.281 124.770 2.511 1
1 82 . 9 1 1 A 10 10 PRO HA H 10 4.257 4.265 -0.008 1
1 88 . 9 1 1 A 10 10 PRO C C 10 178.779 179.292 -0.513 1
1 89 . 9 1 1 A 10 10 PRO CA C 10 65.565 66.157 -0.592 1
1 90 . 9 1 1 A 10 10 PRO CB C 10 32.422 31.921 0.501 1
1 93 . 9 1 1 A 11 11 LYS H H 11 10.994 8.578 2.416 1
1 94 . 9 1 1 A 11 11 LYS HA H 11 4.282 4.186 0.096 1
1 100 . 9 1 1 A 11 11 LYS C C 11 177.279 178.879 -1.600 1
1 101 . 9 1 1 A 11 11 LYS CA C 11 56.859 59.557 -2.698 1
1 102 . 9 1 1 A 11 11 LYS CB C 11 31.279 32.371 -1.092 1
1 104 . 9 1 1 A 11 11 LYS N N 11 121.398 118.254 3.144 1
1 105 . 9 1 1 A 12 12 TYR H H 12 7.146 7.920 -0.774 1
1 106 . 9 1 1 A 12 12 TYR HA H 12 3.722 4.180 -0.458 1
1 113 . 9 1 1 A 12 12 TYR C C 12 176.265 177.416 -1.151 1
1 114 . 9 1 1 A 12 12 TYR CA C 12 61.189 61.286 -0.097 1
1 115 . 9 1 1 A 12 12 TYR CB C 12 37.796 38.394 -0.598 1
1 116 . 9 1 1 A 12 12 TYR N N 12 121.579 121.164 0.415 1
1 117 . 9 1 1 A 13 13 LEU H H 13 7.778 8.713 -0.935 1
1 118 . 9 1 1 A 13 13 LEU HA H 13 3.773 3.881 -0.108 1
1 127 . 9 1 1 A 13 13 LEU C C 13 178.462 178.656 -0.194 1
1 128 . 9 1 1 A 13 13 LEU CA C 13 57.942 58.075 -0.133 1
1 129 . 9 1 1 A 13 13 LEU CB C 13 41.064 41.434 -0.370 1
1 132 . 9 1 1 A 13 13 LEU N N 13 117.518 120.842 -3.324 1
1 133 . 9 1 1 A 14 14 GLU H H 14 7.867 8.479 -0.612 1
1 134 . 9 1 1 A 14 14 GLU HA H 14 3.935 3.876 0.059 1
1 139 . 9 1 1 A 14 14 GLU C C 14 178.326 178.979 -0.653 1
1 140 . 9 1 1 A 14 14 GLU CA C 14 59.368 59.773 -0.405 1
1 141 . 9 1 1 A 14 14 GLU CB C 14 30.147 29.021 1.126 1
1 143 . 9 1 1 A 14 14 GLU N N 14 119.135 118.435 0.700 1
1 144 . 9 1 1 A 15 15 MET H H 15 7.773 7.603 0.170 1
1 145 . 9 1 1 A 15 15 MET HA H 15 3.936 4.123 -0.187 1
1 152 . 9 1 1 A 15 15 MET C C 15 177.886 178.153 -0.267 1
1 153 . 9 1 1 A 15 15 MET CA C 15 59.465 58.008 1.457 1
1 154 . 9 1 1 A 15 15 MET CB C 15 33.987 32.192 1.795 1
1 157 . 9 1 1 A 15 15 MET N N 15 117.884 119.846 -1.962 1
1 158 . 9 1 1 A 16 16 MET H H 16 8.145 8.243 -0.098 1
1 159 . 9 1 1 A 16 16 MET HA H 16 4.159 3.943 0.216 1
1 166 . 9 1 1 A 16 16 MET C C 16 177.835 178.208 -0.373 1
1 167 . 9 1 1 A 16 16 MET CA C 16 57.397 58.119 -0.722 1
1 168 . 9 1 1 A 16 16 MET CB C 16 31.867 32.345 -0.478 1
1 171 . 9 1 1 A 16 16 MET N N 16 119.555 118.247 1.308 1
1 172 . 9 1 1 A 17 17 GLU H H 17 7.761 8.145 -0.384 1
1 173 . 9 1 1 A 17 17 GLU HA H 17 4.117 4.097 0.020 1
1 176 . 9 1 1 A 17 17 GLU C C 17 175.994 176.964 -0.970 1
1 177 . 9 1 1 A 17 17 GLU CA C 17 57.392 58.079 -0.687 1
1 178 . 9 1 1 A 17 17 GLU CB C 17 29.432 29.719 -0.287 1
1 180 . 9 1 1 A 17 17 GLU N N 17 118.216 119.456 -1.240 1
1 181 . 9 1 1 A 18 18 LEU H H 18 7.201 7.291 -0.090 1
1 182 . 9 1 1 A 18 18 LEU HA H 18 4.111 4.240 -0.129 1
1 191 . 9 1 1 A 18 18 LEU C C 18 175.781 177.128 -1.347 1
1 192 . 9 1 1 A 18 18 LEU CA C 18 56.366 55.174 1.192 1
1 193 . 9 1 1 A 18 18 LEU CB C 18 42.030 42.484 -0.454 1
1 196 . 9 1 1 A 18 18 LEU N N 18 117.448 122.901 -5.453 1
1 197 . 9 1 1 A 19 19 ASP H H 19 7.789 8.796 -1.007 1
1 198 . 9 1 1 A 19 19 ASP HA H 19 4.360 4.669 -0.309 1
1 201 . 9 1 1 A 19 19 ASP C C 19 173.765 176.276 -2.511 1
1 202 . 9 1 1 A 19 19 ASP CA C 19 54.851 54.969 -0.118 1
1 203 . 9 1 1 A 19 19 ASP CB C 19 39.115 40.425 -1.310 1
1 204 . 9 1 1 A 19 19 ASP N N 19 115.844 121.354 -5.510 1
1 205 . 9 1 1 A 20 20 ILE H H 20 8.142 7.834 0.308 1
1 206 . 9 1 1 A 20 20 ILE HA H 20 4.128 4.280 -0.152 1
1 216 . 9 1 1 A 20 20 ILE C C 20 174.710 176.419 -1.709 1
1 217 . 9 1 1 A 20 20 ILE CA C 20 60.465 62.339 -1.874 1
1 218 . 9 1 1 A 20 20 ILE CB C 20 40.407 40.105 0.302 1
1 222 . 9 1 1 A 20 20 ILE N N 20 117.287 117.660 -0.373 1
1 223 . 9 1 1 A 21 21 GLY H H 21 8.207 8.067 0.140 1
1 224 . 9 1 1 A 21 21 GLY HA2 H 21 3.889 3.848 0.041 1
1 225 . 9 1 1 A 21 21 GLY HA3 H 21 3.924 3.856 0.068 1
1 226 . 9 1 1 A 21 21 GLY C C 21 172.162 173.851 -1.689 1
1 227 . 9 1 1 A 21 21 GLY CA C 21 45.017 46.758 -1.741 1
1 228 . 9 1 1 A 21 21 GLY N N 21 110.656 109.779 0.877 1
1 229 . 9 1 1 A 22 22 ASP H H 22 7.727 8.025 -0.298 1
1 230 . 9 1 1 A 22 22 ASP HA H 22 4.794 4.839 -0.045 1
1 233 . 9 1 1 A 22 22 ASP C C 22 174.884 177.268 -2.384 1
1 234 . 9 1 1 A 22 22 ASP CA C 22 52.471 52.842 -0.371 1
1 235 . 9 1 1 A 22 22 ASP CB C 22 42.069 42.367 -0.298 1
1 236 . 9 1 1 A 22 22 ASP N N 22 119.305 120.941 -1.636 1
1 237 . 9 1 1 A 23 23 ALA H H 23 8.644 9.077 -0.433 1
1 238 . 9 1 1 A 23 23 ALA HA H 23 4.120 4.023 0.097 1
1 242 . 9 1 1 A 23 23 ALA C C 23 179.546 179.796 -0.250 1
1 243 . 9 1 1 A 23 23 ALA CA C 23 55.609 55.513 0.096 1
1 244 . 9 1 1 A 23 23 ALA CB C 23 18.573 18.420 0.153 1
1 245 . 9 1 1 A 23 23 ALA N N 23 122.468 129.330 -6.862 1
1 246 . 9 1 1 A 24 24 THR H H 24 8.238 7.832 0.406 1
1 247 . 9 1 1 A 24 24 THR HA H 24 4.184 4.038 0.146 1
1 252 . 9 1 1 A 24 24 THR C C 24 174.841 176.881 -2.040 1
1 253 . 9 1 1 A 24 24 THR CA C 24 66.241 66.422 -0.181 1
1 254 . 9 1 1 A 24 24 THR CB C 24 68.376 68.304 0.072 1
1 256 . 9 1 1 A 24 24 THR N N 24 114.824 113.832 0.992 1
1 257 . 9 1 1 A 25 25 GLN H H 25 8.037 7.918 0.119 1
1 258 . 9 1 1 A 25 25 GLN HA H 25 4.095 4.079 0.016 1
1 265 . 9 1 1 A 25 25 GLN C C 25 177.603 178.993 -1.390 1
1 266 . 9 1 1 A 25 25 GLN CA C 25 59.261 58.714 0.547 1
1 267 . 9 1 1 A 25 25 GLN CB C 25 28.437 28.348 0.089 1
1 269 . 9 1 1 A 25 25 GLN N N 25 122.518 120.137 2.381 1
1 271 . 9 1 1 A 26 26 VAL H H 26 7.994 8.606 -0.612 1
1 272 . 9 1 1 A 26 26 VAL HA H 26 3.469 3.817 -0.348 1
1 280 . 9 1 1 A 26 26 VAL C C 26 175.552 177.948 -2.396 1
1 281 . 9 1 1 A 26 26 VAL CA C 26 66.909 65.884 1.025 1
1 282 . 9 1 1 A 26 26 VAL CB C 26 31.582 31.362 0.220 1
1 285 . 9 1 1 A 26 26 VAL N N 26 119.112 116.937 2.175 1
1 286 . 9 1 1 A 27 27 TYR H H 27 8.003 8.155 -0.152 1
1 287 . 9 1 1 A 27 27 TYR HA H 27 4.357 4.397 -0.040 1
1 294 . 9 1 1 A 27 27 TYR C C 27 175.856 177.224 -1.368 1
1 295 . 9 1 1 A 27 27 TYR CA C 27 62.197 61.605 0.592 1
1 296 . 9 1 1 A 27 27 TYR CB C 27 38.394 38.778 -0.384 1
1 297 . 9 1 1 A 27 27 TYR N N 27 119.170 124.703 -5.533 1
1 298 . 9 1 1 A 28 28 VAL H H 28 8.087 8.525 -0.438 1
1 299 . 9 1 1 A 28 28 VAL HA H 28 3.652 3.500 0.152 1
1 307 . 9 1 1 A 28 28 VAL C C 28 176.134 178.098 -1.964 1
1 308 . 9 1 1 A 28 28 VAL CA C 28 66.247 66.349 -0.102 1
1 309 . 9 1 1 A 28 28 VAL CB C 28 31.241 31.382 -0.141 1
1 312 . 9 1 1 A 28 28 VAL N N 28 113.112 119.277 -6.165 1
1 313 . 9 1 1 A 29 29 ALA H H 29 7.853 8.641 -0.788 1
1 314 . 9 1 1 A 29 29 ALA HA H 29 3.913 4.086 -0.173 1
1 318 . 9 1 1 A 29 29 ALA C C 29 177.850 179.212 -1.362 1
1 319 . 9 1 1 A 29 29 ALA CA C 29 55.274 54.942 0.332 1
1 320 . 9 1 1 A 29 29 ALA CB C 29 17.876 18.438 -0.562 1
1 321 . 9 1 1 A 29 29 ALA N N 29 121.350 122.596 -1.246 1
1 322 . 9 1 1 A 30 30 PHE H H 30 8.724 8.035 0.689 1
1 323 . 9 1 1 A 30 30 PHE HA H 30 4.098 4.210 -0.112 1
1 327 . 9 1 1 A 30 30 PHE C C 30 175.035 177.107 -2.072 1
1 328 . 9 1 1 A 30 30 PHE CA C 30 61.264 61.530 -0.266 1
1 329 . 9 1 1 A 30 30 PHE CB C 30 38.926 39.290 -0.364 1
1 330 . 9 1 1 A 30 30 PHE N N 30 120.478 120.353 0.125 1
1 331 . 9 1 1 A 31 31 LEU H H 31 8.146 8.160 -0.014 1
1 332 . 9 1 1 A 31 31 LEU HA H 31 3.597 3.592 0.005 1
1 341 . 9 1 1 A 31 31 LEU C C 31 179.508 179.349 0.159 1
1 342 . 9 1 1 A 31 31 LEU CA C 31 57.884 58.077 -0.193 1
1 343 . 9 1 1 A 31 31 LEU CB C 31 41.829 42.052 -0.223 1
1 346 . 9 1 1 A 31 31 LEU N N 31 118.427 120.258 -1.831 1
1 347 . 9 1 1 A 32 32 VAL H H 32 7.627 7.567 0.060 1
1 348 . 9 1 1 A 32 32 VAL HA H 32 3.464 3.776 -0.312 1
1 356 . 9 1 1 A 32 32 VAL C C 32 174.956 177.677 -2.721 1
1 357 . 9 1 1 A 32 32 VAL CA C 32 66.373 65.637 0.736 1
1 358 . 9 1 1 A 32 32 VAL CB C 32 31.121 31.494 -0.373 1
1 361 . 9 1 1 A 32 32 VAL N N 32 119.497 114.565 4.932 1
1 362 . 9 1 1 A 33 33 TYR H H 33 8.366 8.745 -0.379 1
1 363 . 9 1 1 A 33 33 TYR HA H 33 3.485 3.943 -0.458 1
1 370 . 9 1 1 A 33 33 TYR C C 33 174.883 176.908 -2.025 1
1 371 . 9 1 1 A 33 33 TYR CA C 33 62.866 61.347 1.519 1
1 372 . 9 1 1 A 33 33 TYR CB C 33 37.778 38.296 -0.518 1
1 373 . 9 1 1 A 33 33 TYR N N 33 121.842 124.261 -2.419 1
1 374 . 9 1 1 A 34 34 LEU H H 34 8.000 8.556 -0.556 1
1 375 . 9 1 1 A 34 34 LEU HA H 34 3.495 3.576 -0.081 1
1 385 . 9 1 1 A 34 34 LEU C C 34 178.240 179.015 -0.775 1
1 386 . 9 1 1 A 34 34 LEU CA C 34 57.453 57.111 0.342 1
1 387 . 9 1 1 A 34 34 LEU CB C 34 41.828 40.980 0.848 1
1 390 . 9 1 1 A 34 34 LEU N N 34 116.692 119.063 -2.371 1
1 391 . 9 1 1 A 35 35 ASP H H 35 7.688 7.893 -0.205 1
1 392 . 9 1 1 A 35 35 ASP HA H 35 4.302 4.295 0.007 1
1 395 . 9 1 1 A 35 35 ASP C C 35 177.507 178.445 -0.938 1
1 396 . 9 1 1 A 35 35 ASP CA C 35 58.196 57.659 0.537 1
1 397 . 9 1 1 A 35 35 ASP CB C 35 43.070 41.064 2.006 1
1 398 . 9 1 1 A 35 35 ASP N N 35 120.507 119.909 0.598 1
1 399 . 9 1 1 A 36 36 LEU H H 36 8.482 8.302 0.180 1
1 400 . 9 1 1 A 36 36 LEU HA H 36 3.328 3.622 -0.294 1
1 410 . 9 1 1 A 36 36 LEU C C 36 176.774 179.095 -2.321 1
1 411 . 9 1 1 A 36 36 LEU CA C 36 57.461 57.673 -0.212 1
1 412 . 9 1 1 A 36 36 LEU CB C 36 41.344 40.964 0.380 1
1 416 . 9 1 1 A 36 36 LEU N N 36 117.671 121.077 -3.406 1
1 417 . 9 1 1 A 37 37 MET H H 37 7.822 8.135 -0.313 1
1 418 . 9 1 1 A 37 37 MET HA H 37 4.401 3.999 0.402 1
1 425 . 9 1 1 A 37 37 MET C C 37 177.862 177.674 0.188 1
1 426 . 9 1 1 A 37 37 MET CA C 37 56.434 58.247 -1.813 1
1 427 . 9 1 1 A 37 37 MET CB C 37 31.573 31.930 -0.357 1
1 430 . 9 1 1 A 37 37 MET N N 37 112.952 118.294 -5.342 1
1 431 . 9 1 1 A 38 38 GLU H H 38 8.667 8.219 0.448 1
1 432 . 9 1 1 A 38 38 GLU HA H 38 4.457 4.339 0.118 1
1 436 . 9 1 1 A 38 38 GLU C C 38 176.582 177.127 -0.545 1
1 437 . 9 1 1 A 38 38 GLU CA C 38 57.659 57.218 0.441 1
1 438 . 9 1 1 A 38 38 GLU CB C 38 29.936 30.375 -0.439 1
1 440 . 9 1 1 A 38 38 GLU N N 38 116.463 117.920 -1.457 1
1 441 . 9 1 1 A 39 39 SER H H 39 7.657 8.031 -0.374 1
1 442 . 9 1 1 A 39 39 SER HA H 39 4.658 4.497 0.161 1
1 445 . 9 1 1 A 39 39 SER C C 39 175.661 175.495 0.166 1
1 446 . 9 1 1 A 39 39 SER CA C 39 60.449 60.552 -0.103 1
1 447 . 9 1 1 A 39 39 SER CB C 39 63.341 64.735 -1.394 1
1 448 . 9 1 1 A 39 39 SER N N 39 113.870 113.521 0.349 1
1 449 . 9 1 1 A 40 40 LYS H H 40 8.165 8.027 0.138 1
1 450 . 9 1 1 A 40 40 LYS HA H 40 4.454 4.374 0.080 1
1 458 . 9 1 1 A 40 40 LYS C C 40 174.970 176.474 -1.504 1
1 459 . 9 1 1 A 40 40 LYS CA C 40 55.753 55.933 -0.180 1
1 460 . 9 1 1 A 40 40 LYS CB C 40 32.337 32.875 -0.538 1
1 464 . 9 1 1 A 40 40 LYS N N 40 116.671 118.336 -1.665 1
1 465 . 9 1 1 A 41 41 SER H H 41 7.017 8.080 -1.063 1
1 466 . 9 1 1 A 41 41 SER HA H 41 4.209 4.321 -0.112 1
1 469 . 9 1 1 A 41 41 SER C C 41 173.770 174.128 -0.358 1
1 470 . 9 1 1 A 41 41 SER CA C 41 58.435 58.956 -0.521 1
1 471 . 9 1 1 A 41 41 SER CB C 41 61.700 60.942 0.758 1
1 472 . 9 1 1 A 41 41 SER N N 41 109.989 113.966 -3.977 1
1 473 . 9 1 1 A 42 42 TRP H H 42 8.876 7.574 1.302 1
1 474 . 9 1 1 A 42 42 TRP HA H 42 4.698 4.313 0.385 1
1 478 . 9 1 1 A 42 42 TRP C C 42 174.477 177.020 -2.543 1
1 479 . 9 1 1 A 42 42 TRP CA C 42 59.443 59.984 -0.541 1
1 480 . 9 1 1 A 42 42 TRP CB C 42 28.203 29.741 -1.538 1
1 481 . 9 1 1 A 42 42 TRP N N 42 121.116 124.923 -3.807 1
1 483 . 9 1 1 A 43 43 HIS H H 43 8.132 7.689 0.443 1
1 484 . 9 1 1 A 43 43 HIS HA H 43 4.445 4.837 -0.392 1
1 488 . 9 1 1 A 43 43 HIS C C 43 174.405 174.367 0.038 1
1 489 . 9 1 1 A 43 43 HIS CA C 43 58.556 56.801 1.755 1
1 490 . 9 1 1 A 43 43 HIS CB C 43 29.430 32.318 -2.888 1
1 491 . 9 1 1 A 43 43 HIS N N 43 119.397 114.129 5.268 1
1 492 . 9 1 1 A 44 44 GLU H H 44 8.140 7.646 0.494 1
1 493 . 9 1 1 A 44 44 GLU HA H 44 4.432 4.755 -0.323 1
1 497 . 9 1 1 A 44 44 GLU C C 44 173.010 174.815 -1.805 1
1 498 . 9 1 1 A 44 44 GLU CA C 44 56.421 55.800 0.621 1
1 499 . 9 1 1 A 44 44 GLU CB C 44 33.285 33.267 0.018 1
1 501 . 9 1 1 A 44 44 GLU N N 44 116.181 117.916 -1.735 1
1 502 . 9 1 1 A 45 45 VAL H H 45 8.428 8.767 -0.339 1
1 503 . 9 1 1 A 45 45 VAL HA H 45 4.492 5.001 -0.509 1
1 511 . 9 1 1 A 45 45 VAL C C 45 172.339 174.402 -2.063 1
1 512 . 9 1 1 A 45 45 VAL CA C 45 63.071 60.064 3.007 1
1 513 . 9 1 1 A 45 45 VAL CB C 45 35.145 34.969 0.176 1
1 516 . 9 1 1 A 45 45 VAL N N 45 123.272 120.775 2.497 1
1 517 . 9 1 1 A 46 46 ASN H H 46 9.050 9.212 -0.162 1
1 518 . 9 1 1 A 46 46 ASN HA H 46 5.261 5.556 -0.295 1
1 523 . 9 1 1 A 46 46 ASN C C 46 172.845 174.571 -1.726 1
1 524 . 9 1 1 A 46 46 ASN CA C 46 51.895 51.804 0.091 1
1 525 . 9 1 1 A 46 46 ASN CB C 46 42.322 41.601 0.721 1
1 526 . 9 1 1 A 46 46 ASN N N 46 123.901 124.145 -0.244 1
1 528 . 9 1 1 A 47 47 CYS H H 47 9.039 9.180 -0.141 1
1 529 . 9 1 1 A 47 47 CYS HA H 47 5.160 5.354 -0.194 1
1 532 . 9 1 1 A 47 47 CYS C C 47 172.454 173.448 -0.994 1
1 533 . 9 1 1 A 47 47 CYS CA C 47 56.473 57.355 -0.882 1
1 534 . 9 1 1 A 47 47 CYS CB C 47 29.297 29.498 -0.201 1
1 535 . 9 1 1 A 47 47 CYS N N 47 119.663 118.686 0.977 1
1 536 . 9 1 1 A 48 48 VAL H H 48 9.083 8.851 0.232 1
1 537 . 9 1 1 A 48 48 VAL HA H 48 4.344 4.739 -0.395 1
1 542 . 9 1 1 A 48 48 VAL C C 48 173.307 174.647 -1.340 1
1 543 . 9 1 1 A 48 48 VAL CA C 48 61.368 60.678 0.690 1
1 544 . 9 1 1 A 48 48 VAL CB C 48 35.345 36.078 -0.733 1
1 546 . 9 1 1 A 48 48 VAL N N 48 124.672 124.009 0.663 1
1 547 . 9 1 1 A 49 49 GLY H H 49 9.019 8.939 0.080 1
1 548 . 9 1 1 A 49 49 GLY HA2 H 49 3.460 4.215 -0.755 1
1 549 . 9 1 1 A 49 49 GLY HA3 H 49 4.539 4.217 0.322 1
1 550 . 9 1 1 A 49 49 GLY C C 49 171.278 171.879 -0.601 1
1 551 . 9 1 1 A 49 49 GLY CA C 49 45.075 44.350 0.725 1
1 552 . 9 1 1 A 49 49 GLY N N 49 113.131 114.855 -1.724 1
1 553 . 9 1 1 A 50 50 LEU H H 50 8.747 9.212 -0.465 1
1 554 . 9 1 1 A 50 50 LEU HA H 50 5.102 4.968 0.134 1
1 564 . 9 1 1 A 50 50 LEU CA C 50 51.417 51.299 0.118 1
1 565 . 9 1 1 A 50 50 LEU CB C 50 41.754 42.720 -0.966 1
1 569 . 9 1 1 A 50 50 LEU N N 50 124.471 125.808 -1.337 1
1 570 . 9 1 1 A 51 51 PRO HA H 51 4.106 4.261 -0.155 1
1 577 . 9 1 1 A 51 51 PRO C C 51 178.422 178.722 -0.300 1
1 578 . 9 1 1 A 51 51 PRO CA C 51 65.680 64.818 0.862 1
1 579 . 9 1 1 A 51 51 PRO CB C 51 31.939 32.091 -0.152 1
1 582 . 9 1 1 A 52 52 GLU H H 52 9.721 8.557 1.164 1
1 583 . 9 1 1 A 52 52 GLU HA H 52 4.176 4.082 0.094 1
1 588 . 9 1 1 A 52 52 GLU C C 52 176.146 177.808 -1.662 1
1 589 . 9 1 1 A 52 52 GLU CA C 52 59.158 59.386 -0.228 1
1 590 . 9 1 1 A 52 52 GLU CB C 52 28.442 29.438 -0.996 1
1 592 . 9 1 1 A 52 52 GLU N N 52 118.552 117.675 0.877 1
1 593 . 9 1 1 A 53 53 LEU H H 53 7.089 7.761 -0.672 1
1 594 . 9 1 1 A 53 53 LEU HA H 53 4.511 4.378 0.133 1
1 603 . 9 1 1 A 53 53 LEU C C 53 174.027 176.171 -2.144 1
1 604 . 9 1 1 A 53 53 LEU CA C 53 53.825 54.448 -0.623 1
1 605 . 9 1 1 A 53 53 LEU CB C 53 43.825 42.682 1.143 1
1 608 . 9 1 1 A 53 53 LEU N N 53 116.763 117.491 -0.728 1
1 609 . 9 1 1 A 54 54 GLN H H 54 7.964 7.926 0.038 1
1 610 . 9 1 1 A 54 54 GLN HA H 54 3.591 3.865 -0.274 1
1 616 . 9 1 1 A 54 54 GLN C C 54 172.604 174.090 -1.486 1
1 617 . 9 1 1 A 54 54 GLN CA C 54 56.961 57.100 -0.139 1
1 618 . 9 1 1 A 54 54 GLN CB C 54 26.545 26.439 0.106 1
1 620 . 9 1 1 A 54 54 GLN N N 54 115.489 116.411 -0.922 1
1 622 . 9 1 1 A 55 55 LEU H H 55 7.139 7.413 -0.274 1
1 623 . 9 1 1 A 55 55 LEU HA H 55 4.750 4.972 -0.222 1
1 629 . 9 1 1 A 55 55 LEU C C 55 173.475 175.796 -2.321 1
1 630 . 9 1 1 A 55 55 LEU CA C 55 53.698 52.511 1.187 1
1 631 . 9 1 1 A 55 55 LEU CB C 55 47.859 44.943 2.916 1
1 633 . 9 1 1 A 55 55 LEU N N 55 116.422 114.791 1.631 1
1 634 . 9 1 1 A 56 56 ILE H H 56 8.223 8.580 -0.357 1
1 635 . 9 1 1 A 56 56 ILE HA H 56 4.540 4.949 -0.409 1
1 643 . 9 1 1 A 56 56 ILE C C 56 173.938 174.814 -0.876 1
1 644 . 9 1 1 A 56 56 ILE CA C 56 61.020 60.159 0.861 1
1 645 . 9 1 1 A 56 56 ILE CB C 56 39.403 40.148 -0.745 1
1 648 . 9 1 1 A 56 56 ILE N N 56 122.792 121.341 1.451 1
1 649 . 9 1 1 A 57 57 CYS H H 57 8.995 9.370 -0.375 1
1 650 . 9 1 1 A 57 57 CYS HA H 57 5.036 5.068 -0.032 1
1 653 . 9 1 1 A 57 57 CYS C C 57 170.483 172.491 -2.008 1
1 654 . 9 1 1 A 57 57 CYS CA C 57 56.484 57.583 -1.099 1
1 655 . 9 1 1 A 57 57 CYS CB C 57 30.545 30.489 0.056 1
1 656 . 9 1 1 A 57 57 CYS N N 57 121.575 127.084 -5.509 1
1 657 . 9 1 1 A 58 58 LEU H H 58 9.076 8.671 0.405 1
1 658 . 9 1 1 A 58 58 LEU HA H 58 5.472 5.323 0.149 1
1 668 . 9 1 1 A 58 58 LEU C C 58 174.009 175.095 -1.086 1
1 669 . 9 1 1 A 58 58 LEU CA C 58 52.851 53.565 -0.714 1
1 670 . 9 1 1 A 58 58 LEU CB C 58 42.177 44.461 -2.284 1
1 674 . 9 1 1 A 58 58 LEU N N 58 121.895 128.729 -6.834 1
1 675 . 9 1 1 A 59 59 VAL H H 59 8.966 8.802 0.164 1
1 676 . 9 1 1 A 59 59 VAL HA H 59 5.488 5.082 0.406 1
1 681 . 9 1 1 A 59 59 VAL C C 59 176.034 175.811 0.223 1
1 682 . 9 1 1 A 59 59 VAL CA C 59 59.820 60.828 -1.008 1
1 683 . 9 1 1 A 59 59 VAL CB C 59 34.786 35.220 -0.434 1
1 685 . 9 1 1 A 59 59 VAL N N 59 121.702 127.640 -5.938 1
1 686 . 9 1 1 A 60 60 GLY H H 60 9.258 8.281 0.977 1
1 687 . 9 1 1 A 60 60 GLY HA2 H 60 4.673 4.415 0.258 1
1 688 . 9 1 1 A 60 60 GLY HA3 H 60 4.804 4.555 0.249 1
1 689 . 9 1 1 A 60 60 GLY C C 60 169.831 172.963 -3.132 1
1 690 . 9 1 1 A 60 60 GLY CA C 60 46.399 45.868 0.531 1
1 691 . 9 1 1 A 60 60 GLY N N 60 114.126 113.382 0.744 1
1 692 . 9 1 1 A 61 61 THR H H 61 8.834 8.492 0.342 1
1 693 . 9 1 1 A 61 61 THR HA H 61 4.418 4.963 -0.545 1
1 698 . 9 1 1 A 61 61 THR C C 61 171.985 175.066 -3.081 1
1 699 . 9 1 1 A 61 61 THR CA C 61 60.634 59.927 0.707 1
1 700 . 9 1 1 A 61 61 THR CB C 61 70.983 71.275 -0.292 1
1 702 . 9 1 1 A 61 61 THR N N 61 114.856 111.527 3.329 1
1 703 . 9 1 1 A 62 62 GLU H H 62 8.502 8.581 -0.079 1
1 704 . 9 1 1 A 62 62 GLU HA H 62 2.867 3.809 -0.942 1
1 709 . 9 1 1 A 62 62 GLU C C 62 174.650 175.858 -1.208 1
1 710 . 9 1 1 A 62 62 GLU CA C 62 58.785 58.039 0.746 1
1 711 . 9 1 1 A 62 62 GLU CB C 62 28.981 30.112 -1.131 1
1 713 . 9 1 1 A 62 62 GLU N N 62 129.915 122.914 7.001 1
1 714 . 9 1 1 A 63 63 ILE H H 63 6.928 7.337 -0.409 1
1 715 . 9 1 1 A 63 63 ILE HA H 63 4.038 4.478 -0.440 1
1 725 . 9 1 1 A 63 63 ILE C C 63 173.482 174.922 -1.440 1
1 726 . 9 1 1 A 63 63 ILE CA C 63 58.664 59.961 -1.297 1
1 727 . 9 1 1 A 63 63 ILE CB C 63 40.009 41.642 -1.633 1
1 731 . 9 1 1 A 63 63 ILE N N 63 117.075 117.841 -0.766 1
1 732 . 9 1 1 A 64 64 GLU H H 64 8.585 8.172 0.413 1
1 733 . 9 1 1 A 64 64 GLU HA H 64 3.427 4.029 -0.602 1
1 738 . 9 1 1 A 64 64 GLU C C 64 175.186 176.893 -1.707 1
1 739 . 9 1 1 A 64 64 GLU CA C 64 58.703 57.288 1.415 1
1 740 . 9 1 1 A 64 64 GLU CB C 64 28.999 28.856 0.143 1
1 742 . 9 1 1 A 64 64 GLU N N 64 126.422 127.196 -0.774 1
1 743 . 9 1 1 A 65 65 GLY H H 65 8.754 8.749 0.005 1
1 744 . 9 1 1 A 65 65 GLY HA2 H 65 3.631 3.942 -0.311 1
1 745 . 9 1 1 A 65 65 GLY HA3 H 65 4.287 3.960 0.327 1
1 746 . 9 1 1 A 65 65 GLY C C 65 174.005 174.058 -0.053 1
1 747 . 9 1 1 A 65 65 GLY CA C 65 44.954 45.177 -0.223 1
1 748 . 9 1 1 A 65 65 GLY N N 65 114.614 112.988 1.626 1
1 749 . 9 1 1 A 66 66 GLU H H 66 7.760 7.786 -0.026 1
1 750 . 9 1 1 A 66 66 GLU HA H 66 4.462 4.626 -0.164 1
1 754 . 9 1 1 A 66 66 GLU C C 66 175.255 176.132 -0.877 1
1 755 . 9 1 1 A 66 66 GLU CA C 66 55.582 54.632 0.950 1
1 756 . 9 1 1 A 66 66 GLU CB C 66 30.654 31.566 -0.912 1
1 758 . 9 1 1 A 66 66 GLU N N 66 119.292 121.564 -2.272 1
1 759 . 9 1 1 A 67 67 GLY H H 67 8.262 8.482 -0.220 1
1 760 . 9 1 1 A 67 67 GLY HA2 H 67 3.875 4.056 -0.181 1
1 761 . 9 1 1 A 67 67 GLY HA3 H 67 4.088 4.084 0.004 1
1 762 . 9 1 1 A 67 67 GLY C C 67 172.197 174.672 -2.475 1
1 763 . 9 1 1 A 67 67 GLY CA C 67 44.845 45.184 -0.339 1
1 764 . 9 1 1 A 67 67 GLY N N 67 106.161 110.540 -4.379 1
1 765 . 9 1 1 A 68 68 LEU H H 68 8.142 8.287 -0.145 1
1 766 . 9 1 1 A 68 68 LEU HA H 68 4.491 4.594 -0.103 1
1 775 . 9 1 1 A 68 68 LEU C C 68 176.194 176.622 -0.428 1
1 776 . 9 1 1 A 68 68 LEU CA C 68 55.123 54.357 0.766 1
1 777 . 9 1 1 A 68 68 LEU CB C 68 44.527 43.122 1.405 1
1 780 . 9 1 1 A 68 68 LEU N N 68 120.269 117.942 2.327 1
1 781 . 9 1 1 A 69 69 GLN H H 69 9.253 7.508 1.745 1
1 782 . 9 1 1 A 69 69 GLN HA H 69 4.770 4.714 0.056 1
1 788 . 9 1 1 A 69 69 GLN C C 69 173.607 174.764 -1.157 1
1 789 . 9 1 1 A 69 69 GLN CA C 69 54.736 55.333 -0.597 1
1 790 . 9 1 1 A 69 69 GLN CB C 69 33.782 29.450 4.332 1
1 792 . 9 1 1 A 69 69 GLN N N 69 119.336 119.753 -0.417 1
1 794 . 9 1 1 A 70 70 THR H H 70 8.803 9.099 -0.296 1
1 795 . 9 1 1 A 70 70 THR HA H 70 5.033 5.092 -0.059 1
1 800 . 9 1 1 A 70 70 THR C C 70 172.596 174.509 -1.913 1
1 801 . 9 1 1 A 70 70 THR CA C 70 62.768 62.157 0.611 1
1 802 . 9 1 1 A 70 70 THR CB C 70 69.990 70.533 -0.543 1
1 804 . 9 1 1 A 70 70 THR N N 70 118.372 120.240 -1.868 1
1 805 . 9 1 1 A 71 71 VAL H H 71 9.882 9.578 0.304 1
1 806 . 9 1 1 A 71 71 VAL HA H 71 5.239 5.718 -0.479 1
1 811 . 9 1 1 A 71 71 VAL C C 71 174.015 174.503 -0.488 1
1 812 . 9 1 1 A 71 71 VAL CA C 71 60.577 59.840 0.737 1
1 813 . 9 1 1 A 71 71 VAL CB C 71 34.149 34.821 -0.672 1
1 815 . 9 1 1 A 71 71 VAL N N 71 129.063 121.255 7.808 1
1 816 . 9 1 1 A 72 72 VAL H H 72 9.491 8.942 0.549 1
1 817 . 9 1 1 A 72 72 VAL HA H 72 4.672 4.563 0.109 1
1 825 . 9 1 1 A 72 72 VAL CA C 72 59.568 59.032 0.536 1
1 826 . 9 1 1 A 72 72 VAL CB C 72 34.057 34.588 -0.531 1
1 829 . 9 1 1 A 72 72 VAL N N 72 128.521 124.493 4.028 1
1 830 . 9 1 1 A 73 73 PRO HA H 73 5.368 4.466 0.902 1
1 836 . 9 1 1 A 73 73 PRO C C 73 175.079 175.986 -0.907 1
1 837 . 9 1 1 A 73 73 PRO CA C 73 61.324 63.207 -1.883 1
1 838 . 9 1 1 A 73 73 PRO CB C 73 33.089 31.923 1.166 1
1 841 . 9 1 1 A 74 74 THR H H 74 9.103 8.872 0.231 1
1 842 . 9 1 1 A 74 74 THR HA H 74 5.191 4.809 0.382 1
1 847 . 9 1 1 A 74 74 THR CA C 74 57.986 59.180 -1.194 1
1 848 . 9 1 1 A 74 74 THR CB C 74 72.212 72.462 -0.250 1
1 850 . 9 1 1 A 74 74 THR N N 74 118.075 118.966 -0.891 1
1 851 . 9 1 1 A 75 75 PRO HA H 75 5.015 4.842 0.173 1
1 858 . 9 1 1 A 75 75 PRO C C 75 178.704 177.327 1.377 1
1 859 . 9 1 1 A 75 75 PRO CA C 75 63.038 62.079 0.959 1
1 860 . 9 1 1 A 75 75 PRO CB C 75 32.529 33.038 -0.509 1
1 863 . 9 1 1 A 76 76 ILE H H 76 8.221 8.148 0.073 1
1 864 . 9 1 1 A 76 76 ILE HA H 76 4.218 3.813 0.405 1
1 873 . 9 1 1 A 76 76 ILE C C 76 172.375 177.765 -5.390 1
1 874 . 9 1 1 A 76 76 ILE CA C 76 63.509 63.949 -0.440 1
1 875 . 9 1 1 A 76 76 ILE CB C 76 39.322 37.784 1.538 1
1 879 . 9 1 1 A 76 76 ILE N N 76 122.273 122.504 -0.231 1
1 880 . 9 1 1 A 77 77 THR H H 77 6.984 7.467 -0.483 1
1 881 . 9 1 1 A 77 77 THR HA H 77 4.227 4.367 -0.140 1
1 886 . 9 1 1 A 77 77 THR C C 77 173.531 174.373 -0.842 1
1 887 . 9 1 1 A 77 77 THR CA C 77 61.435 62.726 -1.291 1
1 888 . 9 1 1 A 77 77 THR CB C 77 68.944 69.322 -0.378 1
1 890 . 9 1 1 A 77 77 THR N N 77 105.803 113.014 -7.211 1
1 891 . 9 1 1 A 78 78 ALA H H 78 7.647 7.344 0.303 1
1 892 . 9 1 1 A 78 78 ALA HA H 78 4.757 4.450 0.307 1
1 896 . 9 1 1 A 78 78 ALA C C 78 173.520 176.934 -3.414 1
1 897 . 9 1 1 A 78 78 ALA CA C 78 51.164 51.678 -0.514 1
1 898 . 9 1 1 A 78 78 ALA CB C 78 20.011 21.128 -1.117 1
1 899 . 9 1 1 A 78 78 ALA N N 78 126.635 124.011 2.624 1
1 900 . 9 1 1 A 79 79 SER H H 79 7.884 8.740 -0.856 1
1 901 . 9 1 1 A 79 79 SER HA H 79 4.386 5.466 -1.080 1
1 903 . 9 1 1 A 79 79 SER C C 79 176.077 172.715 3.362 1
1 904 . 9 1 1 A 79 79 SER CA C 79 57.465 55.998 1.467 1
1 905 . 9 1 1 A 79 79 SER CB C 79 65.285 66.028 -0.743 1
1 906 . 9 1 1 A 79 79 SER N N 79 115.272 112.858 2.414 1
1 907 . 9 1 1 A 80 80 LEU H H 80 7.700 8.898 -1.198 1
1 908 . 9 1 1 A 80 80 LEU HA H 80 4.912 5.085 -0.173 1
1 915 . 9 1 1 A 80 80 LEU C C 80 173.927 175.069 -1.142 1
1 916 . 9 1 1 A 80 80 LEU CA C 80 53.829 53.762 0.067 1
1 917 . 9 1 1 A 80 80 LEU CB C 80 45.990 45.178 0.812 1
1 920 . 9 1 1 A 80 80 LEU N N 80 121.507 126.461 -4.954 1
1 921 . 9 1 1 A 81 81 SER H H 81 7.885 8.584 -0.699 1
1 922 . 9 1 1 A 81 81 SER HA H 81 5.269 5.062 0.207 1
1 925 . 9 1 1 A 81 81 SER C C 81 175.756 173.645 2.111 1
1 926 . 9 1 1 A 81 81 SER CA C 81 55.507 57.330 -1.823 1
1 927 . 9 1 1 A 81 81 SER CB C 81 65.966 64.686 1.280 1
1 928 . 9 1 1 A 81 81 SER N N 81 118.323 118.242 0.081 1
1 929 . 9 1 1 A 82 82 HIS H H 82 8.935 8.995 -0.060 1
1 930 . 9 1 1 A 82 82 HIS HA H 82 4.407 4.413 -0.006 1
1 932 . 9 1 1 A 82 82 HIS C C 82 176.550 177.102 -0.552 1
1 933 . 9 1 1 A 82 82 HIS CA C 82 60.960 59.023 1.937 1
1 934 . 9 1 1 A 82 82 HIS CB C 82 30.755 29.301 1.454 1
1 935 . 9 1 1 A 82 82 HIS N N 82 124.042 122.876 1.166 1
1 936 . 9 1 1 A 83 83 ASN H H 83 8.435 8.180 0.255 1
1 937 . 9 1 1 A 83 83 ASN HA H 83 4.439 4.098 0.341 1
1 941 . 9 1 1 A 83 83 ASN C C 83 174.769 177.637 -2.868 1
1 942 . 9 1 1 A 83 83 ASN CA C 83 56.575 56.330 0.245 1
1 943 . 9 1 1 A 83 83 ASN CB C 83 38.731 38.855 -0.124 1
1 944 . 9 1 1 A 83 83 ASN N N 83 118.543 120.410 -1.867 1
1 946 . 9 1 1 A 84 84 ARG H H 84 7.716 7.780 -0.064 1
1 947 . 9 1 1 A 84 84 ARG HA H 84 4.183 4.119 0.064 1
1 953 . 9 1 1 A 84 84 ARG C C 84 177.399 178.609 -1.210 1
1 954 . 9 1 1 A 84 84 ARG CA C 84 59.045 58.872 0.173 1
1 955 . 9 1 1 A 84 84 ARG CB C 84 29.992 29.944 0.048 1
1 957 . 9 1 1 A 84 84 ARG N N 84 121.312 119.283 2.029 1
1 958 . 9 1 1 A 85 85 ILE H H 85 8.354 8.088 0.266 1
1 959 . 9 1 1 A 85 85 ILE HA H 85 3.650 3.929 -0.279 1
1 967 . 9 1 1 A 85 85 ILE C C 85 176.098 178.122 -2.024 1
1 968 . 9 1 1 A 85 85 ILE CA C 85 66.704 64.508 2.196 1
1 969 . 9 1 1 A 85 85 ILE CB C 85 38.017 37.655 0.362 1
1 972 . 9 1 1 A 85 85 ILE N N 85 119.321 119.232 0.089 1
1 973 . 9 1 1 A 86 86 ARG H H 86 7.690 7.925 -0.235 1
1 974 . 9 1 1 A 86 86 ARG HA H 86 3.704 4.011 -0.307 1
1 981 . 9 1 1 A 86 86 ARG C C 86 177.524 179.106 -1.582 1
1 982 . 9 1 1 A 86 86 ARG CA C 86 59.881 59.695 0.186 1
1 983 . 9 1 1 A 86 86 ARG CB C 86 29.248 29.864 -0.616 1
1 986 . 9 1 1 A 86 86 ARG N N 86 118.362 120.660 -2.298 1
1 987 . 9 1 1 A 87 87 GLU H H 87 7.884 7.764 0.120 1
1 988 . 9 1 1 A 87 87 GLU HA H 87 4.064 4.083 -0.019 1
1 993 . 9 1 1 A 87 87 GLU C C 87 178.785 179.364 -0.579 1
1 994 . 9 1 1 A 87 87 GLU CA C 87 58.999 59.065 -0.066 1
1 995 . 9 1 1 A 87 87 GLU CB C 87 29.872 29.723 0.149 1
1 997 . 9 1 1 A 87 87 GLU N N 87 118.124 119.132 -1.008 1
1 998 . 9 1 1 A 88 88 ILE H H 88 8.715 7.744 0.971 1
1 999 . 9 1 1 A 88 88 ILE HA H 88 3.305 3.486 -0.181 1
1 1009 . 9 1 1 A 88 88 ILE C C 88 177.261 178.085 -0.824 1
1 1010 . 9 1 1 A 88 88 ILE CA C 88 65.822 65.600 0.222 1
1 1011 . 9 1 1 A 88 88 ILE CB C 88 37.370 37.259 0.111 1
1 1015 . 9 1 1 A 88 88 ILE N N 88 122.929 120.787 2.142 1
1 1016 . 9 1 1 A 89 89 LEU H H 89 8.486 8.667 -0.181 1
1 1017 . 9 1 1 A 89 89 LEU HA H 89 3.932 3.901 0.031 1
1 1023 . 9 1 1 A 89 89 LEU C C 89 177.919 178.945 -1.026 1
1 1024 . 9 1 1 A 89 89 LEU CA C 89 59.060 58.238 0.822 1
1 1025 . 9 1 1 A 89 89 LEU CB C 89 41.129 41.866 -0.737 1
1 1028 . 9 1 1 A 89 89 LEU N N 89 122.696 120.291 2.405 1
1 1029 . 9 1 1 A 90 90 LYS H H 90 7.790 7.989 -0.199 1
1 1030 . 9 1 1 A 90 90 LYS HA H 90 4.061 3.930 0.131 1
1 1035 . 9 1 1 A 90 90 LYS C C 90 178.432 178.743 -0.311 1
1 1036 . 9 1 1 A 90 90 LYS CA C 90 59.840 59.564 0.276 1
1 1037 . 9 1 1 A 90 90 LYS CB C 90 32.582 32.309 0.273 1
1 1039 . 9 1 1 A 90 90 LYS N N 90 118.640 118.790 -0.150 1
1 1040 . 9 1 1 A 91 91 ALA H H 91 8.113 7.994 0.119 1
1 1041 . 9 1 1 A 91 91 ALA HA H 91 4.151 4.113 0.038 1
1 1045 . 9 1 1 A 91 91 ALA C C 91 179.147 179.715 -0.568 1
1 1046 . 9 1 1 A 91 91 ALA CA C 91 54.942 55.213 -0.271 1
1 1047 . 9 1 1 A 91 91 ALA CB C 91 18.242 18.423 -0.181 1
1 1048 . 9 1 1 A 91 91 ALA N N 91 122.939 121.610 1.329 1
1 1049 . 9 1 1 A 92 92 SER H H 92 8.858 8.764 0.094 1
1 1050 . 9 1 1 A 92 92 SER HA H 92 4.898 4.174 0.724 1
1 1052 . 9 1 1 A 92 92 SER C C 92 172.440 177.239 -4.799 1
1 1053 . 9 1 1 A 92 92 SER CA C 92 61.913 61.495 0.418 1
1 1054 . 9 1 1 A 92 92 SER CB C 92 63.081 62.456 0.625 1
1 1055 . 9 1 1 A 92 92 SER N N 92 114.526 112.903 1.623 1
1 1056 . 9 1 1 A 93 93 ARG H H 93 7.704 8.244 -0.540 1
1 1057 . 9 1 1 A 93 93 ARG HA H 93 4.162 4.114 0.048 1
1 1059 . 9 1 1 A 93 93 ARG C C 93 177.757 178.935 -1.178 1
1 1060 . 9 1 1 A 93 93 ARG CA C 93 59.544 58.694 0.850 1
1 1061 . 9 1 1 A 93 93 ARG CB C 93 30.343 29.532 0.811 1
1 1062 . 9 1 1 A 93 93 ARG N N 93 121.505 122.582 -1.077 1
1 1063 . 9 1 1 A 94 94 LYS H H 94 7.456 7.565 -0.109 1
1 1064 . 9 1 1 A 94 94 LYS HA H 94 4.174 4.143 0.031 1
1 1071 . 9 1 1 A 94 94 LYS C C 94 178.861 179.091 -0.230 1
1 1072 . 9 1 1 A 94 94 LYS CA C 94 59.030 58.975 0.055 1
1 1073 . 9 1 1 A 94 94 LYS CB C 94 32.239 32.224 0.015 1
1 1077 . 9 1 1 A 94 94 LYS N N 94 119.072 120.103 -1.031 1
1 1078 . 9 1 1 A 95 95 LEU H H 95 8.148 7.946 0.202 1
1 1079 . 9 1 1 A 95 95 LEU HA H 95 4.129 4.115 0.014 1
1 1088 . 9 1 1 A 95 95 LEU C C 95 177.274 178.032 -0.758 1
1 1089 . 9 1 1 A 95 95 LEU CA C 95 57.136 57.237 -0.101 1
1 1090 . 9 1 1 A 95 95 LEU CB C 95 41.908 41.204 0.704 1
1 1093 . 9 1 1 A 95 95 LEU N N 95 119.717 119.087 0.630 1
1 1094 . 9 1 1 A 96 96 GLN H H 96 7.807 7.809 -0.002 1
1 1095 . 9 1 1 A 96 96 GLN HA H 96 4.242 4.433 -0.191 1
1 1102 . 9 1 1 A 96 96 GLN C C 96 175.371 176.230 -0.859 1
1 1103 . 9 1 1 A 96 96 GLN CA C 96 56.397 56.111 0.286 1
1 1104 . 9 1 1 A 96 96 GLN CB C 96 29.123 29.406 -0.283 1
1 1106 . 9 1 1 A 96 96 GLN N N 96 114.581 117.766 -3.185 1
1 1108 . 9 1 1 A 97 97 GLY H H 97 7.802 7.984 -0.182 1
1 1109 . 9 1 1 A 97 97 GLY HA2 H 97 3.839 3.949 -0.110 1
1 1110 . 9 1 1 A 97 97 GLY HA3 H 97 4.096 3.949 0.147 1
1 1111 . 9 1 1 A 97 97 GLY C C 97 172.636 174.030 -1.394 1
1 1112 . 9 1 1 A 97 97 GLY CA C 97 46.372 46.337 0.035 1
1 1113 . 9 1 1 A 97 97 GLY N N 97 106.959 108.799 -1.840 1
1 1114 . 9 1 1 A 98 98 ASP H H 98 8.156 8.307 -0.151 1
1 1115 . 9 1 1 A 98 98 ASP HA H 98 4.754 4.909 -0.155 1
1 1118 . 9 1 1 A 98 98 ASP CA C 98 52.882 51.093 1.789 1
1 1119 . 9 1 1 A 98 98 ASP CB C 98 41.603 42.679 -1.076 1
1 1120 . 9 1 1 A 98 98 ASP N N 98 118.447 120.625 -2.178 1
1 1121 . 9 1 1 A 99 99 PRO HA H 99 4.470 4.442 0.028 1
1 1126 . 9 1 1 A 99 99 PRO C C 99 175.500 176.991 -1.491 1
1 1127 . 9 1 1 A 99 99 PRO CA C 99 63.601 65.203 -1.602 1
1 1128 . 9 1 1 A 99 99 PRO CB C 99 32.423 31.826 0.597 1
1 1130 . 9 1 1 A 100 100 ASP H H 100 8.527 7.549 0.978 1
1 1131 . 9 1 1 A 100 100 ASP HA H 100 4.778 4.886 -0.108 1
1 1134 . 9 1 1 A 100 100 ASP C C 100 174.931 174.687 0.244 1
1 1135 . 9 1 1 A 100 100 ASP CA C 100 53.915 53.343 0.572 1
1 1136 . 9 1 1 A 100 100 ASP CB C 100 40.665 41.168 -0.503 1
1 1137 . 9 1 1 A 100 100 ASP N N 100 119.340 115.705 3.635 1
1 1138 . 9 1 1 A 101 101 LEU H H 101 7.379 8.434 -1.055 1
1 1139 . 9 1 1 A 101 101 LEU HA H 101 4.682 4.413 0.269 1
1 1148 . 9 1 1 A 101 101 LEU CA C 101 52.956 52.849 0.107 1
1 1149 . 9 1 1 A 101 101 LEU CB C 101 43.393 42.126 1.267 1
1 1152 . 9 1 1 A 101 101 LEU N N 101 122.107 121.479 0.628 1
1 1153 . 9 1 1 A 102 102 PRO HA H 102 4.487 4.551 -0.064 1
1 1158 . 9 1 1 A 102 102 PRO C C 102 175.697 175.891 -0.194 1
1 1159 . 9 1 1 A 102 102 PRO CA C 102 63.113 62.846 0.267 1
1 1160 . 9 1 1 A 102 102 PRO CB C 102 32.138 31.760 0.378 1
1 1163 . 9 1 1 A 103 103 MET H H 103 9.011 8.795 0.216 1
1 1164 . 9 1 1 A 103 103 MET HA H 103 4.769 4.886 -0.117 1
1 1171 . 9 1 1 A 103 103 MET C C 103 174.080 173.633 0.447 1
1 1172 . 9 1 1 A 103 103 MET CA C 103 54.737 53.181 1.556 1
1 1173 . 9 1 1 A 103 103 MET CB C 103 34.857 35.040 -0.183 1
1 1176 . 9 1 1 A 103 103 MET N N 103 123.334 122.855 0.479 1
1 1177 . 9 1 1 A 104 104 SER H H 104 8.239 8.855 -0.616 1
1 1178 . 9 1 1 A 104 104 SER HA H 104 5.079 5.169 -0.090 1
1 1181 . 9 1 1 A 104 104 SER C C 104 171.795 172.517 -0.722 1
1 1182 . 9 1 1 A 104 104 SER CA C 104 57.641 56.760 0.881 1
1 1183 . 9 1 1 A 104 104 SER CB C 104 66.282 65.454 0.828 1
1 1184 . 9 1 1 A 104 104 SER N N 104 114.434 115.907 -1.473 1
1 1185 . 9 1 1 A 105 105 PHE H H 105 9.003 8.267 0.736 1
1 1186 . 9 1 1 A 105 105 PHE HA H 105 5.209 5.346 -0.137 1
1 1193 . 9 1 1 A 105 105 PHE C C 105 170.688 172.264 -1.576 1
1 1194 . 9 1 1 A 105 105 PHE CA C 105 56.917 55.866 1.051 1
1 1195 . 9 1 1 A 105 105 PHE CB C 105 41.350 42.303 -0.953 1
1 1196 . 9 1 1 A 105 105 PHE N N 105 116.224 118.709 -2.485 1
1 1197 . 9 1 1 A 106 106 THR H H 106 9.074 9.361 -0.287 1
1 1198 . 9 1 1 A 106 106 THR HA H 106 4.664 4.793 -0.129 1
1 1203 . 9 1 1 A 106 106 THR C C 106 171.767 174.754 -2.987 1
1 1204 . 9 1 1 A 106 106 THR CA C 106 62.162 62.137 0.025 1
1 1205 . 9 1 1 A 106 106 THR CB C 106 70.072 69.686 0.386 1
1 1207 . 9 1 1 A 106 106 THR N N 106 117.469 116.637 0.832 1
1 1208 . 9 1 1 A 107 107 LEU H H 107 9.804 9.434 0.370 1
1 1209 . 9 1 1 A 107 107 LEU HA H 107 4.750 4.797 -0.047 1
1 1219 . 9 1 1 A 107 107 LEU C C 107 172.742 176.085 -3.343 1
1 1220 . 9 1 1 A 107 107 LEU CA C 107 54.151 55.026 -0.875 1
1 1221 . 9 1 1 A 107 107 LEU CB C 107 44.486 42.500 1.986 1
1 1224 . 9 1 1 A 107 107 LEU N N 107 133.400 128.810 4.590 1
1 1225 . 9 1 1 A 108 108 ALA H H 108 8.435 8.818 -0.383 1
1 1226 . 9 1 1 A 108 108 ALA HA H 108 4.683 4.844 -0.161 1
1 1230 . 9 1 1 A 108 108 ALA C C 108 173.052 175.930 -2.878 1
1 1231 . 9 1 1 A 108 108 ALA CA C 108 49.308 50.794 -1.486 1
1 1232 . 9 1 1 A 108 108 ALA CB C 108 22.120 20.228 1.892 1
1 1233 . 9 1 1 A 108 108 ALA N N 108 131.422 127.289 4.133 1
1 1234 . 9 1 1 A 109 109 ILE H H 109 8.909 9.056 -0.147 1
1 1235 . 9 1 1 A 109 109 ILE HA H 109 4.063 5.073 -1.010 1
1 1245 . 9 1 1 A 109 109 ILE CA C 109 60.982 60.449 0.533 1
1 1246 . 9 1 1 A 109 109 ILE CB C 109 39.074 38.470 0.604 1
1 1250 . 9 1 1 A 109 109 ILE N N 109 124.415 123.960 0.455 1
1 1251 . 9 1 1 A 110 110 VAL H H 110 8.706 8.887 -0.181 1
1 1252 . 9 1 1 A 110 110 VAL HA H 110 4.324 5.086 -0.762 1
1 1260 . 9 1 1 A 110 110 VAL C C 110 175.700 173.368 2.332 1
1 1261 . 9 1 1 A 110 110 VAL CA C 110 62.316 59.540 2.776 1
1 1262 . 9 1 1 A 110 110 VAL CB C 110 31.876 34.694 -2.818 1
1 1264 . 9 1 1 A 110 110 VAL N N 110 127.457 126.758 0.699 1
1 1265 . 9 1 1 A 111 111 GLU H H 111 9.024 8.708 0.316 1
1 1266 . 9 1 1 A 111 111 GLU HA H 111 4.403 4.402 0.001 1
1 1269 . 9 1 1 A 111 111 GLU C C 111 175.987 177.559 -1.572 1
1 1270 . 9 1 1 A 111 111 GLU CA C 111 56.842 56.513 0.329 1
1 1271 . 9 1 1 A 111 111 GLU CB C 111 31.044 31.597 -0.553 1
1 1272 . 9 1 1 A 111 111 GLU N N 111 129.768 128.572 1.196 1
1 1273 . 9 1 1 A 112 112 SER H H 112 9.143 8.783 0.360 1
1 1274 . 9 1 1 A 112 112 SER HA H 112 4.394 4.261 0.133 1
1 1276 . 9 1 1 A 112 112 SER C C 112 173.187 174.757 -1.570 1
1 1277 . 9 1 1 A 112 112 SER CA C 112 60.180 61.100 -0.920 1
1 1278 . 9 1 1 A 112 112 SER CB C 112 63.415 63.010 0.405 1
1 1279 . 9 1 1 A 112 112 SER N N 112 115.956 121.000 -5.044 1
1 1280 . 9 1 1 A 113 113 ASP H H 113 8.133 7.847 0.286 1
1 1281 . 9 1 1 A 113 113 ASP HA H 113 4.573 4.915 -0.342 1
1 1284 . 9 1 1 A 113 113 ASP C C 113 175.430 176.953 -1.523 1
1 1285 . 9 1 1 A 113 113 ASP CA C 113 54.115 55.191 -1.076 1
1 1286 . 9 1 1 A 113 113 ASP CB C 113 40.011 43.194 -3.183 1
1 1287 . 9 1 1 A 113 113 ASP N N 113 118.343 118.487 -0.144 1
1 1288 . 9 1 1 A 114 114 SER H H 114 8.034 7.827 0.207 1
1 1289 . 9 1 1 A 114 114 SER HA H 114 4.057 4.618 -0.561 1
1 1291 . 9 1 1 A 114 114 SER C C 114 172.209 174.339 -2.130 1
1 1292 . 9 1 1 A 114 114 SER CA C 114 60.179 58.741 1.438 1
1 1293 . 9 1 1 A 114 114 SER CB C 114 62.702 64.693 -1.991 1
1 1294 . 9 1 1 A 114 114 SER N N 114 109.836 108.950 0.886 1
1 1295 . 9 1 1 A 115 115 THR H H 115 7.711 7.908 -0.197 1
1 1296 . 9 1 1 A 115 115 THR HA H 115 4.250 4.224 0.026 1
1 1300 . 9 1 1 A 115 115 THR C C 115 171.500 173.546 -2.046 1
1 1301 . 9 1 1 A 115 115 THR CA C 115 63.547 63.179 0.368 1
1 1302 . 9 1 1 A 115 115 THR CB C 115 69.595 69.444 0.151 1
1 1303 . 9 1 1 A 115 115 THR N N 115 117.407 116.819 0.588 1
1 1304 . 9 1 1 A 116 116 ILE H H 116 8.219 8.582 -0.363 1
1 1305 . 9 1 1 A 116 116 ILE HA H 116 4.769 5.138 -0.369 1
1 1315 . 9 1 1 A 116 116 ILE C C 116 174.434 175.096 -0.662 1
1 1316 . 9 1 1 A 116 116 ILE CA C 116 60.306 59.091 1.215 1
1 1317 . 9 1 1 A 116 116 ILE CB C 116 40.686 39.846 0.840 1
1 1321 . 9 1 1 A 116 116 ILE N N 116 125.480 129.813 -4.333 1
1 1322 . 9 1 1 A 117 117 VAL H H 117 8.695 9.420 -0.725 1
1 1323 . 9 1 1 A 117 117 VAL HA H 117 4.315 4.595 -0.280 1
1 1328 . 9 1 1 A 117 117 VAL C C 117 172.243 174.530 -2.287 1
1 1329 . 9 1 1 A 117 117 VAL CA C 117 60.621 60.857 -0.236 1
1 1330 . 9 1 1 A 117 117 VAL CB C 117 34.558 34.532 0.026 1
1 1332 . 9 1 1 A 117 117 VAL N N 117 127.887 127.289 0.598 1
1 1333 . 9 1 1 A 118 118 TYR H H 118 8.270 8.590 -0.320 1
1 1334 . 9 1 1 A 118 118 TYR HA H 118 5.327 5.339 -0.012 1
1 1342 . 9 1 1 A 118 118 TYR C C 118 174.250 174.994 -0.744 1
1 1343 . 9 1 1 A 118 118 TYR CA C 118 57.283 57.700 -0.417 1
1 1344 . 9 1 1 A 118 118 TYR CB C 118 39.262 40.042 -0.780 1
1 1345 . 9 1 1 A 118 118 TYR N N 118 124.822 126.841 -2.019 1
1 1346 . 9 1 1 A 119 119 TYR H H 119 9.207 9.226 -0.019 1
1 1347 . 9 1 1 A 119 119 TYR HA H 119 4.821 5.187 -0.366 1
1 1354 . 9 1 1 A 119 119 TYR C C 119 171.994 173.227 -1.233 1
1 1355 . 9 1 1 A 119 119 TYR CA C 119 58.116 57.568 0.548 1
1 1356 . 9 1 1 A 119 119 TYR CB C 119 43.544 42.154 1.390 1
1 1357 . 9 1 1 A 119 119 TYR N N 119 125.153 123.683 1.470 1
1 1358 . 9 1 1 A 120 120 LYS H H 120 7.700 8.575 -0.875 1
1 1359 . 9 1 1 A 120 120 LYS HA H 120 4.558 4.645 -0.087 1
1 1366 . 9 1 1 A 120 120 LYS C C 120 172.017 174.973 -2.956 1
1 1367 . 9 1 1 A 120 120 LYS CA C 120 57.217 55.902 1.315 1
1 1368 . 9 1 1 A 120 120 LYS CB C 120 33.914 33.496 0.418 1
1 1372 . 9 1 1 A 120 120 LYS N N 120 129.442 128.841 0.601 1
1 1373 . 9 1 1 A 121 121 LEU H H 121 8.112 8.263 -0.151 1
1 1374 . 9 1 1 A 121 121 LEU HA H 121 5.323 4.885 0.438 1
1 1384 . 9 1 1 A 121 121 LEU C C 121 175.733 174.843 0.890 1
1 1385 . 9 1 1 A 121 121 LEU CA C 121 52.716 53.450 -0.734 1
1 1386 . 9 1 1 A 121 121 LEU CB C 121 44.098 45.856 -1.758 1
1 1389 . 9 1 1 A 121 121 LEU N N 121 123.403 126.470 -3.067 1
1 1390 . 9 1 1 A 122 122 THR H H 122 8.338 8.933 -0.595 1
1 1391 . 9 1 1 A 122 122 THR HA H 122 5.097 5.094 0.003 1
1 1396 . 9 1 1 A 122 122 THR C C 122 173.221 171.916 1.305 1
1 1397 . 9 1 1 A 122 122 THR CA C 122 60.306 59.225 1.081 1
1 1398 . 9 1 1 A 122 122 THR CB C 122 72.473 71.629 0.844 1
1 1400 . 9 1 1 A 122 122 THR N N 122 109.081 116.173 -7.092 1
1 7 . 10 1 1 A 2 2 GLU H H 2 8.994 8.820 0.174 1
1 8 . 10 1 1 A 2 2 GLU HA H 2 4.278 4.427 -0.149 1
1 13 . 10 1 1 A 2 2 GLU C C 2 175.315 176.539 -1.224 1
1 14 . 10 1 1 A 2 2 GLU CA C 2 57.318 59.239 -1.921 1
1 15 . 10 1 1 A 2 2 GLU CB C 2 29.221 30.712 -1.491 1
1 17 . 10 1 1 A 2 2 GLU N N 2 122.259 127.084 -4.825 1
1 18 . 10 1 1 A 3 3 ASP H H 3 8.048 8.362 -0.314 1
1 19 . 10 1 1 A 3 3 ASP HA H 3 4.580 5.104 -0.524 1
1 21 . 10 1 1 A 3 3 ASP C C 3 175.636 174.798 0.838 1
1 22 . 10 1 1 A 3 3 ASP CA C 3 54.579 53.285 1.294 1
1 23 . 10 1 1 A 3 3 ASP CB C 3 40.984 43.041 -2.057 1
1 24 . 10 1 1 A 3 3 ASP N N 3 119.830 118.088 1.742 1
1 25 . 10 1 1 A 4 4 ALA H H 4 8.090 7.849 0.241 1
1 26 . 10 1 1 A 4 4 ALA HA H 4 4.216 4.160 0.056 1
1 30 . 10 1 1 A 4 4 ALA C C 4 177.157 177.584 -0.427 1
1 31 . 10 1 1 A 4 4 ALA CA C 4 53.620 50.971 2.649 1
1 32 . 10 1 1 A 4 4 ALA CB C 4 18.728 19.593 -0.865 1
1 33 . 10 1 1 A 4 4 ALA N N 4 123.957 126.858 -2.901 1
1 34 . 10 1 1 A 5 5 TRP H H 5 7.941 7.728 0.213 1
1 35 . 10 1 1 A 5 5 TRP HA H 5 4.559 5.028 -0.469 1
1 39 . 10 1 1 A 5 5 TRP C C 5 176.072 176.925 -0.853 1
1 40 . 10 1 1 A 5 5 TRP CA C 5 57.744 58.657 -0.913 1
1 41 . 10 1 1 A 5 5 TRP CB C 5 28.906 30.593 -1.687 1
1 42 . 10 1 1 A 5 5 TRP N N 5 118.408 118.640 -0.232 1
1 44 . 10 1 1 A 6 6 MET H H 6 7.679 7.691 -0.012 1
1 45 . 10 1 1 A 6 6 MET HA H 6 3.785 4.429 -0.644 1
1 52 . 10 1 1 A 6 6 MET C C 6 175.174 176.958 -1.784 1
1 53 . 10 1 1 A 6 6 MET CA C 6 57.724 56.882 0.842 1
1 54 . 10 1 1 A 6 6 MET CB C 6 31.640 33.528 -1.888 1
1 57 . 10 1 1 A 6 6 MET N N 6 121.538 116.276 5.262 1
1 58 . 10 1 1 A 7 7 GLY H H 7 7.247 8.396 -1.149 1
1 59 . 10 1 1 A 7 7 GLY HA2 H 7 3.455 3.418 0.037 1
1 60 . 10 1 1 A 7 7 GLY HA3 H 7 3.578 3.934 -0.356 1
1 61 . 10 1 1 A 7 7 GLY C C 7 172.852 174.442 -1.590 1
1 62 . 10 1 1 A 7 7 GLY CA C 7 45.896 45.476 0.420 1
1 63 . 10 1 1 A 7 7 GLY N N 7 104.055 105.554 -1.499 1
1 64 . 10 1 1 A 8 8 THR H H 8 7.436 8.514 -1.078 1
1 65 . 10 1 1 A 8 8 THR HA H 8 4.428 4.556 -0.128 1
1 70 . 10 1 1 A 8 8 THR C C 8 172.973 174.367 -1.394 1
1 71 . 10 1 1 A 8 8 THR CA C 8 60.751 61.983 -1.232 1
1 72 . 10 1 1 A 8 8 THR CB C 8 69.637 70.770 -1.133 1
1 74 . 10 1 1 A 8 8 THR N N 8 107.669 116.518 -8.849 1
1 75 . 10 1 1 A 9 9 HIS H H 9 8.048 7.038 1.010 1
1 76 . 10 1 1 A 9 9 HIS HA H 9 4.654 4.684 -0.030 1
1 79 . 10 1 1 A 9 9 HIS CA C 9 56.163 55.118 1.045 1
1 80 . 10 1 1 A 9 9 HIS CB C 9 32.619 29.727 2.892 1
1 81 . 10 1 1 A 9 9 HIS N N 9 127.281 121.024 6.257 1
1 82 . 10 1 1 A 10 10 PRO HA H 10 4.257 4.256 0.001 1
1 88 . 10 1 1 A 10 10 PRO C C 10 178.779 178.985 -0.206 1
1 89 . 10 1 1 A 10 10 PRO CA C 10 65.565 66.108 -0.543 1
1 90 . 10 1 1 A 10 10 PRO CB C 10 32.422 31.821 0.601 1
1 93 . 10 1 1 A 11 11 LYS H H 11 10.994 8.483 2.511 1
1 94 . 10 1 1 A 11 11 LYS HA H 11 4.282 4.209 0.073 1
1 100 . 10 1 1 A 11 11 LYS C C 11 177.279 178.800 -1.521 1
1 101 . 10 1 1 A 11 11 LYS CA C 11 56.859 59.527 -2.668 1
1 102 . 10 1 1 A 11 11 LYS CB C 11 31.279 32.367 -1.088 1
1 104 . 10 1 1 A 11 11 LYS N N 11 121.398 118.228 3.170 1
1 105 . 10 1 1 A 12 12 TYR H H 12 7.146 8.140 -0.994 1
1 106 . 10 1 1 A 12 12 TYR HA H 12 3.722 4.224 -0.502 1
1 113 . 10 1 1 A 12 12 TYR C C 12 176.265 177.474 -1.209 1
1 114 . 10 1 1 A 12 12 TYR CA C 12 61.189 61.344 -0.155 1
1 115 . 10 1 1 A 12 12 TYR CB C 12 37.796 38.330 -0.534 1
1 116 . 10 1 1 A 12 12 TYR N N 12 121.579 121.200 0.379 1
1 117 . 10 1 1 A 13 13 LEU H H 13 7.778 8.765 -0.987 1
1 118 . 10 1 1 A 13 13 LEU HA H 13 3.773 3.990 -0.217 1
1 127 . 10 1 1 A 13 13 LEU C C 13 178.462 178.624 -0.162 1
1 128 . 10 1 1 A 13 13 LEU CA C 13 57.942 58.167 -0.225 1
1 129 . 10 1 1 A 13 13 LEU CB C 13 41.064 41.522 -0.458 1
1 132 . 10 1 1 A 13 13 LEU N N 13 117.518 120.887 -3.369 1
1 133 . 10 1 1 A 14 14 GLU H H 14 7.867 8.775 -0.908 1
1 134 . 10 1 1 A 14 14 GLU HA H 14 3.935 4.059 -0.124 1
1 139 . 10 1 1 A 14 14 GLU C C 14 178.326 179.009 -0.683 1
1 140 . 10 1 1 A 14 14 GLU CA C 14 59.368 59.818 -0.450 1
1 141 . 10 1 1 A 14 14 GLU CB C 14 30.147 29.089 1.058 1
1 143 . 10 1 1 A 14 14 GLU N N 14 119.135 118.060 1.075 1
1 144 . 10 1 1 A 15 15 MET H H 15 7.773 7.681 0.092 1
1 145 . 10 1 1 A 15 15 MET HA H 15 3.936 4.118 -0.182 1
1 152 . 10 1 1 A 15 15 MET C C 15 177.886 177.656 0.230 1
1 153 . 10 1 1 A 15 15 MET CA C 15 59.465 58.061 1.404 1
1 154 . 10 1 1 A 15 15 MET CB C 15 33.987 32.171 1.816 1
1 157 . 10 1 1 A 15 15 MET N N 15 117.884 119.799 -1.915 1
1 158 . 10 1 1 A 16 16 MET H H 16 8.145 8.188 -0.043 1
1 159 . 10 1 1 A 16 16 MET HA H 16 4.159 4.127 0.032 1
1 166 . 10 1 1 A 16 16 MET C C 16 177.835 178.097 -0.262 1
1 167 . 10 1 1 A 16 16 MET CA C 16 57.397 57.496 -0.099 1
1 168 . 10 1 1 A 16 16 MET CB C 16 31.867 32.251 -0.384 1
1 171 . 10 1 1 A 16 16 MET N N 16 119.555 116.714 2.841 1
1 172 . 10 1 1 A 17 17 GLU H H 17 7.761 7.954 -0.193 1
1 173 . 10 1 1 A 17 17 GLU HA H 17 4.117 4.241 -0.124 1
1 176 . 10 1 1 A 17 17 GLU C C 17 175.994 176.603 -0.609 1
1 177 . 10 1 1 A 17 17 GLU CA C 17 57.392 58.136 -0.744 1
1 178 . 10 1 1 A 17 17 GLU CB C 17 29.432 30.030 -0.598 1
1 180 . 10 1 1 A 17 17 GLU N N 17 118.216 118.040 0.176 1
1 181 . 10 1 1 A 18 18 LEU H H 18 7.201 6.956 0.245 1
1 182 . 10 1 1 A 18 18 LEU HA H 18 4.111 4.331 -0.220 1
1 191 . 10 1 1 A 18 18 LEU C C 18 175.781 176.345 -0.564 1
1 192 . 10 1 1 A 18 18 LEU CA C 18 56.366 54.545 1.821 1
1 193 . 10 1 1 A 18 18 LEU CB C 18 42.030 42.068 -0.038 1
1 196 . 10 1 1 A 18 18 LEU N N 18 117.448 117.284 0.164 1
1 197 . 10 1 1 A 19 19 ASP H H 19 7.789 8.970 -1.181 1
1 198 . 10 1 1 A 19 19 ASP HA H 19 4.360 4.191 0.169 1
1 201 . 10 1 1 A 19 19 ASP C C 19 173.765 175.421 -1.656 1
1 202 . 10 1 1 A 19 19 ASP CA C 19 54.851 55.938 -1.087 1
1 203 . 10 1 1 A 19 19 ASP CB C 19 39.115 39.107 0.008 1
1 204 . 10 1 1 A 19 19 ASP N N 19 115.844 117.939 -2.095 1
1 205 . 10 1 1 A 20 20 ILE H H 20 8.142 8.521 -0.379 1
1 206 . 10 1 1 A 20 20 ILE HA H 20 4.128 4.282 -0.154 1
1 216 . 10 1 1 A 20 20 ILE C C 20 174.710 176.956 -2.246 1
1 217 . 10 1 1 A 20 20 ILE CA C 20 60.465 62.134 -1.669 1
1 218 . 10 1 1 A 20 20 ILE CB C 20 40.407 40.025 0.382 1
1 222 . 10 1 1 A 20 20 ILE N N 20 117.287 116.462 0.825 1
1 223 . 10 1 1 A 21 21 GLY H H 21 8.207 8.157 0.050 1
1 224 . 10 1 1 A 21 21 GLY HA2 H 21 3.889 3.892 -0.003 1
1 225 . 10 1 1 A 21 21 GLY HA3 H 21 3.924 3.913 0.011 1
1 226 . 10 1 1 A 21 21 GLY C C 21 172.162 174.238 -2.076 1
1 227 . 10 1 1 A 21 21 GLY CA C 21 45.017 46.445 -1.428 1
1 228 . 10 1 1 A 21 21 GLY N N 21 110.656 110.103 0.553 1
1 229 . 10 1 1 A 22 22 ASP H H 22 7.727 8.011 -0.284 1
1 230 . 10 1 1 A 22 22 ASP HA H 22 4.794 4.806 -0.012 1
1 233 . 10 1 1 A 22 22 ASP C C 22 174.884 176.561 -1.677 1
1 234 . 10 1 1 A 22 22 ASP CA C 22 52.471 52.898 -0.427 1
1 235 . 10 1 1 A 22 22 ASP CB C 22 42.069 42.140 -0.071 1
1 236 . 10 1 1 A 22 22 ASP N N 22 119.305 119.888 -0.583 1
1 237 . 10 1 1 A 23 23 ALA H H 23 8.644 9.054 -0.410 1
1 238 . 10 1 1 A 23 23 ALA HA H 23 4.120 4.014 0.106 1
1 242 . 10 1 1 A 23 23 ALA C C 23 179.546 179.802 -0.256 1
1 243 . 10 1 1 A 23 23 ALA CA C 23 55.609 55.533 0.076 1
1 244 . 10 1 1 A 23 23 ALA CB C 23 18.573 18.535 0.038 1
1 245 . 10 1 1 A 23 23 ALA N N 23 122.468 129.172 -6.704 1
1 246 . 10 1 1 A 24 24 THR H H 24 8.238 7.511 0.727 1
1 247 . 10 1 1 A 24 24 THR HA H 24 4.184 4.065 0.119 1
1 252 . 10 1 1 A 24 24 THR C C 24 174.841 176.852 -2.011 1
1 253 . 10 1 1 A 24 24 THR CA C 24 66.241 66.461 -0.220 1
1 254 . 10 1 1 A 24 24 THR CB C 24 68.376 68.362 0.014 1
1 256 . 10 1 1 A 24 24 THR N N 24 114.824 113.674 1.150 1
1 257 . 10 1 1 A 25 25 GLN H H 25 8.037 8.551 -0.514 1
1 258 . 10 1 1 A 25 25 GLN HA H 25 4.095 4.027 0.068 1
1 265 . 10 1 1 A 25 25 GLN C C 25 177.603 178.872 -1.269 1
1 266 . 10 1 1 A 25 25 GLN CA C 25 59.261 58.763 0.498 1
1 267 . 10 1 1 A 25 25 GLN CB C 25 28.437 28.234 0.203 1
1 269 . 10 1 1 A 25 25 GLN N N 25 122.518 120.107 2.411 1
1 271 . 10 1 1 A 26 26 VAL H H 26 7.994 8.259 -0.265 1
1 272 . 10 1 1 A 26 26 VAL HA H 26 3.469 3.674 -0.205 1
1 280 . 10 1 1 A 26 26 VAL C C 26 175.552 177.866 -2.314 1
1 281 . 10 1 1 A 26 26 VAL CA C 26 66.909 65.575 1.334 1
1 282 . 10 1 1 A 26 26 VAL CB C 26 31.582 31.274 0.308 1
1 285 . 10 1 1 A 26 26 VAL N N 26 119.112 116.749 2.363 1
1 286 . 10 1 1 A 27 27 TYR H H 27 8.003 8.254 -0.251 1
1 287 . 10 1 1 A 27 27 TYR HA H 27 4.357 4.487 -0.130 1
1 294 . 10 1 1 A 27 27 TYR C C 27 175.856 177.288 -1.432 1
1 295 . 10 1 1 A 27 27 TYR CA C 27 62.197 61.629 0.568 1
1 296 . 10 1 1 A 27 27 TYR CB C 27 38.394 38.777 -0.383 1
1 297 . 10 1 1 A 27 27 TYR N N 27 119.170 124.736 -5.566 1
1 298 . 10 1 1 A 28 28 VAL H H 28 8.087 8.741 -0.654 1
1 299 . 10 1 1 A 28 28 VAL HA H 28 3.652 3.568 0.084 1
1 307 . 10 1 1 A 28 28 VAL C C 28 176.134 178.325 -2.191 1
1 308 . 10 1 1 A 28 28 VAL CA C 28 66.247 66.345 -0.098 1
1 309 . 10 1 1 A 28 28 VAL CB C 28 31.241 31.399 -0.158 1
1 312 . 10 1 1 A 28 28 VAL N N 28 113.112 119.498 -6.386 1
1 313 . 10 1 1 A 29 29 ALA H H 29 7.853 8.612 -0.759 1
1 314 . 10 1 1 A 29 29 ALA HA H 29 3.913 4.065 -0.152 1
1 318 . 10 1 1 A 29 29 ALA C C 29 177.850 179.468 -1.618 1
1 319 . 10 1 1 A 29 29 ALA CA C 29 55.274 54.901 0.373 1
1 320 . 10 1 1 A 29 29 ALA CB C 29 17.876 18.389 -0.513 1
1 321 . 10 1 1 A 29 29 ALA N N 29 121.350 122.339 -0.989 1
1 322 . 10 1 1 A 30 30 PHE H H 30 8.724 7.917 0.807 1
1 323 . 10 1 1 A 30 30 PHE HA H 30 4.098 4.271 -0.173 1
1 327 . 10 1 1 A 30 30 PHE C C 30 175.035 176.920 -1.885 1
1 328 . 10 1 1 A 30 30 PHE CA C 30 61.264 61.467 -0.203 1
1 329 . 10 1 1 A 30 30 PHE CB C 30 38.926 39.377 -0.451 1
1 330 . 10 1 1 A 30 30 PHE N N 30 120.478 120.495 -0.017 1
1 331 . 10 1 1 A 31 31 LEU H H 31 8.146 8.039 0.107 1
1 332 . 10 1 1 A 31 31 LEU HA H 31 3.597 3.555 0.042 1
1 341 . 10 1 1 A 31 31 LEU C C 31 179.508 179.191 0.317 1
1 342 . 10 1 1 A 31 31 LEU CA C 31 57.884 57.974 -0.090 1
1 343 . 10 1 1 A 31 31 LEU CB C 31 41.829 41.881 -0.052 1
1 346 . 10 1 1 A 31 31 LEU N N 31 118.427 120.024 -1.597 1
1 347 . 10 1 1 A 32 32 VAL H H 32 7.627 7.650 -0.023 1
1 348 . 10 1 1 A 32 32 VAL HA H 32 3.464 3.767 -0.303 1
1 356 . 10 1 1 A 32 32 VAL C C 32 174.956 177.585 -2.629 1
1 357 . 10 1 1 A 32 32 VAL CA C 32 66.373 65.514 0.859 1
1 358 . 10 1 1 A 32 32 VAL CB C 32 31.121 31.587 -0.466 1
1 361 . 10 1 1 A 32 32 VAL N N 32 119.497 114.657 4.840 1
1 362 . 10 1 1 A 33 33 TYR H H 33 8.366 8.611 -0.245 1
1 363 . 10 1 1 A 33 33 TYR HA H 33 3.485 3.888 -0.403 1
1 370 . 10 1 1 A 33 33 TYR C C 33 174.883 176.810 -1.927 1
1 371 . 10 1 1 A 33 33 TYR CA C 33 62.866 61.219 1.647 1
1 372 . 10 1 1 A 33 33 TYR CB C 33 37.778 38.239 -0.461 1
1 373 . 10 1 1 A 33 33 TYR N N 33 121.842 124.229 -2.387 1
1 374 . 10 1 1 A 34 34 LEU H H 34 8.000 8.153 -0.153 1
1 375 . 10 1 1 A 34 34 LEU HA H 34 3.495 3.543 -0.048 1
1 385 . 10 1 1 A 34 34 LEU C C 34 178.240 178.968 -0.728 1
1 386 . 10 1 1 A 34 34 LEU CA C 34 57.453 57.174 0.279 1
1 387 . 10 1 1 A 34 34 LEU CB C 34 41.828 41.101 0.727 1
1 390 . 10 1 1 A 34 34 LEU N N 34 116.692 119.399 -2.707 1
1 391 . 10 1 1 A 35 35 ASP H H 35 7.688 7.877 -0.189 1
1 392 . 10 1 1 A 35 35 ASP HA H 35 4.302 4.313 -0.011 1
1 395 . 10 1 1 A 35 35 ASP C C 35 177.507 178.398 -0.891 1
1 396 . 10 1 1 A 35 35 ASP CA C 35 58.196 57.664 0.532 1
1 397 . 10 1 1 A 35 35 ASP CB C 35 43.070 41.109 1.961 1
1 398 . 10 1 1 A 35 35 ASP N N 35 120.507 119.908 0.599 1
1 399 . 10 1 1 A 36 36 LEU H H 36 8.482 8.452 0.030 1
1 400 . 10 1 1 A 36 36 LEU HA H 36 3.328 3.676 -0.348 1
1 410 . 10 1 1 A 36 36 LEU C C 36 176.774 179.198 -2.424 1
1 411 . 10 1 1 A 36 36 LEU CA C 36 57.461 57.610 -0.149 1
1 412 . 10 1 1 A 36 36 LEU CB C 36 41.344 40.832 0.512 1
1 416 . 10 1 1 A 36 36 LEU N N 36 117.671 120.145 -2.474 1
1 417 . 10 1 1 A 37 37 MET H H 37 7.822 7.642 0.180 1
1 418 . 10 1 1 A 37 37 MET HA H 37 4.401 4.190 0.211 1
1 425 . 10 1 1 A 37 37 MET C C 37 177.862 177.238 0.624 1
1 426 . 10 1 1 A 37 37 MET CA C 37 56.434 57.785 -1.351 1
1 427 . 10 1 1 A 37 37 MET CB C 37 31.573 32.454 -0.881 1
1 430 . 10 1 1 A 37 37 MET N N 37 112.952 118.172 -5.220 1
1 431 . 10 1 1 A 38 38 GLU H H 38 8.667 7.835 0.832 1
1 432 . 10 1 1 A 38 38 GLU HA H 38 4.457 4.310 0.147 1
1 436 . 10 1 1 A 38 38 GLU C C 38 176.582 177.996 -1.414 1
1 437 . 10 1 1 A 38 38 GLU CA C 38 57.659 56.517 1.142 1
1 438 . 10 1 1 A 38 38 GLU CB C 38 29.936 30.162 -0.226 1
1 440 . 10 1 1 A 38 38 GLU N N 38 116.463 116.596 -0.133 1
1 441 . 10 1 1 A 39 39 SER H H 39 7.657 8.494 -0.837 1
1 442 . 10 1 1 A 39 39 SER HA H 39 4.658 4.691 -0.033 1
1 445 . 10 1 1 A 39 39 SER C C 39 175.661 176.355 -0.694 1
1 446 . 10 1 1 A 39 39 SER CA C 39 60.449 59.553 0.896 1
1 447 . 10 1 1 A 39 39 SER CB C 39 63.341 64.661 -1.320 1
1 448 . 10 1 1 A 39 39 SER N N 39 113.870 116.138 -2.268 1
1 449 . 10 1 1 A 40 40 LYS H H 40 8.165 8.321 -0.156 1
1 450 . 10 1 1 A 40 40 LYS HA H 40 4.454 4.291 0.163 1
1 458 . 10 1 1 A 40 40 LYS C C 40 174.970 175.940 -0.970 1
1 459 . 10 1 1 A 40 40 LYS CA C 40 55.753 57.672 -1.919 1
1 460 . 10 1 1 A 40 40 LYS CB C 40 32.337 33.043 -0.706 1
1 464 . 10 1 1 A 40 40 LYS N N 40 116.671 122.588 -5.917 1
1 465 . 10 1 1 A 41 41 SER H H 41 7.017 7.992 -0.975 1
1 466 . 10 1 1 A 41 41 SER HA H 41 4.209 4.301 -0.092 1
1 469 . 10 1 1 A 41 41 SER C C 41 173.770 173.874 -0.104 1
1 470 . 10 1 1 A 41 41 SER CA C 41 58.435 58.983 -0.548 1
1 471 . 10 1 1 A 41 41 SER CB C 41 61.700 61.722 -0.022 1
1 472 . 10 1 1 A 41 41 SER N N 41 109.989 113.183 -3.194 1
1 473 . 10 1 1 A 42 42 TRP H H 42 8.876 8.508 0.368 1
1 474 . 10 1 1 A 42 42 TRP HA H 42 4.698 4.706 -0.008 1
1 478 . 10 1 1 A 42 42 TRP C C 42 174.477 177.217 -2.740 1
1 479 . 10 1 1 A 42 42 TRP CA C 42 59.443 57.354 2.089 1
1 480 . 10 1 1 A 42 42 TRP CB C 42 28.203 30.251 -2.048 1
1 481 . 10 1 1 A 42 42 TRP N N 42 121.116 121.081 0.035 1
1 483 . 10 1 1 A 43 43 HIS H H 43 8.132 8.333 -0.201 1
1 484 . 10 1 1 A 43 43 HIS HA H 43 4.445 4.485 -0.040 1
1 488 . 10 1 1 A 43 43 HIS C C 43 174.405 174.587 -0.182 1
1 489 . 10 1 1 A 43 43 HIS CA C 43 58.556 58.458 0.098 1
1 490 . 10 1 1 A 43 43 HIS CB C 43 29.430 31.189 -1.759 1
1 491 . 10 1 1 A 43 43 HIS N N 43 119.397 122.018 -2.621 1
1 492 . 10 1 1 A 44 44 GLU H H 44 8.140 7.689 0.451 1
1 493 . 10 1 1 A 44 44 GLU HA H 44 4.432 4.722 -0.290 1
1 497 . 10 1 1 A 44 44 GLU C C 44 173.010 174.524 -1.514 1
1 498 . 10 1 1 A 44 44 GLU CA C 44 56.421 55.889 0.532 1
1 499 . 10 1 1 A 44 44 GLU CB C 44 33.285 32.993 0.292 1
1 501 . 10 1 1 A 44 44 GLU N N 44 116.181 117.977 -1.796 1
1 502 . 10 1 1 A 45 45 VAL H H 45 8.428 8.920 -0.492 1
1 503 . 10 1 1 A 45 45 VAL HA H 45 4.492 5.036 -0.544 1
1 511 . 10 1 1 A 45 45 VAL C C 45 172.339 174.742 -2.403 1
1 512 . 10 1 1 A 45 45 VAL CA C 45 63.071 60.878 2.193 1
1 513 . 10 1 1 A 45 45 VAL CB C 45 35.145 34.791 0.354 1
1 516 . 10 1 1 A 45 45 VAL N N 45 123.272 126.184 -2.912 1
1 517 . 10 1 1 A 46 46 ASN H H 46 9.050 8.937 0.113 1
1 518 . 10 1 1 A 46 46 ASN HA H 46 5.261 5.483 -0.222 1
1 523 . 10 1 1 A 46 46 ASN C C 46 172.845 173.508 -0.663 1
1 524 . 10 1 1 A 46 46 ASN CA C 46 51.895 51.675 0.220 1
1 525 . 10 1 1 A 46 46 ASN CB C 46 42.322 42.280 0.042 1
1 526 . 10 1 1 A 46 46 ASN N N 46 123.901 124.638 -0.737 1
1 528 . 10 1 1 A 47 47 CYS H H 47 9.039 8.946 0.093 1
1 529 . 10 1 1 A 47 47 CYS HA H 47 5.160 5.300 -0.140 1
1 532 . 10 1 1 A 47 47 CYS C C 47 172.454 173.620 -1.166 1
1 533 . 10 1 1 A 47 47 CYS CA C 47 56.473 56.960 -0.487 1
1 534 . 10 1 1 A 47 47 CYS CB C 47 29.297 28.999 0.298 1
1 535 . 10 1 1 A 47 47 CYS N N 47 119.663 118.840 0.823 1
1 536 . 10 1 1 A 48 48 VAL H H 48 9.083 8.690 0.393 1
1 537 . 10 1 1 A 48 48 VAL HA H 48 4.344 4.677 -0.333 1
1 542 . 10 1 1 A 48 48 VAL C C 48 173.307 174.805 -1.498 1
1 543 . 10 1 1 A 48 48 VAL CA C 48 61.368 60.705 0.663 1
1 544 . 10 1 1 A 48 48 VAL CB C 48 35.345 36.097 -0.752 1
1 546 . 10 1 1 A 48 48 VAL N N 48 124.672 124.688 -0.016 1
1 547 . 10 1 1 A 49 49 GLY H H 49 9.019 8.979 0.040 1
1 548 . 10 1 1 A 49 49 GLY HA2 H 49 3.460 4.191 -0.731 1
1 549 . 10 1 1 A 49 49 GLY HA3 H 49 4.539 4.191 0.348 1
1 550 . 10 1 1 A 49 49 GLY C C 49 171.278 172.043 -0.765 1
1 551 . 10 1 1 A 49 49 GLY CA C 49 45.075 44.468 0.607 1
1 552 . 10 1 1 A 49 49 GLY N N 49 113.131 115.106 -1.975 1
1 553 . 10 1 1 A 50 50 LEU H H 50 8.747 9.520 -0.773 1
1 554 . 10 1 1 A 50 50 LEU HA H 50 5.102 4.963 0.139 1
1 564 . 10 1 1 A 50 50 LEU CA C 50 51.417 51.334 0.083 1
1 565 . 10 1 1 A 50 50 LEU CB C 50 41.754 42.597 -0.843 1
1 569 . 10 1 1 A 50 50 LEU N N 50 124.471 126.729 -2.258 1
1 570 . 10 1 1 A 51 51 PRO HA H 51 4.106 4.235 -0.129 1
1 577 . 10 1 1 A 51 51 PRO C C 51 178.422 178.570 -0.148 1
1 578 . 10 1 1 A 51 51 PRO CA C 51 65.680 65.196 0.484 1
1 579 . 10 1 1 A 51 51 PRO CB C 51 31.939 31.962 -0.023 1
1 582 . 10 1 1 A 52 52 GLU H H 52 9.721 9.117 0.604 1
1 583 . 10 1 1 A 52 52 GLU HA H 52 4.176 4.078 0.098 1
1 588 . 10 1 1 A 52 52 GLU C C 52 176.146 177.593 -1.447 1
1 589 . 10 1 1 A 52 52 GLU CA C 52 59.158 59.055 0.103 1
1 590 . 10 1 1 A 52 52 GLU CB C 52 28.442 28.656 -0.214 1
1 592 . 10 1 1 A 52 52 GLU N N 52 118.552 116.486 2.066 1
1 593 . 10 1 1 A 53 53 LEU H H 53 7.089 7.874 -0.785 1
1 594 . 10 1 1 A 53 53 LEU HA H 53 4.511 4.282 0.229 1
1 603 . 10 1 1 A 53 53 LEU C C 53 174.027 176.588 -2.561 1
1 604 . 10 1 1 A 53 53 LEU CA C 53 53.825 54.871 -1.046 1
1 605 . 10 1 1 A 53 53 LEU CB C 53 43.825 42.107 1.718 1
1 608 . 10 1 1 A 53 53 LEU N N 53 116.763 118.354 -1.591 1
1 609 . 10 1 1 A 54 54 GLN H H 54 7.964 7.879 0.085 1
1 610 . 10 1 1 A 54 54 GLN HA H 54 3.591 3.893 -0.302 1
1 616 . 10 1 1 A 54 54 GLN C C 54 172.604 174.522 -1.918 1
1 617 . 10 1 1 A 54 54 GLN CA C 54 56.961 57.228 -0.267 1
1 618 . 10 1 1 A 54 54 GLN CB C 54 26.545 27.834 -1.289 1
1 620 . 10 1 1 A 54 54 GLN N N 54 115.489 118.876 -3.387 1
1 622 . 10 1 1 A 55 55 LEU H H 55 7.139 7.381 -0.242 1
1 623 . 10 1 1 A 55 55 LEU HA H 55 4.750 4.958 -0.208 1
1 629 . 10 1 1 A 55 55 LEU C C 55 173.475 175.371 -1.896 1
1 630 . 10 1 1 A 55 55 LEU CA C 55 53.698 52.389 1.309 1
1 631 . 10 1 1 A 55 55 LEU CB C 55 47.859 46.012 1.847 1
1 633 . 10 1 1 A 55 55 LEU N N 55 116.422 114.807 1.615 1
1 634 . 10 1 1 A 56 56 ILE H H 56 8.223 8.479 -0.256 1
1 635 . 10 1 1 A 56 56 ILE HA H 56 4.540 5.386 -0.846 1
1 643 . 10 1 1 A 56 56 ILE C C 56 173.938 174.328 -0.390 1
1 644 . 10 1 1 A 56 56 ILE CA C 56 61.020 59.617 1.403 1
1 645 . 10 1 1 A 56 56 ILE CB C 56 39.403 40.924 -1.521 1
1 648 . 10 1 1 A 56 56 ILE N N 56 122.792 119.462 3.330 1
1 649 . 10 1 1 A 57 57 CYS H H 57 8.995 9.115 -0.120 1
1 650 . 10 1 1 A 57 57 CYS HA H 57 5.036 5.235 -0.199 1
1 653 . 10 1 1 A 57 57 CYS C C 57 170.483 172.813 -2.330 1
1 654 . 10 1 1 A 57 57 CYS CA C 57 56.484 56.730 -0.246 1
1 655 . 10 1 1 A 57 57 CYS CB C 57 30.545 31.286 -0.741 1
1 656 . 10 1 1 A 57 57 CYS N N 57 121.575 123.153 -1.578 1
1 657 . 10 1 1 A 58 58 LEU H H 58 9.076 8.599 0.477 1
1 658 . 10 1 1 A 58 58 LEU HA H 58 5.472 5.694 -0.222 1
1 668 . 10 1 1 A 58 58 LEU C C 58 174.009 176.221 -2.212 1
1 669 . 10 1 1 A 58 58 LEU CA C 58 52.851 53.554 -0.703 1
1 670 . 10 1 1 A 58 58 LEU CB C 58 42.177 43.084 -0.907 1
1 674 . 10 1 1 A 58 58 LEU N N 58 121.895 123.135 -1.240 1
1 675 . 10 1 1 A 59 59 VAL H H 59 8.966 8.629 0.337 1
1 676 . 10 1 1 A 59 59 VAL HA H 59 5.488 5.367 0.121 1
1 681 . 10 1 1 A 59 59 VAL C C 59 176.034 175.867 0.167 1
1 682 . 10 1 1 A 59 59 VAL CA C 59 59.820 60.787 -0.967 1
1 683 . 10 1 1 A 59 59 VAL CB C 59 34.786 34.657 0.129 1
1 685 . 10 1 1 A 59 59 VAL N N 59 121.702 124.313 -2.611 1
1 686 . 10 1 1 A 60 60 GLY H H 60 9.258 8.316 0.942 1
1 687 . 10 1 1 A 60 60 GLY HA2 H 60 4.673 4.414 0.259 1
1 688 . 10 1 1 A 60 60 GLY HA3 H 60 4.804 4.509 0.295 1
1 689 . 10 1 1 A 60 60 GLY C C 60 169.831 172.380 -2.549 1
1 690 . 10 1 1 A 60 60 GLY CA C 60 46.399 46.449 -0.050 1
1 691 . 10 1 1 A 60 60 GLY N N 60 114.126 112.685 1.441 1
1 692 . 10 1 1 A 61 61 THR H H 61 8.834 8.494 0.340 1
1 693 . 10 1 1 A 61 61 THR HA H 61 4.418 4.981 -0.563 1
1 698 . 10 1 1 A 61 61 THR C C 61 171.985 174.565 -2.580 1
1 699 . 10 1 1 A 61 61 THR CA C 61 60.634 60.592 0.042 1
1 700 . 10 1 1 A 61 61 THR CB C 61 70.983 70.980 0.003 1
1 702 . 10 1 1 A 61 61 THR N N 61 114.856 113.574 1.282 1
1 703 . 10 1 1 A 62 62 GLU H H 62 8.502 8.533 -0.031 1
1 704 . 10 1 1 A 62 62 GLU HA H 62 2.867 2.669 0.198 1
1 709 . 10 1 1 A 62 62 GLU C C 62 174.650 175.730 -1.080 1
1 710 . 10 1 1 A 62 62 GLU CA C 62 58.785 58.090 0.695 1
1 711 . 10 1 1 A 62 62 GLU CB C 62 28.981 29.118 -0.137 1
1 713 . 10 1 1 A 62 62 GLU N N 62 129.915 123.323 6.592 1
1 714 . 10 1 1 A 63 63 ILE H H 63 6.928 7.749 -0.821 1
1 715 . 10 1 1 A 63 63 ILE HA H 63 4.038 4.425 -0.387 1
1 725 . 10 1 1 A 63 63 ILE C C 63 173.482 175.000 -1.518 1
1 726 . 10 1 1 A 63 63 ILE CA C 63 58.664 60.128 -1.464 1
1 727 . 10 1 1 A 63 63 ILE CB C 63 40.009 41.198 -1.189 1
1 731 . 10 1 1 A 63 63 ILE N N 63 117.075 117.748 -0.673 1
1 732 . 10 1 1 A 64 64 GLU H H 64 8.585 8.477 0.108 1
1 733 . 10 1 1 A 64 64 GLU HA H 64 3.427 3.780 -0.353 1
1 738 . 10 1 1 A 64 64 GLU C C 64 175.186 177.207 -2.021 1
1 739 . 10 1 1 A 64 64 GLU CA C 64 58.703 57.987 0.716 1
1 740 . 10 1 1 A 64 64 GLU CB C 64 28.999 29.104 -0.105 1
1 742 . 10 1 1 A 64 64 GLU N N 64 126.422 127.298 -0.876 1
1 743 . 10 1 1 A 65 65 GLY H H 65 8.754 8.842 -0.088 1
1 744 . 10 1 1 A 65 65 GLY HA2 H 65 3.631 3.911 -0.280 1
1 745 . 10 1 1 A 65 65 GLY HA3 H 65 4.287 3.927 0.360 1
1 746 . 10 1 1 A 65 65 GLY C C 65 174.005 173.968 0.037 1
1 747 . 10 1 1 A 65 65 GLY CA C 65 44.954 45.040 -0.086 1
1 748 . 10 1 1 A 65 65 GLY N N 65 114.614 115.038 -0.424 1
1 749 . 10 1 1 A 66 66 GLU H H 66 7.760 7.576 0.184 1
1 750 . 10 1 1 A 66 66 GLU HA H 66 4.462 4.398 0.064 1
1 754 . 10 1 1 A 66 66 GLU C C 66 175.255 176.428 -1.173 1
1 755 . 10 1 1 A 66 66 GLU CA C 66 55.582 55.551 0.031 1
1 756 . 10 1 1 A 66 66 GLU CB C 66 30.654 31.198 -0.544 1
1 758 . 10 1 1 A 66 66 GLU N N 66 119.292 121.643 -2.351 1
1 759 . 10 1 1 A 67 67 GLY H H 67 8.262 8.300 -0.038 1
1 760 . 10 1 1 A 67 67 GLY HA2 H 67 3.875 4.039 -0.164 1
1 761 . 10 1 1 A 67 67 GLY HA3 H 67 4.088 4.041 0.047 1
1 762 . 10 1 1 A 67 67 GLY C C 67 172.197 172.912 -0.715 1
1 763 . 10 1 1 A 67 67 GLY CA C 67 44.845 44.555 0.290 1
1 764 . 10 1 1 A 67 67 GLY N N 67 106.161 111.130 -4.969 1
1 765 . 10 1 1 A 68 68 LEU H H 68 8.142 8.563 -0.421 1
1 766 . 10 1 1 A 68 68 LEU HA H 68 4.491 4.446 0.045 1
1 775 . 10 1 1 A 68 68 LEU C C 68 176.194 176.557 -0.363 1
1 776 . 10 1 1 A 68 68 LEU CA C 68 55.123 54.371 0.752 1
1 777 . 10 1 1 A 68 68 LEU CB C 68 44.527 42.262 2.265 1
1 780 . 10 1 1 A 68 68 LEU N N 68 120.269 120.242 0.027 1
1 781 . 10 1 1 A 69 69 GLN H H 69 9.253 8.616 0.637 1
1 782 . 10 1 1 A 69 69 GLN HA H 69 4.770 5.002 -0.232 1
1 788 . 10 1 1 A 69 69 GLN C C 69 173.607 175.004 -1.397 1
1 789 . 10 1 1 A 69 69 GLN CA C 69 54.736 54.848 -0.112 1
1 790 . 10 1 1 A 69 69 GLN CB C 69 33.782 30.949 2.833 1
1 792 . 10 1 1 A 69 69 GLN N N 69 119.336 123.864 -4.528 1
1 794 . 10 1 1 A 70 70 THR H H 70 8.803 8.886 -0.083 1
1 795 . 10 1 1 A 70 70 THR HA H 70 5.033 5.151 -0.118 1
1 800 . 10 1 1 A 70 70 THR C C 70 172.596 173.980 -1.384 1
1 801 . 10 1 1 A 70 70 THR CA C 70 62.768 61.928 0.840 1
1 802 . 10 1 1 A 70 70 THR CB C 70 69.990 70.583 -0.593 1
1 804 . 10 1 1 A 70 70 THR N N 70 118.372 117.351 1.021 1
1 805 . 10 1 1 A 71 71 VAL H H 71 9.882 9.269 0.613 1
1 806 . 10 1 1 A 71 71 VAL HA H 71 5.239 5.669 -0.430 1
1 811 . 10 1 1 A 71 71 VAL C C 71 174.015 175.494 -1.479 1
1 812 . 10 1 1 A 71 71 VAL CA C 71 60.577 60.248 0.329 1
1 813 . 10 1 1 A 71 71 VAL CB C 71 34.149 34.145 0.004 1
1 815 . 10 1 1 A 71 71 VAL N N 71 129.063 122.253 6.810 1
1 816 . 10 1 1 A 72 72 VAL H H 72 9.491 8.613 0.878 1
1 817 . 10 1 1 A 72 72 VAL HA H 72 4.672 4.944 -0.272 1
1 825 . 10 1 1 A 72 72 VAL CA C 72 59.568 58.589 0.979 1
1 826 . 10 1 1 A 72 72 VAL CB C 72 34.057 34.385 -0.328 1
1 829 . 10 1 1 A 72 72 VAL N N 72 128.521 119.945 8.576 1
1 830 . 10 1 1 A 73 73 PRO HA H 73 5.368 4.501 0.867 1
1 836 . 10 1 1 A 73 73 PRO C C 73 175.079 175.871 -0.792 1
1 837 . 10 1 1 A 73 73 PRO CA C 73 61.324 63.180 -1.856 1
1 838 . 10 1 1 A 73 73 PRO CB C 73 33.089 31.845 1.244 1
1 841 . 10 1 1 A 74 74 THR H H 74 9.103 8.974 0.129 1
1 842 . 10 1 1 A 74 74 THR HA H 74 5.191 4.754 0.437 1
1 847 . 10 1 1 A 74 74 THR CA C 74 57.986 58.994 -1.008 1
1 848 . 10 1 1 A 74 74 THR CB C 74 72.212 72.174 0.038 1
1 850 . 10 1 1 A 74 74 THR N N 74 118.075 118.889 -0.814 1
1 851 . 10 1 1 A 75 75 PRO HA H 75 5.015 4.848 0.167 1
1 858 . 10 1 1 A 75 75 PRO C C 75 178.704 177.019 1.685 1
1 859 . 10 1 1 A 75 75 PRO CA C 75 63.038 62.062 0.976 1
1 860 . 10 1 1 A 75 75 PRO CB C 75 32.529 33.013 -0.484 1
1 863 . 10 1 1 A 76 76 ILE H H 76 8.221 8.034 0.187 1
1 864 . 10 1 1 A 76 76 ILE HA H 76 4.218 3.917 0.301 1
1 873 . 10 1 1 A 76 76 ILE C C 76 172.375 177.721 -5.346 1
1 874 . 10 1 1 A 76 76 ILE CA C 76 63.509 63.657 -0.148 1
1 875 . 10 1 1 A 76 76 ILE CB C 76 39.322 37.595 1.727 1
1 879 . 10 1 1 A 76 76 ILE N N 76 122.273 122.110 0.163 1
1 880 . 10 1 1 A 77 77 THR H H 77 6.984 7.630 -0.646 1
1 881 . 10 1 1 A 77 77 THR HA H 77 4.227 4.290 -0.063 1
1 886 . 10 1 1 A 77 77 THR C C 77 173.531 174.201 -0.670 1
1 887 . 10 1 1 A 77 77 THR CA C 77 61.435 63.606 -2.171 1
1 888 . 10 1 1 A 77 77 THR CB C 77 68.944 69.149 -0.205 1
1 890 . 10 1 1 A 77 77 THR N N 77 105.803 115.487 -9.684 1
1 891 . 10 1 1 A 78 78 ALA H H 78 7.647 7.408 0.239 1
1 892 . 10 1 1 A 78 78 ALA HA H 78 4.757 4.613 0.144 1
1 896 . 10 1 1 A 78 78 ALA C C 78 173.520 176.432 -2.912 1
1 897 . 10 1 1 A 78 78 ALA CA C 78 51.164 51.227 -0.063 1
1 898 . 10 1 1 A 78 78 ALA CB C 78 20.011 21.362 -1.351 1
1 899 . 10 1 1 A 78 78 ALA N N 78 126.635 123.395 3.240 1
1 900 . 10 1 1 A 79 79 SER H H 79 7.884 8.865 -0.981 1
1 901 . 10 1 1 A 79 79 SER HA H 79 4.386 5.241 -0.855 1
1 903 . 10 1 1 A 79 79 SER C C 79 176.077 172.515 3.562 1
1 904 . 10 1 1 A 79 79 SER CA C 79 57.465 56.570 0.895 1
1 905 . 10 1 1 A 79 79 SER CB C 79 65.285 65.933 -0.648 1
1 906 . 10 1 1 A 79 79 SER N N 79 115.272 111.854 3.418 1
1 907 . 10 1 1 A 80 80 LEU H H 80 7.700 8.707 -1.007 1
1 908 . 10 1 1 A 80 80 LEU HA H 80 4.912 4.767 0.145 1
1 915 . 10 1 1 A 80 80 LEU C C 80 173.927 175.194 -1.267 1
1 916 . 10 1 1 A 80 80 LEU CA C 80 53.829 53.818 0.011 1
1 917 . 10 1 1 A 80 80 LEU CB C 80 45.990 44.248 1.742 1
1 920 . 10 1 1 A 80 80 LEU N N 80 121.507 126.748 -5.241 1
1 921 . 10 1 1 A 81 81 SER H H 81 7.885 8.701 -0.816 1
1 922 . 10 1 1 A 81 81 SER HA H 81 5.269 4.876 0.393 1
1 925 . 10 1 1 A 81 81 SER C C 81 175.756 174.916 0.840 1
1 926 . 10 1 1 A 81 81 SER CA C 81 55.507 57.227 -1.720 1
1 927 . 10 1 1 A 81 81 SER CB C 81 65.966 65.711 0.255 1
1 928 . 10 1 1 A 81 81 SER N N 81 118.323 116.115 2.208 1
1 929 . 10 1 1 A 82 82 HIS H H 82 8.935 9.022 -0.087 1
1 930 . 10 1 1 A 82 82 HIS HA H 82 4.407 4.414 -0.007 1
1 932 . 10 1 1 A 82 82 HIS C C 82 176.550 176.725 -0.175 1
1 933 . 10 1 1 A 82 82 HIS CA C 82 60.960 58.907 2.053 1
1 934 . 10 1 1 A 82 82 HIS CB C 82 30.755 29.269 1.486 1
1 935 . 10 1 1 A 82 82 HIS N N 82 124.042 119.699 4.343 1
1 936 . 10 1 1 A 83 83 ASN H H 83 8.435 7.866 0.569 1
1 937 . 10 1 1 A 83 83 ASN HA H 83 4.439 4.158 0.281 1
1 941 . 10 1 1 A 83 83 ASN C C 83 174.769 177.949 -3.180 1
1 942 . 10 1 1 A 83 83 ASN CA C 83 56.575 55.904 0.671 1
1 943 . 10 1 1 A 83 83 ASN CB C 83 38.731 37.961 0.770 1
1 944 . 10 1 1 A 83 83 ASN N N 83 118.543 118.733 -0.190 1
1 946 . 10 1 1 A 84 84 ARG H H 84 7.716 7.715 0.001 1
1 947 . 10 1 1 A 84 84 ARG HA H 84 4.183 4.179 0.004 1
1 953 . 10 1 1 A 84 84 ARG C C 84 177.399 178.664 -1.265 1
1 954 . 10 1 1 A 84 84 ARG CA C 84 59.045 58.408 0.637 1
1 955 . 10 1 1 A 84 84 ARG CB C 84 29.992 29.793 0.199 1
1 957 . 10 1 1 A 84 84 ARG N N 84 121.312 119.976 1.336 1
1 958 . 10 1 1 A 85 85 ILE H H 85 8.354 8.583 -0.229 1
1 959 . 10 1 1 A 85 85 ILE HA H 85 3.650 3.796 -0.146 1
1 967 . 10 1 1 A 85 85 ILE C C 85 176.098 177.926 -1.828 1
1 968 . 10 1 1 A 85 85 ILE CA C 85 66.704 65.437 1.267 1
1 969 . 10 1 1 A 85 85 ILE CB C 85 38.017 37.988 0.029 1
1 972 . 10 1 1 A 85 85 ILE N N 85 119.321 120.307 -0.986 1
1 973 . 10 1 1 A 86 86 ARG H H 86 7.690 8.305 -0.615 1
1 974 . 10 1 1 A 86 86 ARG HA H 86 3.704 3.965 -0.261 1
1 981 . 10 1 1 A 86 86 ARG C C 86 177.524 178.771 -1.247 1
1 982 . 10 1 1 A 86 86 ARG CA C 86 59.881 59.732 0.149 1
1 983 . 10 1 1 A 86 86 ARG CB C 86 29.248 29.990 -0.742 1
1 986 . 10 1 1 A 86 86 ARG N N 86 118.362 119.300 -0.938 1
1 987 . 10 1 1 A 87 87 GLU H H 87 7.884 7.918 -0.034 1
1 988 . 10 1 1 A 87 87 GLU HA H 87 4.064 4.066 -0.002 1
1 993 . 10 1 1 A 87 87 GLU C C 87 178.785 178.995 -0.210 1
1 994 . 10 1 1 A 87 87 GLU CA C 87 58.999 59.284 -0.285 1
1 995 . 10 1 1 A 87 87 GLU CB C 87 29.872 29.122 0.750 1
1 997 . 10 1 1 A 87 87 GLU N N 87 118.124 118.135 -0.011 1
1 998 . 10 1 1 A 88 88 ILE H H 88 8.715 7.764 0.951 1
1 999 . 10 1 1 A 88 88 ILE HA H 88 3.305 3.492 -0.187 1
1 1009 . 10 1 1 A 88 88 ILE C C 88 177.261 177.912 -0.651 1
1 1010 . 10 1 1 A 88 88 ILE CA C 88 65.822 65.562 0.260 1
1 1011 . 10 1 1 A 88 88 ILE CB C 88 37.370 37.427 -0.057 1
1 1015 . 10 1 1 A 88 88 ILE N N 88 122.929 121.372 1.557 1
1 1016 . 10 1 1 A 89 89 LEU H H 89 8.486 8.686 -0.200 1
1 1017 . 10 1 1 A 89 89 LEU HA H 89 3.932 3.856 0.076 1
1 1023 . 10 1 1 A 89 89 LEU C C 89 177.919 179.130 -1.211 1
1 1024 . 10 1 1 A 89 89 LEU CA C 89 59.060 58.154 0.906 1
1 1025 . 10 1 1 A 89 89 LEU CB C 89 41.129 41.718 -0.589 1
1 1028 . 10 1 1 A 89 89 LEU N N 89 122.696 119.897 2.799 1
1 1029 . 10 1 1 A 90 90 LYS H H 90 7.790 8.170 -0.380 1
1 1030 . 10 1 1 A 90 90 LYS HA H 90 4.061 3.933 0.128 1
1 1035 . 10 1 1 A 90 90 LYS C C 90 178.432 178.670 -0.238 1
1 1036 . 10 1 1 A 90 90 LYS CA C 90 59.840 58.909 0.931 1
1 1037 . 10 1 1 A 90 90 LYS CB C 90 32.582 32.197 0.385 1
1 1039 . 10 1 1 A 90 90 LYS N N 90 118.640 119.195 -0.555 1
1 1040 . 10 1 1 A 91 91 ALA H H 91 8.113 8.118 -0.005 1
1 1041 . 10 1 1 A 91 91 ALA HA H 91 4.151 4.086 0.065 1
1 1045 . 10 1 1 A 91 91 ALA C C 91 179.147 179.554 -0.407 1
1 1046 . 10 1 1 A 91 91 ALA CA C 91 54.942 55.205 -0.263 1
1 1047 . 10 1 1 A 91 91 ALA CB C 91 18.242 18.570 -0.328 1
1 1048 . 10 1 1 A 91 91 ALA N N 91 122.939 122.320 0.619 1
1 1049 . 10 1 1 A 92 92 SER H H 92 8.858 8.197 0.661 1
1 1050 . 10 1 1 A 92 92 SER HA H 92 4.898 4.133 0.765 1
1 1052 . 10 1 1 A 92 92 SER C C 92 172.440 177.193 -4.753 1
1 1053 . 10 1 1 A 92 92 SER CA C 92 61.913 61.137 0.776 1
1 1054 . 10 1 1 A 92 92 SER CB C 92 63.081 63.187 -0.106 1
1 1055 . 10 1 1 A 92 92 SER N N 92 114.526 112.750 1.776 1
1 1056 . 10 1 1 A 93 93 ARG H H 93 7.704 8.036 -0.332 1
1 1057 . 10 1 1 A 93 93 ARG HA H 93 4.162 4.347 -0.185 1
1 1059 . 10 1 1 A 93 93 ARG C C 93 177.757 178.941 -1.184 1
1 1060 . 10 1 1 A 93 93 ARG CA C 93 59.544 58.968 0.576 1
1 1061 . 10 1 1 A 93 93 ARG CB C 93 30.343 29.845 0.498 1
1 1062 . 10 1 1 A 93 93 ARG N N 93 121.505 121.654 -0.149 1
1 1063 . 10 1 1 A 94 94 LYS H H 94 7.456 7.687 -0.231 1
1 1064 . 10 1 1 A 94 94 LYS HA H 94 4.174 4.157 0.017 1
1 1071 . 10 1 1 A 94 94 LYS C C 94 178.861 178.504 0.357 1
1 1072 . 10 1 1 A 94 94 LYS CA C 94 59.030 59.001 0.029 1
1 1073 . 10 1 1 A 94 94 LYS CB C 94 32.239 31.681 0.558 1
1 1077 . 10 1 1 A 94 94 LYS N N 94 119.072 120.077 -1.005 1
1 1078 . 10 1 1 A 95 95 LEU H H 95 8.148 7.648 0.500 1
1 1079 . 10 1 1 A 95 95 LEU HA H 95 4.129 4.121 0.008 1
1 1088 . 10 1 1 A 95 95 LEU C C 95 177.274 178.557 -1.283 1
1 1089 . 10 1 1 A 95 95 LEU CA C 95 57.136 57.207 -0.071 1
1 1090 . 10 1 1 A 95 95 LEU CB C 95 41.908 42.250 -0.342 1
1 1093 . 10 1 1 A 95 95 LEU N N 95 119.717 120.604 -0.887 1
1 1094 . 10 1 1 A 96 96 GLN H H 96 7.807 8.543 -0.736 1
1 1095 . 10 1 1 A 96 96 GLN HA H 96 4.242 4.363 -0.121 1
1 1102 . 10 1 1 A 96 96 GLN C C 96 175.371 176.542 -1.171 1
1 1103 . 10 1 1 A 96 96 GLN CA C 96 56.397 55.610 0.787 1
1 1104 . 10 1 1 A 96 96 GLN CB C 96 29.123 29.172 -0.049 1
1 1106 . 10 1 1 A 96 96 GLN N N 96 114.581 115.418 -0.837 1
1 1108 . 10 1 1 A 97 97 GLY H H 97 7.802 8.547 -0.745 1
1 1109 . 10 1 1 A 97 97 GLY HA2 H 97 3.839 3.935 -0.096 1
1 1110 . 10 1 1 A 97 97 GLY HA3 H 97 4.096 3.937 0.159 1
1 1111 . 10 1 1 A 97 97 GLY C C 97 172.636 173.690 -1.054 1
1 1112 . 10 1 1 A 97 97 GLY CA C 97 46.372 46.180 0.192 1
1 1113 . 10 1 1 A 97 97 GLY N N 97 106.959 110.308 -3.349 1
1 1114 . 10 1 1 A 98 98 ASP H H 98 8.156 7.532 0.624 1
1 1115 . 10 1 1 A 98 98 ASP HA H 98 4.754 5.031 -0.277 1
1 1118 . 10 1 1 A 98 98 ASP CA C 98 52.882 50.299 2.583 1
1 1119 . 10 1 1 A 98 98 ASP CB C 98 41.603 42.830 -1.227 1
1 1120 . 10 1 1 A 98 98 ASP N N 98 118.447 119.959 -1.512 1
1 1121 . 10 1 1 A 99 99 PRO HA H 99 4.470 4.513 -0.043 1
1 1126 . 10 1 1 A 99 99 PRO C C 99 175.500 176.707 -1.207 1
1 1127 . 10 1 1 A 99 99 PRO CA C 99 63.601 63.943 -0.342 1
1 1128 . 10 1 1 A 99 99 PRO CB C 99 32.423 32.242 0.181 1
1 1130 . 10 1 1 A 100 100 ASP H H 100 8.527 8.518 0.009 1
1 1131 . 10 1 1 A 100 100 ASP HA H 100 4.778 4.884 -0.106 1
1 1134 . 10 1 1 A 100 100 ASP C C 100 174.931 176.259 -1.328 1
1 1135 . 10 1 1 A 100 100 ASP CA C 100 53.915 53.501 0.414 1
1 1136 . 10 1 1 A 100 100 ASP CB C 100 40.665 42.622 -1.957 1
1 1137 . 10 1 1 A 100 100 ASP N N 100 119.340 116.056 3.284 1
1 1138 . 10 1 1 A 101 101 LEU H H 101 7.379 7.895 -0.516 1
1 1139 . 10 1 1 A 101 101 LEU HA H 101 4.682 4.383 0.299 1
1 1148 . 10 1 1 A 101 101 LEU CA C 101 52.956 53.323 -0.367 1
1 1149 . 10 1 1 A 101 101 LEU CB C 101 43.393 42.234 1.159 1
1 1152 . 10 1 1 A 101 101 LEU N N 101 122.107 124.652 -2.545 1
1 1153 . 10 1 1 A 102 102 PRO HA H 102 4.487 4.667 -0.180 1
1 1158 . 10 1 1 A 102 102 PRO C C 102 175.697 175.887 -0.190 1
1 1159 . 10 1 1 A 102 102 PRO CA C 102 63.113 62.808 0.305 1
1 1160 . 10 1 1 A 102 102 PRO CB C 102 32.138 31.797 0.341 1
1 1163 . 10 1 1 A 103 103 MET H H 103 9.011 8.795 0.216 1
1 1164 . 10 1 1 A 103 103 MET HA H 103 4.769 4.950 -0.181 1
1 1171 . 10 1 1 A 103 103 MET C C 103 174.080 174.225 -0.145 1
1 1172 . 10 1 1 A 103 103 MET CA C 103 54.737 53.342 1.395 1
1 1173 . 10 1 1 A 103 103 MET CB C 103 34.857 35.146 -0.289 1
1 1176 . 10 1 1 A 103 103 MET N N 103 123.334 122.908 0.426 1
1 1177 . 10 1 1 A 104 104 SER H H 104 8.239 8.485 -0.246 1
1 1178 . 10 1 1 A 104 104 SER HA H 104 5.079 5.160 -0.081 1
1 1181 . 10 1 1 A 104 104 SER C C 104 171.795 172.808 -1.013 1
1 1182 . 10 1 1 A 104 104 SER CA C 104 57.641 57.566 0.075 1
1 1183 . 10 1 1 A 104 104 SER CB C 104 66.282 67.723 -1.441 1
1 1184 . 10 1 1 A 104 104 SER N N 104 114.434 116.682 -2.248 1
1 1185 . 10 1 1 A 105 105 PHE H H 105 9.003 8.132 0.871 1
1 1186 . 10 1 1 A 105 105 PHE HA H 105 5.209 5.388 -0.179 1
1 1193 . 10 1 1 A 105 105 PHE C C 105 170.688 172.198 -1.510 1
1 1194 . 10 1 1 A 105 105 PHE CA C 105 56.917 55.876 1.041 1
1 1195 . 10 1 1 A 105 105 PHE CB C 105 41.350 41.974 -0.624 1
1 1196 . 10 1 1 A 105 105 PHE N N 105 116.224 118.742 -2.518 1
1 1197 . 10 1 1 A 106 106 THR H H 106 9.074 8.840 0.234 1
1 1198 . 10 1 1 A 106 106 THR HA H 106 4.664 4.920 -0.256 1
1 1203 . 10 1 1 A 106 106 THR C C 106 171.767 174.316 -2.549 1
1 1204 . 10 1 1 A 106 106 THR CA C 106 62.162 61.718 0.444 1
1 1205 . 10 1 1 A 106 106 THR CB C 106 70.072 70.588 -0.516 1
1 1207 . 10 1 1 A 106 106 THR N N 106 117.469 116.235 1.234 1
1 1208 . 10 1 1 A 107 107 LEU H H 107 9.804 9.362 0.442 1
1 1209 . 10 1 1 A 107 107 LEU HA H 107 4.750 4.798 -0.048 1
1 1219 . 10 1 1 A 107 107 LEU C C 107 172.742 175.990 -3.248 1
1 1220 . 10 1 1 A 107 107 LEU CA C 107 54.151 54.515 -0.364 1
1 1221 . 10 1 1 A 107 107 LEU CB C 107 44.486 42.513 1.973 1
1 1224 . 10 1 1 A 107 107 LEU N N 107 133.400 128.076 5.324 1
1 1225 . 10 1 1 A 108 108 ALA H H 108 8.435 8.837 -0.402 1
1 1226 . 10 1 1 A 108 108 ALA HA H 108 4.683 4.550 0.133 1
1 1230 . 10 1 1 A 108 108 ALA C C 108 173.052 175.972 -2.920 1
1 1231 . 10 1 1 A 108 108 ALA CA C 108 49.308 50.752 -1.444 1
1 1232 . 10 1 1 A 108 108 ALA CB C 108 22.120 19.850 2.270 1
1 1233 . 10 1 1 A 108 108 ALA N N 108 131.422 127.020 4.402 1
1 1234 . 10 1 1 A 109 109 ILE H H 109 8.909 8.773 0.136 1
1 1235 . 10 1 1 A 109 109 ILE HA H 109 4.063 4.983 -0.920 1
1 1245 . 10 1 1 A 109 109 ILE CA C 109 60.982 60.272 0.710 1
1 1246 . 10 1 1 A 109 109 ILE CB C 109 39.074 38.585 0.489 1
1 1250 . 10 1 1 A 109 109 ILE N N 109 124.415 123.908 0.507 1
1 1251 . 10 1 1 A 110 110 VAL H H 110 8.706 8.982 -0.276 1
1 1252 . 10 1 1 A 110 110 VAL HA H 110 4.324 5.361 -1.037 1
1 1260 . 10 1 1 A 110 110 VAL C C 110 175.700 175.461 0.239 1
1 1261 . 10 1 1 A 110 110 VAL CA C 110 62.316 59.758 2.558 1
1 1262 . 10 1 1 A 110 110 VAL CB C 110 31.876 34.281 -2.405 1
1 1264 . 10 1 1 A 110 110 VAL N N 110 127.457 127.095 0.362 1
1 1265 . 10 1 1 A 111 111 GLU H H 111 9.024 8.447 0.577 1
1 1266 . 10 1 1 A 111 111 GLU HA H 111 4.403 4.749 -0.346 1
1 1269 . 10 1 1 A 111 111 GLU C C 111 175.987 176.864 -0.877 1
1 1270 . 10 1 1 A 111 111 GLU CA C 111 56.842 54.657 2.185 1
1 1271 . 10 1 1 A 111 111 GLU CB C 111 31.044 30.346 0.698 1
1 1272 . 10 1 1 A 111 111 GLU N N 111 129.768 126.894 2.874 1
1 1273 . 10 1 1 A 112 112 SER H H 112 9.143 8.916 0.227 1
1 1274 . 10 1 1 A 112 112 SER HA H 112 4.394 4.452 -0.058 1
1 1276 . 10 1 1 A 112 112 SER C C 112 173.187 174.939 -1.752 1
1 1277 . 10 1 1 A 112 112 SER CA C 112 60.180 59.713 0.467 1
1 1278 . 10 1 1 A 112 112 SER CB C 112 63.415 62.945 0.470 1
1 1279 . 10 1 1 A 112 112 SER N N 112 115.956 114.732 1.224 1
1 1280 . 10 1 1 A 113 113 ASP H H 113 8.133 7.819 0.314 1
1 1281 . 10 1 1 A 113 113 ASP HA H 113 4.573 4.830 -0.257 1
1 1284 . 10 1 1 A 113 113 ASP C C 113 175.430 175.864 -0.434 1
1 1285 . 10 1 1 A 113 113 ASP CA C 113 54.115 53.809 0.306 1
1 1286 . 10 1 1 A 113 113 ASP CB C 113 40.011 41.003 -0.992 1
1 1287 . 10 1 1 A 113 113 ASP N N 113 118.343 120.414 -2.071 1
1 1288 . 10 1 1 A 114 114 SER H H 114 8.034 8.006 0.028 1
1 1289 . 10 1 1 A 114 114 SER HA H 114 4.057 4.197 -0.140 1
1 1291 . 10 1 1 A 114 114 SER C C 114 172.209 173.541 -1.332 1
1 1292 . 10 1 1 A 114 114 SER CA C 114 60.179 59.603 0.576 1
1 1293 . 10 1 1 A 114 114 SER CB C 114 62.702 61.169 1.533 1
1 1294 . 10 1 1 A 114 114 SER N N 114 109.836 113.269 -3.433 1
1 1295 . 10 1 1 A 115 115 THR H H 115 7.711 8.275 -0.564 1
1 1296 . 10 1 1 A 115 115 THR HA H 115 4.250 4.401 -0.151 1
1 1300 . 10 1 1 A 115 115 THR C C 115 171.500 173.959 -2.459 1
1 1301 . 10 1 1 A 115 115 THR CA C 115 63.547 62.428 1.119 1
1 1302 . 10 1 1 A 115 115 THR CB C 115 69.595 69.784 -0.189 1
1 1303 . 10 1 1 A 115 115 THR N N 115 117.407 115.347 2.060 1
1 1304 . 10 1 1 A 116 116 ILE H H 116 8.219 9.143 -0.924 1
1 1305 . 10 1 1 A 116 116 ILE HA H 116 4.769 5.008 -0.239 1
1 1315 . 10 1 1 A 116 116 ILE C C 116 174.434 174.737 -0.303 1
1 1316 . 10 1 1 A 116 116 ILE CA C 116 60.306 59.276 1.030 1
1 1317 . 10 1 1 A 116 116 ILE CB C 116 40.686 38.659 2.027 1
1 1321 . 10 1 1 A 116 116 ILE N N 116 125.480 127.668 -2.188 1
1 1322 . 10 1 1 A 117 117 VAL H H 117 8.695 9.411 -0.716 1
1 1323 . 10 1 1 A 117 117 VAL HA H 117 4.315 4.637 -0.322 1
1 1328 . 10 1 1 A 117 117 VAL C C 117 172.243 174.556 -2.313 1
1 1329 . 10 1 1 A 117 117 VAL CA C 117 60.621 60.998 -0.377 1
1 1330 . 10 1 1 A 117 117 VAL CB C 117 34.558 33.470 1.088 1
1 1332 . 10 1 1 A 117 117 VAL N N 117 127.887 127.119 0.768 1
1 1333 . 10 1 1 A 118 118 TYR H H 118 8.270 8.865 -0.595 1
1 1334 . 10 1 1 A 118 118 TYR HA H 118 5.327 5.320 0.007 1
1 1342 . 10 1 1 A 118 118 TYR C C 118 174.250 175.047 -0.797 1
1 1343 . 10 1 1 A 118 118 TYR CA C 118 57.283 56.962 0.321 1
1 1344 . 10 1 1 A 118 118 TYR CB C 118 39.262 39.735 -0.473 1
1 1345 . 10 1 1 A 118 118 TYR N N 118 124.822 126.944 -2.122 1
1 1346 . 10 1 1 A 119 119 TYR H H 119 9.207 8.717 0.490 1
1 1347 . 10 1 1 A 119 119 TYR HA H 119 4.821 5.097 -0.276 1
1 1354 . 10 1 1 A 119 119 TYR C C 119 171.994 173.764 -1.770 1
1 1355 . 10 1 1 A 119 119 TYR CA C 119 58.116 57.701 0.415 1
1 1356 . 10 1 1 A 119 119 TYR CB C 119 43.544 42.148 1.396 1
1 1357 . 10 1 1 A 119 119 TYR N N 119 125.153 124.032 1.121 1
1 1358 . 10 1 1 A 120 120 LYS H H 120 7.700 8.237 -0.537 1
1 1359 . 10 1 1 A 120 120 LYS HA H 120 4.558 5.003 -0.445 1
1 1366 . 10 1 1 A 120 120 LYS C C 120 172.017 175.570 -3.553 1
1 1367 . 10 1 1 A 120 120 LYS CA C 120 57.217 54.514 2.703 1
1 1368 . 10 1 1 A 120 120 LYS CB C 120 33.914 34.807 -0.893 1
1 1372 . 10 1 1 A 120 120 LYS N N 120 129.442 126.694 2.748 1
1 1373 . 10 1 1 A 121 121 LEU H H 121 8.112 8.223 -0.111 1
1 1374 . 10 1 1 A 121 121 LEU HA H 121 5.323 4.905 0.418 1
1 1384 . 10 1 1 A 121 121 LEU C C 121 175.733 175.396 0.337 1
1 1385 . 10 1 1 A 121 121 LEU CA C 121 52.716 52.760 -0.044 1
1 1386 . 10 1 1 A 121 121 LEU CB C 121 44.098 45.486 -1.388 1
1 1389 . 10 1 1 A 121 121 LEU N N 121 123.403 118.795 4.608 1
1 1390 . 10 1 1 A 122 122 THR H H 122 8.338 8.771 -0.433 1
1 1391 . 10 1 1 A 122 122 THR HA H 122 5.097 5.195 -0.098 1
1 1396 . 10 1 1 A 122 122 THR C C 122 173.221 173.053 0.168 1
1 1397 . 10 1 1 A 122 122 THR CA C 122 60.306 59.779 0.527 1
1 1398 . 10 1 1 A 122 122 THR CB C 122 72.473 71.646 0.827 1
1 1400 . 10 1 1 A 122 122 THR N N 122 109.081 113.138 -4.057 1
1 7 . 11 1 1 A 2 2 GLU H H 2 8.994 8.186 0.808 1
1 8 . 11 1 1 A 2 2 GLU HA H 2 4.278 4.478 -0.200 1
1 13 . 11 1 1 A 2 2 GLU C C 2 175.315 176.273 -0.958 1
1 14 . 11 1 1 A 2 2 GLU CA C 2 57.318 58.515 -1.197 1
1 15 . 11 1 1 A 2 2 GLU CB C 2 29.221 31.013 -1.792 1
1 17 . 11 1 1 A 2 2 GLU N N 2 122.259 118.185 4.074 1
1 18 . 11 1 1 A 3 3 ASP H H 3 8.048 8.038 0.010 1
1 19 . 11 1 1 A 3 3 ASP HA H 3 4.580 4.804 -0.224 1
1 21 . 11 1 1 A 3 3 ASP C C 3 175.636 175.296 0.340 1
1 22 . 11 1 1 A 3 3 ASP CA C 3 54.579 53.829 0.750 1
1 23 . 11 1 1 A 3 3 ASP CB C 3 40.984 40.998 -0.014 1
1 24 . 11 1 1 A 3 3 ASP N N 3 119.830 117.285 2.545 1
1 25 . 11 1 1 A 4 4 ALA H H 4 8.090 7.878 0.212 1
1 26 . 11 1 1 A 4 4 ALA HA H 4 4.216 4.717 -0.501 1
1 30 . 11 1 1 A 4 4 ALA C C 4 177.157 176.101 1.056 1
1 31 . 11 1 1 A 4 4 ALA CA C 4 53.620 52.095 1.525 1
1 32 . 11 1 1 A 4 4 ALA CB C 4 18.728 19.726 -0.998 1
1 33 . 11 1 1 A 4 4 ALA N N 4 123.957 124.995 -1.038 1
1 34 . 11 1 1 A 5 5 TRP H H 5 7.941 9.023 -1.082 1
1 35 . 11 1 1 A 5 5 TRP HA H 5 4.559 4.881 -0.322 1
1 39 . 11 1 1 A 5 5 TRP C C 5 176.072 176.298 -0.226 1
1 40 . 11 1 1 A 5 5 TRP CA C 5 57.744 58.307 -0.563 1
1 41 . 11 1 1 A 5 5 TRP CB C 5 28.906 31.927 -3.021 1
1 42 . 11 1 1 A 5 5 TRP N N 5 118.408 123.723 -5.315 1
1 44 . 11 1 1 A 6 6 MET H H 6 7.679 8.424 -0.745 1
1 45 . 11 1 1 A 6 6 MET HA H 6 3.785 5.092 -1.307 1
1 52 . 11 1 1 A 6 6 MET C C 6 175.174 175.298 -0.124 1
1 53 . 11 1 1 A 6 6 MET CA C 6 57.724 54.250 3.474 1
1 54 . 11 1 1 A 6 6 MET CB C 6 31.640 35.220 -3.580 1
1 57 . 11 1 1 A 6 6 MET N N 6 121.538 116.220 5.318 1
1 58 . 11 1 1 A 7 7 GLY H H 7 7.247 8.470 -1.223 1
1 59 . 11 1 1 A 7 7 GLY HA2 H 7 3.455 3.709 -0.254 1
1 60 . 11 1 1 A 7 7 GLY HA3 H 7 3.578 3.890 -0.312 1
1 61 . 11 1 1 A 7 7 GLY C C 7 172.852 174.648 -1.796 1
1 62 . 11 1 1 A 7 7 GLY CA C 7 45.896 45.277 0.619 1
1 63 . 11 1 1 A 7 7 GLY N N 7 104.055 111.662 -7.607 1
1 64 . 11 1 1 A 8 8 THR H H 8 7.436 8.550 -1.114 1
1 65 . 11 1 1 A 8 8 THR HA H 8 4.428 4.206 0.222 1
1 70 . 11 1 1 A 8 8 THR C C 8 172.973 173.504 -0.531 1
1 71 . 11 1 1 A 8 8 THR CA C 8 60.751 63.570 -2.819 1
1 72 . 11 1 1 A 8 8 THR CB C 8 69.637 66.676 2.961 1
1 74 . 11 1 1 A 8 8 THR N N 8 107.669 115.076 -7.407 1
1 75 . 11 1 1 A 9 9 HIS H H 9 8.048 8.016 0.032 1
1 76 . 11 1 1 A 9 9 HIS HA H 9 4.654 4.870 -0.216 1
1 79 . 11 1 1 A 9 9 HIS CA C 9 56.163 54.197 1.966 1
1 80 . 11 1 1 A 9 9 HIS CB C 9 32.619 30.073 2.546 1
1 81 . 11 1 1 A 9 9 HIS N N 9 127.281 121.980 5.301 1
1 82 . 11 1 1 A 10 10 PRO HA H 10 4.257 4.254 0.003 1
1 88 . 11 1 1 A 10 10 PRO C C 10 178.779 179.108 -0.329 1
1 89 . 11 1 1 A 10 10 PRO CA C 10 65.565 65.989 -0.424 1
1 90 . 11 1 1 A 10 10 PRO CB C 10 32.422 31.993 0.429 1
1 93 . 11 1 1 A 11 11 LYS H H 11 10.994 8.551 2.443 1
1 94 . 11 1 1 A 11 11 LYS HA H 11 4.282 4.182 0.100 1
1 100 . 11 1 1 A 11 11 LYS C C 11 177.279 178.765 -1.486 1
1 101 . 11 1 1 A 11 11 LYS CA C 11 56.859 59.558 -2.699 1
1 102 . 11 1 1 A 11 11 LYS CB C 11 31.279 32.257 -0.978 1
1 104 . 11 1 1 A 11 11 LYS N N 11 121.398 118.313 3.085 1
1 105 . 11 1 1 A 12 12 TYR H H 12 7.146 8.510 -1.364 1
1 106 . 11 1 1 A 12 12 TYR HA H 12 3.722 4.206 -0.484 1
1 113 . 11 1 1 A 12 12 TYR C C 12 176.265 177.522 -1.257 1
1 114 . 11 1 1 A 12 12 TYR CA C 12 61.189 61.767 -0.578 1
1 115 . 11 1 1 A 12 12 TYR CB C 12 37.796 38.099 -0.303 1
1 116 . 11 1 1 A 12 12 TYR N N 12 121.579 122.018 -0.439 1
1 117 . 11 1 1 A 13 13 LEU H H 13 7.778 8.910 -1.132 1
1 118 . 11 1 1 A 13 13 LEU HA H 13 3.773 3.930 -0.157 1
1 127 . 11 1 1 A 13 13 LEU C C 13 178.462 178.427 0.035 1
1 128 . 11 1 1 A 13 13 LEU CA C 13 57.942 58.115 -0.173 1
1 129 . 11 1 1 A 13 13 LEU CB C 13 41.064 41.477 -0.413 1
1 132 . 11 1 1 A 13 13 LEU N N 13 117.518 121.301 -3.783 1
1 133 . 11 1 1 A 14 14 GLU H H 14 7.867 8.786 -0.919 1
1 134 . 11 1 1 A 14 14 GLU HA H 14 3.935 3.946 -0.011 1
1 139 . 11 1 1 A 14 14 GLU C C 14 178.326 178.604 -0.278 1
1 140 . 11 1 1 A 14 14 GLU CA C 14 59.368 59.733 -0.365 1
1 141 . 11 1 1 A 14 14 GLU CB C 14 30.147 29.150 0.997 1
1 143 . 11 1 1 A 14 14 GLU N N 14 119.135 119.322 -0.187 1
1 144 . 11 1 1 A 15 15 MET H H 15 7.773 7.674 0.099 1
1 145 . 11 1 1 A 15 15 MET HA H 15 3.936 4.106 -0.170 1
1 152 . 11 1 1 A 15 15 MET C C 15 177.886 178.152 -0.266 1
1 153 . 11 1 1 A 15 15 MET CA C 15 59.465 58.123 1.342 1
1 154 . 11 1 1 A 15 15 MET CB C 15 33.987 32.133 1.854 1
1 157 . 11 1 1 A 15 15 MET N N 15 117.884 119.375 -1.491 1
1 158 . 11 1 1 A 16 16 MET H H 16 8.145 8.111 0.034 1
1 159 . 11 1 1 A 16 16 MET HA H 16 4.159 4.144 0.015 1
1 166 . 11 1 1 A 16 16 MET C C 16 177.835 178.476 -0.641 1
1 167 . 11 1 1 A 16 16 MET CA C 16 57.397 57.183 0.214 1
1 168 . 11 1 1 A 16 16 MET CB C 16 31.867 31.182 0.685 1
1 171 . 11 1 1 A 16 16 MET N N 16 119.555 117.640 1.915 1
1 172 . 11 1 1 A 17 17 GLU H H 17 7.761 7.762 -0.001 1
1 173 . 11 1 1 A 17 17 GLU HA H 17 4.117 4.201 -0.084 1
1 176 . 11 1 1 A 17 17 GLU C C 17 175.994 177.013 -1.019 1
1 177 . 11 1 1 A 17 17 GLU CA C 17 57.392 58.132 -0.740 1
1 178 . 11 1 1 A 17 17 GLU CB C 17 29.432 29.489 -0.057 1
1 180 . 11 1 1 A 17 17 GLU N N 17 118.216 117.190 1.026 1
1 181 . 11 1 1 A 18 18 LEU H H 18 7.201 7.353 -0.152 1
1 182 . 11 1 1 A 18 18 LEU HA H 18 4.111 4.195 -0.084 1
1 191 . 11 1 1 A 18 18 LEU C C 18 175.781 175.804 -0.023 1
1 192 . 11 1 1 A 18 18 LEU CA C 18 56.366 54.946 1.420 1
1 193 . 11 1 1 A 18 18 LEU CB C 18 42.030 42.090 -0.060 1
1 196 . 11 1 1 A 18 18 LEU N N 18 117.448 121.980 -4.532 1
1 197 . 11 1 1 A 19 19 ASP H H 19 7.789 8.638 -0.849 1
1 198 . 11 1 1 A 19 19 ASP HA H 19 4.360 5.098 -0.738 1
1 201 . 11 1 1 A 19 19 ASP C C 19 173.765 175.728 -1.963 1
1 202 . 11 1 1 A 19 19 ASP CA C 19 54.851 53.011 1.840 1
1 203 . 11 1 1 A 19 19 ASP CB C 19 39.115 40.630 -1.515 1
1 204 . 11 1 1 A 19 19 ASP N N 19 115.844 123.867 -8.023 1
1 205 . 11 1 1 A 20 20 ILE H H 20 8.142 8.700 -0.558 1
1 206 . 11 1 1 A 20 20 ILE HA H 20 4.128 4.323 -0.195 1
1 216 . 11 1 1 A 20 20 ILE C C 20 174.710 176.955 -2.245 1
1 217 . 11 1 1 A 20 20 ILE CA C 20 60.465 62.077 -1.612 1
1 218 . 11 1 1 A 20 20 ILE CB C 20 40.407 39.550 0.857 1
1 222 . 11 1 1 A 20 20 ILE N N 20 117.287 124.014 -6.727 1
1 223 . 11 1 1 A 21 21 GLY H H 21 8.207 8.304 -0.097 1
1 224 . 11 1 1 A 21 21 GLY HA2 H 21 3.889 4.013 -0.124 1
1 225 . 11 1 1 A 21 21 GLY HA3 H 21 3.924 4.019 -0.095 1
1 226 . 11 1 1 A 21 21 GLY C C 21 172.162 173.651 -1.489 1
1 227 . 11 1 1 A 21 21 GLY CA C 21 45.017 45.481 -0.464 1
1 228 . 11 1 1 A 21 21 GLY N N 21 110.656 109.630 1.026 1
1 229 . 11 1 1 A 22 22 ASP H H 22 7.727 7.971 -0.244 1
1 230 . 11 1 1 A 22 22 ASP HA H 22 4.794 4.938 -0.144 1
1 233 . 11 1 1 A 22 22 ASP C C 22 174.884 175.895 -1.011 1
1 234 . 11 1 1 A 22 22 ASP CA C 22 52.471 52.765 -0.294 1
1 235 . 11 1 1 A 22 22 ASP CB C 22 42.069 42.365 -0.296 1
1 236 . 11 1 1 A 22 22 ASP N N 22 119.305 119.961 -0.656 1
1 237 . 11 1 1 A 23 23 ALA H H 23 8.644 9.028 -0.384 1
1 238 . 11 1 1 A 23 23 ALA HA H 23 4.120 4.057 0.063 1
1 242 . 11 1 1 A 23 23 ALA C C 23 179.546 179.703 -0.157 1
1 243 . 11 1 1 A 23 23 ALA CA C 23 55.609 55.011 0.598 1
1 244 . 11 1 1 A 23 23 ALA CB C 23 18.573 18.558 0.015 1
1 245 . 11 1 1 A 23 23 ALA N N 23 122.468 128.158 -5.690 1
1 246 . 11 1 1 A 24 24 THR H H 24 8.238 7.941 0.297 1
1 247 . 11 1 1 A 24 24 THR HA H 24 4.184 4.049 0.135 1
1 252 . 11 1 1 A 24 24 THR C C 24 174.841 176.906 -2.065 1
1 253 . 11 1 1 A 24 24 THR CA C 24 66.241 66.517 -0.276 1
1 254 . 11 1 1 A 24 24 THR CB C 24 68.376 68.243 0.133 1
1 256 . 11 1 1 A 24 24 THR N N 24 114.824 114.291 0.533 1
1 257 . 11 1 1 A 25 25 GLN H H 25 8.037 8.612 -0.575 1
1 258 . 11 1 1 A 25 25 GLN HA H 25 4.095 4.058 0.037 1
1 265 . 11 1 1 A 25 25 GLN C C 25 177.603 178.639 -1.036 1
1 266 . 11 1 1 A 25 25 GLN CA C 25 59.261 58.821 0.440 1
1 267 . 11 1 1 A 25 25 GLN CB C 25 28.437 28.309 0.128 1
1 269 . 11 1 1 A 25 25 GLN N N 25 122.518 120.166 2.352 1
1 271 . 11 1 1 A 26 26 VAL H H 26 7.994 7.856 0.138 1
1 272 . 11 1 1 A 26 26 VAL HA H 26 3.469 3.908 -0.439 1
1 280 . 11 1 1 A 26 26 VAL C C 26 175.552 177.980 -2.428 1
1 281 . 11 1 1 A 26 26 VAL CA C 26 66.909 65.915 0.994 1
1 282 . 11 1 1 A 26 26 VAL CB C 26 31.582 31.428 0.154 1
1 285 . 11 1 1 A 26 26 VAL N N 26 119.112 116.960 2.152 1
1 286 . 11 1 1 A 27 27 TYR H H 27 8.003 8.204 -0.201 1
1 287 . 11 1 1 A 27 27 TYR HA H 27 4.357 4.482 -0.125 1
1 294 . 11 1 1 A 27 27 TYR C C 27 175.856 177.122 -1.266 1
1 295 . 11 1 1 A 27 27 TYR CA C 27 62.197 61.806 0.391 1
1 296 . 11 1 1 A 27 27 TYR CB C 27 38.394 38.931 -0.537 1
1 297 . 11 1 1 A 27 27 TYR N N 27 119.170 124.720 -5.550 1
1 298 . 11 1 1 A 28 28 VAL H H 28 8.087 8.566 -0.479 1
1 299 . 11 1 1 A 28 28 VAL HA H 28 3.652 3.481 0.171 1
1 307 . 11 1 1 A 28 28 VAL C C 28 176.134 177.884 -1.750 1
1 308 . 11 1 1 A 28 28 VAL CA C 28 66.247 66.274 -0.027 1
1 309 . 11 1 1 A 28 28 VAL CB C 28 31.241 31.464 -0.223 1
1 312 . 11 1 1 A 28 28 VAL N N 28 113.112 119.456 -6.344 1
1 313 . 11 1 1 A 29 29 ALA H H 29 7.853 8.919 -1.066 1
1 314 . 11 1 1 A 29 29 ALA HA H 29 3.913 4.101 -0.188 1
1 318 . 11 1 1 A 29 29 ALA C C 29 177.850 179.137 -1.287 1
1 319 . 11 1 1 A 29 29 ALA CA C 29 55.274 55.020 0.254 1
1 320 . 11 1 1 A 29 29 ALA CB C 29 17.876 18.513 -0.637 1
1 321 . 11 1 1 A 29 29 ALA N N 29 121.350 122.455 -1.105 1
1 322 . 11 1 1 A 30 30 PHE H H 30 8.724 8.296 0.428 1
1 323 . 11 1 1 A 30 30 PHE HA H 30 4.098 4.279 -0.181 1
1 327 . 11 1 1 A 30 30 PHE C C 30 175.035 177.030 -1.995 1
1 328 . 11 1 1 A 30 30 PHE CA C 30 61.264 61.619 -0.355 1
1 329 . 11 1 1 A 30 30 PHE CB C 30 38.926 39.423 -0.497 1
1 330 . 11 1 1 A 30 30 PHE N N 30 120.478 119.939 0.539 1
1 331 . 11 1 1 A 31 31 LEU H H 31 8.146 8.166 -0.020 1
1 332 . 11 1 1 A 31 31 LEU HA H 31 3.597 3.673 -0.076 1
1 341 . 11 1 1 A 31 31 LEU C C 31 179.508 179.462 0.046 1
1 342 . 11 1 1 A 31 31 LEU CA C 31 57.884 58.018 -0.134 1
1 343 . 11 1 1 A 31 31 LEU CB C 31 41.829 41.907 -0.078 1
1 346 . 11 1 1 A 31 31 LEU N N 31 118.427 120.273 -1.846 1
1 347 . 11 1 1 A 32 32 VAL H H 32 7.627 7.713 -0.086 1
1 348 . 11 1 1 A 32 32 VAL HA H 32 3.464 3.901 -0.437 1
1 356 . 11 1 1 A 32 32 VAL C C 32 174.956 177.870 -2.914 1
1 357 . 11 1 1 A 32 32 VAL CA C 32 66.373 65.838 0.535 1
1 358 . 11 1 1 A 32 32 VAL CB C 32 31.121 31.533 -0.412 1
1 361 . 11 1 1 A 32 32 VAL N N 32 119.497 114.787 4.710 1
1 362 . 11 1 1 A 33 33 TYR H H 33 8.366 8.786 -0.420 1
1 363 . 11 1 1 A 33 33 TYR HA H 33 3.485 4.094 -0.609 1
1 370 . 11 1 1 A 33 33 TYR C C 33 174.883 176.925 -2.042 1
1 371 . 11 1 1 A 33 33 TYR CA C 33 62.866 61.408 1.458 1
1 372 . 11 1 1 A 33 33 TYR CB C 33 37.778 38.340 -0.562 1
1 373 . 11 1 1 A 33 33 TYR N N 33 121.842 124.305 -2.463 1
1 374 . 11 1 1 A 34 34 LEU H H 34 8.000 8.609 -0.609 1
1 375 . 11 1 1 A 34 34 LEU HA H 34 3.495 3.665 -0.170 1
1 385 . 11 1 1 A 34 34 LEU C C 34 178.240 179.125 -0.885 1
1 386 . 11 1 1 A 34 34 LEU CA C 34 57.453 57.317 0.136 1
1 387 . 11 1 1 A 34 34 LEU CB C 34 41.828 41.030 0.798 1
1 390 . 11 1 1 A 34 34 LEU N N 34 116.692 119.682 -2.990 1
1 391 . 11 1 1 A 35 35 ASP H H 35 7.688 8.042 -0.354 1
1 392 . 11 1 1 A 35 35 ASP HA H 35 4.302 4.328 -0.026 1
1 395 . 11 1 1 A 35 35 ASP C C 35 177.507 178.660 -1.153 1
1 396 . 11 1 1 A 35 35 ASP CA C 35 58.196 57.690 0.506 1
1 397 . 11 1 1 A 35 35 ASP CB C 35 43.070 41.397 1.673 1
1 398 . 11 1 1 A 35 35 ASP N N 35 120.507 120.066 0.441 1
1 399 . 11 1 1 A 36 36 LEU H H 36 8.482 8.609 -0.127 1
1 400 . 11 1 1 A 36 36 LEU HA H 36 3.328 3.930 -0.602 1
1 410 . 11 1 1 A 36 36 LEU C C 36 176.774 179.103 -2.329 1
1 411 . 11 1 1 A 36 36 LEU CA C 36 57.461 57.913 -0.452 1
1 412 . 11 1 1 A 36 36 LEU CB C 36 41.344 41.666 -0.322 1
1 416 . 11 1 1 A 36 36 LEU N N 36 117.671 121.247 -3.576 1
1 417 . 11 1 1 A 37 37 MET H H 37 7.822 8.112 -0.290 1
1 418 . 11 1 1 A 37 37 MET HA H 37 4.401 4.099 0.302 1
1 425 . 11 1 1 A 37 37 MET C C 37 177.862 177.872 -0.010 1
1 426 . 11 1 1 A 37 37 MET CA C 37 56.434 57.842 -1.408 1
1 427 . 11 1 1 A 37 37 MET CB C 37 31.573 32.164 -0.591 1
1 430 . 11 1 1 A 37 37 MET N N 37 112.952 118.279 -5.327 1
1 431 . 11 1 1 A 38 38 GLU H H 38 8.667 8.247 0.420 1
1 432 . 11 1 1 A 38 38 GLU HA H 38 4.457 4.154 0.303 1
1 436 . 11 1 1 A 38 38 GLU C C 38 176.582 177.194 -0.612 1
1 437 . 11 1 1 A 38 38 GLU CA C 38 57.659 58.168 -0.509 1
1 438 . 11 1 1 A 38 38 GLU CB C 38 29.936 30.296 -0.360 1
1 440 . 11 1 1 A 38 38 GLU N N 38 116.463 118.664 -2.201 1
1 441 . 11 1 1 A 39 39 SER H H 39 7.657 7.741 -0.084 1
1 442 . 11 1 1 A 39 39 SER HA H 39 4.658 4.431 0.227 1
1 445 . 11 1 1 A 39 39 SER C C 39 175.661 175.397 0.264 1
1 446 . 11 1 1 A 39 39 SER CA C 39 60.449 60.457 -0.008 1
1 447 . 11 1 1 A 39 39 SER CB C 39 63.341 64.570 -1.229 1
1 448 . 11 1 1 A 39 39 SER N N 39 113.870 113.625 0.245 1
1 449 . 11 1 1 A 40 40 LYS H H 40 8.165 7.500 0.665 1
1 450 . 11 1 1 A 40 40 LYS HA H 40 4.454 3.966 0.488 1
1 458 . 11 1 1 A 40 40 LYS C C 40 174.970 175.751 -0.781 1
1 459 . 11 1 1 A 40 40 LYS CA C 40 55.753 55.788 -0.035 1
1 460 . 11 1 1 A 40 40 LYS CB C 40 32.337 32.435 -0.098 1
1 464 . 11 1 1 A 40 40 LYS N N 40 116.671 118.682 -2.011 1
1 465 . 11 1 1 A 41 41 SER H H 41 7.017 7.839 -0.822 1
1 466 . 11 1 1 A 41 41 SER HA H 41 4.209 4.216 -0.007 1
1 469 . 11 1 1 A 41 41 SER C C 41 173.770 173.093 0.677 1
1 470 . 11 1 1 A 41 41 SER CA C 41 58.435 58.838 -0.403 1
1 471 . 11 1 1 A 41 41 SER CB C 41 61.700 61.394 0.306 1
1 472 . 11 1 1 A 41 41 SER N N 41 109.989 114.275 -4.286 1
1 473 . 11 1 1 A 42 42 TRP H H 42 8.876 7.957 0.919 1
1 474 . 11 1 1 A 42 42 TRP HA H 42 4.698 4.744 -0.046 1
1 478 . 11 1 1 A 42 42 TRP C C 42 174.477 177.534 -3.057 1
1 479 . 11 1 1 A 42 42 TRP CA C 42 59.443 56.815 2.628 1
1 480 . 11 1 1 A 42 42 TRP CB C 42 28.203 30.913 -2.710 1
1 481 . 11 1 1 A 42 42 TRP N N 42 121.116 124.031 -2.915 1
1 483 . 11 1 1 A 43 43 HIS H H 43 8.132 8.466 -0.334 1
1 484 . 11 1 1 A 43 43 HIS HA H 43 4.445 4.368 0.077 1
1 488 . 11 1 1 A 43 43 HIS C C 43 174.405 174.358 0.047 1
1 489 . 11 1 1 A 43 43 HIS CA C 43 58.556 59.824 -1.268 1
1 490 . 11 1 1 A 43 43 HIS CB C 43 29.430 30.139 -0.709 1
1 491 . 11 1 1 A 43 43 HIS N N 43 119.397 122.504 -3.107 1
1 492 . 11 1 1 A 44 44 GLU H H 44 8.140 7.567 0.573 1
1 493 . 11 1 1 A 44 44 GLU HA H 44 4.432 4.712 -0.280 1
1 497 . 11 1 1 A 44 44 GLU C C 44 173.010 174.408 -1.398 1
1 498 . 11 1 1 A 44 44 GLU CA C 44 56.421 55.805 0.616 1
1 499 . 11 1 1 A 44 44 GLU CB C 44 33.285 33.251 0.034 1
1 501 . 11 1 1 A 44 44 GLU N N 44 116.181 117.920 -1.739 1
1 502 . 11 1 1 A 45 45 VAL H H 45 8.428 8.674 -0.246 1
1 503 . 11 1 1 A 45 45 VAL HA H 45 4.492 4.842 -0.350 1
1 511 . 11 1 1 A 45 45 VAL C C 45 172.339 174.816 -2.477 1
1 512 . 11 1 1 A 45 45 VAL CA C 45 63.071 60.719 2.352 1
1 513 . 11 1 1 A 45 45 VAL CB C 45 35.145 35.842 -0.697 1
1 516 . 11 1 1 A 45 45 VAL N N 45 123.272 126.303 -3.031 1
1 517 . 11 1 1 A 46 46 ASN H H 46 9.050 9.022 0.028 1
1 518 . 11 1 1 A 46 46 ASN HA H 46 5.261 5.431 -0.170 1
1 523 . 11 1 1 A 46 46 ASN C C 46 172.845 173.312 -0.467 1
1 524 . 11 1 1 A 46 46 ASN CA C 46 51.895 51.516 0.379 1
1 525 . 11 1 1 A 46 46 ASN CB C 46 42.322 42.968 -0.646 1
1 526 . 11 1 1 A 46 46 ASN N N 46 123.901 123.992 -0.091 1
1 528 . 11 1 1 A 47 47 CYS H H 47 9.039 8.924 0.115 1
1 529 . 11 1 1 A 47 47 CYS HA H 47 5.160 5.294 -0.134 1
1 532 . 11 1 1 A 47 47 CYS C C 47 172.454 173.749 -1.295 1
1 533 . 11 1 1 A 47 47 CYS CA C 47 56.473 57.164 -0.691 1
1 534 . 11 1 1 A 47 47 CYS CB C 47 29.297 29.053 0.244 1
1 535 . 11 1 1 A 47 47 CYS N N 47 119.663 119.554 0.109 1
1 536 . 11 1 1 A 48 48 VAL H H 48 9.083 9.321 -0.238 1
1 537 . 11 1 1 A 48 48 VAL HA H 48 4.344 4.687 -0.343 1
1 542 . 11 1 1 A 48 48 VAL C C 48 173.307 174.985 -1.678 1
1 543 . 11 1 1 A 48 48 VAL CA C 48 61.368 60.773 0.595 1
1 544 . 11 1 1 A 48 48 VAL CB C 48 35.345 34.901 0.444 1
1 546 . 11 1 1 A 48 48 VAL N N 48 124.672 125.042 -0.370 1
1 547 . 11 1 1 A 49 49 GLY H H 49 9.019 9.066 -0.047 1
1 548 . 11 1 1 A 49 49 GLY HA2 H 49 3.460 4.165 -0.705 1
1 549 . 11 1 1 A 49 49 GLY HA3 H 49 4.539 4.169 0.370 1
1 550 . 11 1 1 A 49 49 GLY C C 49 171.278 172.393 -1.115 1
1 551 . 11 1 1 A 49 49 GLY CA C 49 45.075 44.526 0.549 1
1 552 . 11 1 1 A 49 49 GLY N N 49 113.131 115.842 -2.711 1
1 553 . 11 1 1 A 50 50 LEU H H 50 8.747 9.374 -0.627 1
1 554 . 11 1 1 A 50 50 LEU HA H 50 5.102 4.994 0.108 1
1 564 . 11 1 1 A 50 50 LEU CA C 50 51.417 51.346 0.071 1
1 565 . 11 1 1 A 50 50 LEU CB C 50 41.754 42.075 -0.321 1
1 569 . 11 1 1 A 50 50 LEU N N 50 124.471 126.590 -2.119 1
1 570 . 11 1 1 A 51 51 PRO HA H 51 4.106 4.275 -0.169 1
1 577 . 11 1 1 A 51 51 PRO C C 51 178.422 177.963 0.459 1
1 578 . 11 1 1 A 51 51 PRO CA C 51 65.680 64.683 0.997 1
1 579 . 11 1 1 A 51 51 PRO CB C 51 31.939 32.060 -0.121 1
1 582 . 11 1 1 A 52 52 GLU H H 52 9.721 8.299 1.422 1
1 583 . 11 1 1 A 52 52 GLU HA H 52 4.176 4.131 0.045 1
1 588 . 11 1 1 A 52 52 GLU C C 52 176.146 178.016 -1.870 1
1 589 . 11 1 1 A 52 52 GLU CA C 52 59.158 59.411 -0.253 1
1 590 . 11 1 1 A 52 52 GLU CB C 52 28.442 29.543 -1.101 1
1 592 . 11 1 1 A 52 52 GLU N N 52 118.552 118.060 0.492 1
1 593 . 11 1 1 A 53 53 LEU H H 53 7.089 7.804 -0.715 1
1 594 . 11 1 1 A 53 53 LEU HA H 53 4.511 4.313 0.198 1
1 603 . 11 1 1 A 53 53 LEU C C 53 174.027 176.162 -2.135 1
1 604 . 11 1 1 A 53 53 LEU CA C 53 53.825 54.741 -0.916 1
1 605 . 11 1 1 A 53 53 LEU CB C 53 43.825 41.731 2.094 1
1 608 . 11 1 1 A 53 53 LEU N N 53 116.763 118.108 -1.345 1
1 609 . 11 1 1 A 54 54 GLN H H 54 7.964 7.990 -0.026 1
1 610 . 11 1 1 A 54 54 GLN HA H 54 3.591 3.952 -0.361 1
1 616 . 11 1 1 A 54 54 GLN C C 54 172.604 174.405 -1.801 1
1 617 . 11 1 1 A 54 54 GLN CA C 54 56.961 56.703 0.258 1
1 618 . 11 1 1 A 54 54 GLN CB C 54 26.545 27.353 -0.808 1
1 620 . 11 1 1 A 54 54 GLN N N 54 115.489 119.036 -3.547 1
1 622 . 11 1 1 A 55 55 LEU H H 55 7.139 7.451 -0.312 1
1 623 . 11 1 1 A 55 55 LEU HA H 55 4.750 5.084 -0.334 1
1 629 . 11 1 1 A 55 55 LEU C C 55 173.475 174.857 -1.382 1
1 630 . 11 1 1 A 55 55 LEU CA C 55 53.698 53.010 0.688 1
1 631 . 11 1 1 A 55 55 LEU CB C 55 47.859 46.222 1.637 1
1 633 . 11 1 1 A 55 55 LEU N N 55 116.422 114.893 1.529 1
1 634 . 11 1 1 A 56 56 ILE H H 56 8.223 8.504 -0.281 1
1 635 . 11 1 1 A 56 56 ILE HA H 56 4.540 5.093 -0.553 1
1 643 . 11 1 1 A 56 56 ILE C C 56 173.938 174.662 -0.724 1
1 644 . 11 1 1 A 56 56 ILE CA C 56 61.020 59.910 1.110 1
1 645 . 11 1 1 A 56 56 ILE CB C 56 39.403 40.549 -1.146 1
1 648 . 11 1 1 A 56 56 ILE N N 56 122.792 120.510 2.282 1
1 649 . 11 1 1 A 57 57 CYS H H 57 8.995 9.218 -0.223 1
1 650 . 11 1 1 A 57 57 CYS HA H 57 5.036 5.145 -0.109 1
1 653 . 11 1 1 A 57 57 CYS C C 57 170.483 173.142 -2.659 1
1 654 . 11 1 1 A 57 57 CYS CA C 57 56.484 58.091 -1.607 1
1 655 . 11 1 1 A 57 57 CYS CB C 57 30.545 31.289 -0.744 1
1 656 . 11 1 1 A 57 57 CYS N N 57 121.575 125.713 -4.138 1
1 657 . 11 1 1 A 58 58 LEU H H 58 9.076 8.896 0.180 1
1 658 . 11 1 1 A 58 58 LEU HA H 58 5.472 5.624 -0.152 1
1 668 . 11 1 1 A 58 58 LEU C C 58 174.009 175.938 -1.929 1
1 669 . 11 1 1 A 58 58 LEU CA C 58 52.851 53.590 -0.739 1
1 670 . 11 1 1 A 58 58 LEU CB C 58 42.177 43.066 -0.889 1
1 674 . 11 1 1 A 58 58 LEU N N 58 121.895 126.121 -4.226 1
1 675 . 11 1 1 A 59 59 VAL H H 59 8.966 8.546 0.420 1
1 676 . 11 1 1 A 59 59 VAL HA H 59 5.488 5.171 0.317 1
1 681 . 11 1 1 A 59 59 VAL C C 59 176.034 175.459 0.575 1
1 682 . 11 1 1 A 59 59 VAL CA C 59 59.820 60.745 -0.925 1
1 683 . 11 1 1 A 59 59 VAL CB C 59 34.786 34.904 -0.118 1
1 685 . 11 1 1 A 59 59 VAL N N 59 121.702 124.259 -2.557 1
1 686 . 11 1 1 A 60 60 GLY H H 60 9.258 8.491 0.767 1
1 687 . 11 1 1 A 60 60 GLY HA2 H 60 4.673 4.306 0.367 1
1 688 . 11 1 1 A 60 60 GLY HA3 H 60 4.804 4.316 0.488 1
1 689 . 11 1 1 A 60 60 GLY C C 60 169.831 171.655 -1.824 1
1 690 . 11 1 1 A 60 60 GLY CA C 60 46.399 45.882 0.517 1
1 691 . 11 1 1 A 60 60 GLY N N 60 114.126 112.844 1.282 1
1 692 . 11 1 1 A 61 61 THR H H 61 8.834 8.628 0.206 1
1 693 . 11 1 1 A 61 61 THR HA H 61 4.418 4.544 -0.126 1
1 698 . 11 1 1 A 61 61 THR C C 61 171.985 175.025 -3.040 1
1 699 . 11 1 1 A 61 61 THR CA C 61 60.634 61.710 -1.076 1
1 700 . 11 1 1 A 61 61 THR CB C 61 70.983 68.454 2.529 1
1 702 . 11 1 1 A 61 61 THR N N 61 114.856 116.461 -1.605 1
1 703 . 11 1 1 A 62 62 GLU H H 62 8.502 8.759 -0.257 1
1 704 . 11 1 1 A 62 62 GLU HA H 62 2.867 3.780 -0.913 1
1 709 . 11 1 1 A 62 62 GLU C C 62 174.650 176.032 -1.382 1
1 710 . 11 1 1 A 62 62 GLU CA C 62 58.785 59.044 -0.259 1
1 711 . 11 1 1 A 62 62 GLU CB C 62 28.981 29.490 -0.509 1
1 713 . 11 1 1 A 62 62 GLU N N 62 129.915 127.927 1.988 1
1 714 . 11 1 1 A 63 63 ILE H H 63 6.928 7.462 -0.534 1
1 715 . 11 1 1 A 63 63 ILE HA H 63 4.038 4.596 -0.558 1
1 725 . 11 1 1 A 63 63 ILE C C 63 173.482 174.052 -0.570 1
1 726 . 11 1 1 A 63 63 ILE CA C 63 58.664 59.993 -1.329 1
1 727 . 11 1 1 A 63 63 ILE CB C 63 40.009 41.416 -1.407 1
1 731 . 11 1 1 A 63 63 ILE N N 63 117.075 118.031 -0.956 1
1 732 . 11 1 1 A 64 64 GLU H H 64 8.585 8.677 -0.092 1
1 733 . 11 1 1 A 64 64 GLU HA H 64 3.427 3.814 -0.387 1
1 738 . 11 1 1 A 64 64 GLU C C 64 175.186 177.384 -2.198 1
1 739 . 11 1 1 A 64 64 GLU CA C 64 58.703 58.579 0.124 1
1 740 . 11 1 1 A 64 64 GLU CB C 64 28.999 29.317 -0.318 1
1 742 . 11 1 1 A 64 64 GLU N N 64 126.422 127.630 -1.208 1
1 743 . 11 1 1 A 65 65 GLY H H 65 8.754 8.912 -0.158 1
1 744 . 11 1 1 A 65 65 GLY HA2 H 65 3.631 3.970 -0.339 1
1 745 . 11 1 1 A 65 65 GLY HA3 H 65 4.287 3.972 0.315 1
1 746 . 11 1 1 A 65 65 GLY C C 65 174.005 174.618 -0.613 1
1 747 . 11 1 1 A 65 65 GLY CA C 65 44.954 45.137 -0.183 1
1 748 . 11 1 1 A 65 65 GLY N N 65 114.614 112.716 1.898 1
1 749 . 11 1 1 A 66 66 GLU H H 66 7.760 7.561 0.199 1
1 750 . 11 1 1 A 66 66 GLU HA H 66 4.462 4.708 -0.246 1
1 754 . 11 1 1 A 66 66 GLU C C 66 175.255 176.386 -1.131 1
1 755 . 11 1 1 A 66 66 GLU CA C 66 55.582 55.805 -0.223 1
1 756 . 11 1 1 A 66 66 GLU CB C 66 30.654 30.697 -0.043 1
1 758 . 11 1 1 A 66 66 GLU N N 66 119.292 120.698 -1.406 1
1 759 . 11 1 1 A 67 67 GLY H H 67 8.262 8.550 -0.288 1
1 760 . 11 1 1 A 67 67 GLY HA2 H 67 3.875 4.115 -0.240 1
1 761 . 11 1 1 A 67 67 GLY HA3 H 67 4.088 4.140 -0.052 1
1 762 . 11 1 1 A 67 67 GLY C C 67 172.197 174.010 -1.813 1
1 763 . 11 1 1 A 67 67 GLY CA C 67 44.845 45.637 -0.792 1
1 764 . 11 1 1 A 67 67 GLY N N 67 106.161 108.649 -2.488 1
1 765 . 11 1 1 A 68 68 LEU H H 68 8.142 7.746 0.396 1
1 766 . 11 1 1 A 68 68 LEU HA H 68 4.491 4.780 -0.289 1
1 775 . 11 1 1 A 68 68 LEU C C 68 176.194 175.171 1.023 1
1 776 . 11 1 1 A 68 68 LEU CA C 68 55.123 54.312 0.811 1
1 777 . 11 1 1 A 68 68 LEU CB C 68 44.527 44.215 0.312 1
1 780 . 11 1 1 A 68 68 LEU N N 68 120.269 120.856 -0.587 1
1 781 . 11 1 1 A 69 69 GLN H H 69 9.253 8.491 0.762 1
1 782 . 11 1 1 A 69 69 GLN HA H 69 4.770 4.643 0.127 1
1 788 . 11 1 1 A 69 69 GLN C C 69 173.607 173.769 -0.162 1
1 789 . 11 1 1 A 69 69 GLN CA C 69 54.736 55.824 -1.088 1
1 790 . 11 1 1 A 69 69 GLN CB C 69 33.782 31.757 2.025 1
1 792 . 11 1 1 A 69 69 GLN N N 69 119.336 124.071 -4.735 1
1 794 . 11 1 1 A 70 70 THR H H 70 8.803 8.920 -0.117 1
1 795 . 11 1 1 A 70 70 THR HA H 70 5.033 4.969 0.064 1
1 800 . 11 1 1 A 70 70 THR C C 70 172.596 173.724 -1.128 1
1 801 . 11 1 1 A 70 70 THR CA C 70 62.768 61.862 0.906 1
1 802 . 11 1 1 A 70 70 THR CB C 70 69.990 71.012 -1.022 1
1 804 . 11 1 1 A 70 70 THR N N 70 118.372 121.086 -2.714 1
1 805 . 11 1 1 A 71 71 VAL H H 71 9.882 9.043 0.839 1
1 806 . 11 1 1 A 71 71 VAL HA H 71 5.239 5.319 -0.080 1
1 811 . 11 1 1 A 71 71 VAL C C 71 174.015 175.496 -1.481 1
1 812 . 11 1 1 A 71 71 VAL CA C 71 60.577 60.122 0.455 1
1 813 . 11 1 1 A 71 71 VAL CB C 71 34.149 34.200 -0.051 1
1 815 . 11 1 1 A 71 71 VAL N N 71 129.063 121.278 7.785 1
1 816 . 11 1 1 A 72 72 VAL H H 72 9.491 8.611 0.880 1
1 817 . 11 1 1 A 72 72 VAL HA H 72 4.672 4.985 -0.313 1
1 825 . 11 1 1 A 72 72 VAL CA C 72 59.568 58.481 1.087 1
1 826 . 11 1 1 A 72 72 VAL CB C 72 34.057 34.536 -0.479 1
1 829 . 11 1 1 A 72 72 VAL N N 72 128.521 119.536 8.985 1
1 830 . 11 1 1 A 73 73 PRO HA H 73 5.368 4.549 0.819 1
1 836 . 11 1 1 A 73 73 PRO C C 73 175.079 175.966 -0.887 1
1 837 . 11 1 1 A 73 73 PRO CA C 73 61.324 63.123 -1.799 1
1 838 . 11 1 1 A 73 73 PRO CB C 73 33.089 32.041 1.048 1
1 841 . 11 1 1 A 74 74 THR H H 74 9.103 8.901 0.202 1
1 842 . 11 1 1 A 74 74 THR HA H 74 5.191 4.865 0.326 1
1 847 . 11 1 1 A 74 74 THR CA C 74 57.986 59.188 -1.202 1
1 848 . 11 1 1 A 74 74 THR CB C 74 72.212 71.838 0.374 1
1 850 . 11 1 1 A 74 74 THR N N 74 118.075 118.816 -0.741 1
1 851 . 11 1 1 A 75 75 PRO HA H 75 5.015 4.758 0.257 1
1 858 . 11 1 1 A 75 75 PRO C C 75 178.704 177.401 1.303 1
1 859 . 11 1 1 A 75 75 PRO CA C 75 63.038 62.209 0.829 1
1 860 . 11 1 1 A 75 75 PRO CB C 75 32.529 32.981 -0.452 1
1 863 . 11 1 1 A 76 76 ILE H H 76 8.221 8.220 0.001 1
1 864 . 11 1 1 A 76 76 ILE HA H 76 4.218 3.813 0.405 1
1 873 . 11 1 1 A 76 76 ILE C C 76 172.375 176.681 -4.306 1
1 874 . 11 1 1 A 76 76 ILE CA C 76 63.509 64.003 -0.494 1
1 875 . 11 1 1 A 76 76 ILE CB C 76 39.322 37.922 1.400 1
1 879 . 11 1 1 A 76 76 ILE N N 76 122.273 122.384 -0.111 1
1 880 . 11 1 1 A 77 77 THR H H 77 6.984 7.605 -0.621 1
1 881 . 11 1 1 A 77 77 THR HA H 77 4.227 4.411 -0.184 1
1 886 . 11 1 1 A 77 77 THR C C 77 173.531 174.171 -0.640 1
1 887 . 11 1 1 A 77 77 THR CA C 77 61.435 62.974 -1.539 1
1 888 . 11 1 1 A 77 77 THR CB C 77 68.944 69.452 -0.508 1
1 890 . 11 1 1 A 77 77 THR N N 77 105.803 113.958 -8.155 1
1 891 . 11 1 1 A 78 78 ALA H H 78 7.647 7.546 0.101 1
1 892 . 11 1 1 A 78 78 ALA HA H 78 4.757 4.612 0.145 1
1 896 . 11 1 1 A 78 78 ALA C C 78 173.520 176.945 -3.425 1
1 897 . 11 1 1 A 78 78 ALA CA C 78 51.164 51.245 -0.081 1
1 898 . 11 1 1 A 78 78 ALA CB C 78 20.011 21.819 -1.808 1
1 899 . 11 1 1 A 78 78 ALA N N 78 126.635 123.791 2.844 1
1 900 . 11 1 1 A 79 79 SER H H 79 7.884 8.764 -0.880 1
1 901 . 11 1 1 A 79 79 SER HA H 79 4.386 5.467 -1.081 1
1 903 . 11 1 1 A 79 79 SER C C 79 176.077 172.743 3.334 1
1 904 . 11 1 1 A 79 79 SER CA C 79 57.465 55.940 1.525 1
1 905 . 11 1 1 A 79 79 SER CB C 79 65.285 65.934 -0.649 1
1 906 . 11 1 1 A 79 79 SER N N 79 115.272 112.669 2.603 1
1 907 . 11 1 1 A 80 80 LEU H H 80 7.700 8.869 -1.169 1
1 908 . 11 1 1 A 80 80 LEU HA H 80 4.912 4.972 -0.060 1
1 915 . 11 1 1 A 80 80 LEU C C 80 173.927 175.107 -1.180 1
1 916 . 11 1 1 A 80 80 LEU CA C 80 53.829 53.946 -0.117 1
1 917 . 11 1 1 A 80 80 LEU CB C 80 45.990 45.161 0.829 1
1 920 . 11 1 1 A 80 80 LEU N N 80 121.507 126.441 -4.934 1
1 921 . 11 1 1 A 81 81 SER H H 81 7.885 8.748 -0.863 1
1 922 . 11 1 1 A 81 81 SER HA H 81 5.269 4.801 0.468 1
1 925 . 11 1 1 A 81 81 SER C C 81 175.756 174.868 0.888 1
1 926 . 11 1 1 A 81 81 SER CA C 81 55.507 57.190 -1.683 1
1 927 . 11 1 1 A 81 81 SER CB C 81 65.966 65.886 0.080 1
1 928 . 11 1 1 A 81 81 SER N N 81 118.323 117.162 1.161 1
1 929 . 11 1 1 A 82 82 HIS H H 82 8.935 8.941 -0.006 1
1 930 . 11 1 1 A 82 82 HIS HA H 82 4.407 4.410 -0.003 1
1 932 . 11 1 1 A 82 82 HIS C C 82 176.550 176.999 -0.449 1
1 933 . 11 1 1 A 82 82 HIS CA C 82 60.960 58.954 2.006 1
1 934 . 11 1 1 A 82 82 HIS CB C 82 30.755 29.321 1.434 1
1 935 . 11 1 1 A 82 82 HIS N N 82 124.042 119.187 4.855 1
1 936 . 11 1 1 A 83 83 ASN H H 83 8.435 7.731 0.704 1
1 937 . 11 1 1 A 83 83 ASN HA H 83 4.439 4.114 0.325 1
1 941 . 11 1 1 A 83 83 ASN C C 83 174.769 178.319 -3.550 1
1 942 . 11 1 1 A 83 83 ASN CA C 83 56.575 55.943 0.632 1
1 943 . 11 1 1 A 83 83 ASN CB C 83 38.731 37.744 0.987 1
1 944 . 11 1 1 A 83 83 ASN N N 83 118.543 119.678 -1.135 1
1 946 . 11 1 1 A 84 84 ARG H H 84 7.716 8.157 -0.441 1
1 947 . 11 1 1 A 84 84 ARG HA H 84 4.183 3.956 0.227 1
1 953 . 11 1 1 A 84 84 ARG C C 84 177.399 178.931 -1.532 1
1 954 . 11 1 1 A 84 84 ARG CA C 84 59.045 59.266 -0.221 1
1 955 . 11 1 1 A 84 84 ARG CB C 84 29.992 29.955 0.037 1
1 957 . 11 1 1 A 84 84 ARG N N 84 121.312 119.615 1.697 1
1 958 . 11 1 1 A 85 85 ILE H H 85 8.354 7.421 0.933 1
1 959 . 11 1 1 A 85 85 ILE HA H 85 3.650 4.103 -0.453 1
1 967 . 11 1 1 A 85 85 ILE C C 85 176.098 178.088 -1.990 1
1 968 . 11 1 1 A 85 85 ILE CA C 85 66.704 64.842 1.862 1
1 969 . 11 1 1 A 85 85 ILE CB C 85 38.017 37.896 0.121 1
1 972 . 11 1 1 A 85 85 ILE N N 85 119.321 117.800 1.521 1
1 973 . 11 1 1 A 86 86 ARG H H 86 7.690 7.872 -0.182 1
1 974 . 11 1 1 A 86 86 ARG HA H 86 3.704 3.973 -0.269 1
1 981 . 11 1 1 A 86 86 ARG C C 86 177.524 178.907 -1.383 1
1 982 . 11 1 1 A 86 86 ARG CA C 86 59.881 59.815 0.066 1
1 983 . 11 1 1 A 86 86 ARG CB C 86 29.248 29.965 -0.717 1
1 986 . 11 1 1 A 86 86 ARG N N 86 118.362 121.281 -2.919 1
1 987 . 11 1 1 A 87 87 GLU H H 87 7.884 8.080 -0.196 1
1 988 . 11 1 1 A 87 87 GLU HA H 87 4.064 4.078 -0.014 1
1 993 . 11 1 1 A 87 87 GLU C C 87 178.785 178.907 -0.122 1
1 994 . 11 1 1 A 87 87 GLU CA C 87 58.999 59.249 -0.250 1
1 995 . 11 1 1 A 87 87 GLU CB C 87 29.872 29.124 0.748 1
1 997 . 11 1 1 A 87 87 GLU N N 87 118.124 118.415 -0.291 1
1 998 . 11 1 1 A 88 88 ILE H H 88 8.715 8.211 0.504 1
1 999 . 11 1 1 A 88 88 ILE HA H 88 3.305 3.536 -0.231 1
1 1009 . 11 1 1 A 88 88 ILE C C 88 177.261 178.310 -1.049 1
1 1010 . 11 1 1 A 88 88 ILE CA C 88 65.822 64.541 1.281 1
1 1011 . 11 1 1 A 88 88 ILE CB C 88 37.370 37.165 0.205 1
1 1015 . 11 1 1 A 88 88 ILE N N 88 122.929 121.135 1.794 1
1 1016 . 11 1 1 A 89 89 LEU H H 89 8.486 8.623 -0.137 1
1 1017 . 11 1 1 A 89 89 LEU HA H 89 3.932 4.026 -0.094 1
1 1023 . 11 1 1 A 89 89 LEU C C 89 177.919 179.494 -1.575 1
1 1024 . 11 1 1 A 89 89 LEU CA C 89 59.060 57.494 1.566 1
1 1025 . 11 1 1 A 89 89 LEU CB C 89 41.129 41.505 -0.376 1
1 1028 . 11 1 1 A 89 89 LEU N N 89 122.696 120.544 2.152 1
1 1029 . 11 1 1 A 90 90 LYS H H 90 7.790 7.698 0.092 1
1 1030 . 11 1 1 A 90 90 LYS HA H 90 4.061 4.004 0.057 1
1 1035 . 11 1 1 A 90 90 LYS C C 90 178.432 178.629 -0.197 1
1 1036 . 11 1 1 A 90 90 LYS CA C 90 59.840 58.819 1.021 1
1 1037 . 11 1 1 A 90 90 LYS CB C 90 32.582 32.209 0.373 1
1 1039 . 11 1 1 A 90 90 LYS N N 90 118.640 120.994 -2.354 1
1 1040 . 11 1 1 A 91 91 ALA H H 91 8.113 8.182 -0.069 1
1 1041 . 11 1 1 A 91 91 ALA HA H 91 4.151 4.094 0.057 1
1 1045 . 11 1 1 A 91 91 ALA C C 91 179.147 179.855 -0.708 1
1 1046 . 11 1 1 A 91 91 ALA CA C 91 54.942 55.232 -0.290 1
1 1047 . 11 1 1 A 91 91 ALA CB C 91 18.242 18.382 -0.140 1
1 1048 . 11 1 1 A 91 91 ALA N N 91 122.939 122.058 0.881 1
1 1049 . 11 1 1 A 92 92 SER H H 92 8.858 8.609 0.249 1
1 1050 . 11 1 1 A 92 92 SER HA H 92 4.898 4.169 0.729 1
1 1052 . 11 1 1 A 92 92 SER C C 92 172.440 176.847 -4.407 1
1 1053 . 11 1 1 A 92 92 SER CA C 92 61.913 61.110 0.803 1
1 1054 . 11 1 1 A 92 92 SER CB C 92 63.081 62.603 0.478 1
1 1055 . 11 1 1 A 92 92 SER N N 92 114.526 112.983 1.543 1
1 1056 . 11 1 1 A 93 93 ARG H H 93 7.704 7.954 -0.250 1
1 1057 . 11 1 1 A 93 93 ARG HA H 93 4.162 4.047 0.115 1
1 1059 . 11 1 1 A 93 93 ARG C C 93 177.757 178.842 -1.085 1
1 1060 . 11 1 1 A 93 93 ARG CA C 93 59.544 59.376 0.168 1
1 1061 . 11 1 1 A 93 93 ARG CB C 93 30.343 29.696 0.647 1
1 1062 . 11 1 1 A 93 93 ARG N N 93 121.505 122.208 -0.703 1
1 1063 . 11 1 1 A 94 94 LYS H H 94 7.456 7.787 -0.331 1
1 1064 . 11 1 1 A 94 94 LYS HA H 94 4.174 4.076 0.098 1
1 1071 . 11 1 1 A 94 94 LYS C C 94 178.861 178.781 0.080 1
1 1072 . 11 1 1 A 94 94 LYS CA C 94 59.030 58.754 0.276 1
1 1073 . 11 1 1 A 94 94 LYS CB C 94 32.239 31.969 0.270 1
1 1077 . 11 1 1 A 94 94 LYS N N 94 119.072 118.097 0.975 1
1 1078 . 11 1 1 A 95 95 LEU H H 95 8.148 7.548 0.600 1
1 1079 . 11 1 1 A 95 95 LEU HA H 95 4.129 4.110 0.019 1
1 1088 . 11 1 1 A 95 95 LEU C C 95 177.274 178.409 -1.135 1
1 1089 . 11 1 1 A 95 95 LEU CA C 95 57.136 57.160 -0.024 1
1 1090 . 11 1 1 A 95 95 LEU CB C 95 41.908 42.284 -0.376 1
1 1093 . 11 1 1 A 95 95 LEU N N 95 119.717 121.608 -1.891 1
1 1094 . 11 1 1 A 96 96 GLN H H 96 7.807 8.262 -0.455 1
1 1095 . 11 1 1 A 96 96 GLN HA H 96 4.242 4.338 -0.096 1
1 1102 . 11 1 1 A 96 96 GLN C C 96 175.371 176.451 -1.080 1
1 1103 . 11 1 1 A 96 96 GLN CA C 96 56.397 55.684 0.713 1
1 1104 . 11 1 1 A 96 96 GLN CB C 96 29.123 29.277 -0.154 1
1 1106 . 11 1 1 A 96 96 GLN N N 96 114.581 115.362 -0.781 1
1 1108 . 11 1 1 A 97 97 GLY H H 97 7.802 8.171 -0.369 1
1 1109 . 11 1 1 A 97 97 GLY HA2 H 97 3.839 3.934 -0.095 1
1 1110 . 11 1 1 A 97 97 GLY HA3 H 97 4.096 3.935 0.161 1
1 1111 . 11 1 1 A 97 97 GLY C C 97 172.636 173.864 -1.228 1
1 1112 . 11 1 1 A 97 97 GLY CA C 97 46.372 46.507 -0.135 1
1 1113 . 11 1 1 A 97 97 GLY N N 97 106.959 109.933 -2.974 1
1 1114 . 11 1 1 A 98 98 ASP H H 98 8.156 7.756 0.400 1
1 1115 . 11 1 1 A 98 98 ASP HA H 98 4.754 4.900 -0.146 1
1 1118 . 11 1 1 A 98 98 ASP CA C 98 52.882 50.857 2.025 1
1 1119 . 11 1 1 A 98 98 ASP CB C 98 41.603 41.803 -0.200 1
1 1120 . 11 1 1 A 98 98 ASP N N 98 118.447 121.180 -2.733 1
1 1121 . 11 1 1 A 99 99 PRO HA H 99 4.470 4.582 -0.112 1
1 1126 . 11 1 1 A 99 99 PRO C C 99 175.500 176.094 -0.594 1
1 1127 . 11 1 1 A 99 99 PRO CA C 99 63.601 64.030 -0.429 1
1 1128 . 11 1 1 A 99 99 PRO CB C 99 32.423 32.102 0.321 1
1 1130 . 11 1 1 A 100 100 ASP H H 100 8.527 7.675 0.852 1
1 1131 . 11 1 1 A 100 100 ASP HA H 100 4.778 5.045 -0.267 1
1 1134 . 11 1 1 A 100 100 ASP C C 100 174.931 173.867 1.064 1
1 1135 . 11 1 1 A 100 100 ASP CA C 100 53.915 53.910 0.005 1
1 1136 . 11 1 1 A 100 100 ASP CB C 100 40.665 43.065 -2.400 1
1 1137 . 11 1 1 A 100 100 ASP N N 100 119.340 116.490 2.850 1
1 1138 . 11 1 1 A 101 101 LEU H H 101 7.379 8.730 -1.351 1
1 1139 . 11 1 1 A 101 101 LEU HA H 101 4.682 4.803 -0.121 1
1 1148 . 11 1 1 A 101 101 LEU CA C 101 52.956 51.752 1.204 1
1 1149 . 11 1 1 A 101 101 LEU CB C 101 43.393 46.139 -2.746 1
1 1152 . 11 1 1 A 101 101 LEU N N 101 122.107 126.602 -4.495 1
1 1153 . 11 1 1 A 102 102 PRO HA H 102 4.487 4.856 -0.369 1
1 1158 . 11 1 1 A 102 102 PRO C C 102 175.697 175.354 0.343 1
1 1159 . 11 1 1 A 102 102 PRO CA C 102 63.113 62.518 0.595 1
1 1160 . 11 1 1 A 102 102 PRO CB C 102 32.138 31.689 0.449 1
1 1163 . 11 1 1 A 103 103 MET H H 103 9.011 8.646 0.365 1
1 1164 . 11 1 1 A 103 103 MET HA H 103 4.769 4.978 -0.209 1
1 1171 . 11 1 1 A 103 103 MET C C 103 174.080 174.030 0.050 1
1 1172 . 11 1 1 A 103 103 MET CA C 103 54.737 53.617 1.120 1
1 1173 . 11 1 1 A 103 103 MET CB C 103 34.857 35.196 -0.339 1
1 1176 . 11 1 1 A 103 103 MET N N 103 123.334 122.544 0.790 1
1 1177 . 11 1 1 A 104 104 SER H H 104 8.239 8.448 -0.209 1
1 1178 . 11 1 1 A 104 104 SER HA H 104 5.079 5.080 -0.001 1
1 1181 . 11 1 1 A 104 104 SER C C 104 171.795 172.916 -1.121 1
1 1182 . 11 1 1 A 104 104 SER CA C 104 57.641 57.529 0.112 1
1 1183 . 11 1 1 A 104 104 SER CB C 104 66.282 66.304 -0.022 1
1 1184 . 11 1 1 A 104 104 SER N N 104 114.434 114.172 0.262 1
1 1185 . 11 1 1 A 105 105 PHE H H 105 9.003 8.113 0.890 1
1 1186 . 11 1 1 A 105 105 PHE HA H 105 5.209 5.201 0.008 1
1 1193 . 11 1 1 A 105 105 PHE C C 105 170.688 172.112 -1.424 1
1 1194 . 11 1 1 A 105 105 PHE CA C 105 56.917 55.897 1.020 1
1 1195 . 11 1 1 A 105 105 PHE CB C 105 41.350 41.944 -0.594 1
1 1196 . 11 1 1 A 105 105 PHE N N 105 116.224 117.374 -1.150 1
1 1197 . 11 1 1 A 106 106 THR H H 106 9.074 8.662 0.412 1
1 1198 . 11 1 1 A 106 106 THR HA H 106 4.664 4.846 -0.182 1
1 1203 . 11 1 1 A 106 106 THR C C 106 171.767 174.355 -2.588 1
1 1204 . 11 1 1 A 106 106 THR CA C 106 62.162 61.711 0.451 1
1 1205 . 11 1 1 A 106 106 THR CB C 106 70.072 70.018 0.054 1
1 1207 . 11 1 1 A 106 106 THR N N 106 117.469 116.254 1.215 1
1 1208 . 11 1 1 A 107 107 LEU H H 107 9.804 8.958 0.846 1
1 1209 . 11 1 1 A 107 107 LEU HA H 107 4.750 4.748 0.002 1
1 1219 . 11 1 1 A 107 107 LEU C C 107 172.742 175.741 -2.999 1
1 1220 . 11 1 1 A 107 107 LEU CA C 107 54.151 54.601 -0.450 1
1 1221 . 11 1 1 A 107 107 LEU CB C 107 44.486 42.353 2.133 1
1 1224 . 11 1 1 A 107 107 LEU N N 107 133.400 128.209 5.191 1
1 1225 . 11 1 1 A 108 108 ALA H H 108 8.435 8.700 -0.265 1
1 1226 . 11 1 1 A 108 108 ALA HA H 108 4.683 4.462 0.221 1
1 1230 . 11 1 1 A 108 108 ALA C C 108 173.052 175.738 -2.686 1
1 1231 . 11 1 1 A 108 108 ALA CA C 108 49.308 50.507 -1.199 1
1 1232 . 11 1 1 A 108 108 ALA CB C 108 22.120 19.975 2.145 1
1 1233 . 11 1 1 A 108 108 ALA N N 108 131.422 127.129 4.293 1
1 1234 . 11 1 1 A 109 109 ILE H H 109 8.909 9.106 -0.197 1
1 1235 . 11 1 1 A 109 109 ILE HA H 109 4.063 5.167 -1.104 1
1 1245 . 11 1 1 A 109 109 ILE CA C 109 60.982 60.330 0.652 1
1 1246 . 11 1 1 A 109 109 ILE CB C 109 39.074 38.140 0.934 1
1 1250 . 11 1 1 A 109 109 ILE N N 109 124.415 123.837 0.578 1
1 1251 . 11 1 1 A 110 110 VAL H H 110 8.706 9.281 -0.575 1
1 1252 . 11 1 1 A 110 110 VAL HA H 110 4.324 5.443 -1.119 1
1 1260 . 11 1 1 A 110 110 VAL C C 110 175.700 174.063 1.637 1
1 1261 . 11 1 1 A 110 110 VAL CA C 110 62.316 60.312 2.004 1
1 1262 . 11 1 1 A 110 110 VAL CB C 110 31.876 34.162 -2.286 1
1 1264 . 11 1 1 A 110 110 VAL N N 110 127.457 123.221 4.236 1
1 1265 . 11 1 1 A 111 111 GLU H H 111 9.024 8.951 0.073 1
1 1266 . 11 1 1 A 111 111 GLU HA H 111 4.403 4.710 -0.307 1
1 1269 . 11 1 1 A 111 111 GLU C C 111 175.987 176.242 -0.255 1
1 1270 . 11 1 1 A 111 111 GLU CA C 111 56.842 54.948 1.894 1
1 1271 . 11 1 1 A 111 111 GLU CB C 111 31.044 32.760 -1.716 1
1 1272 . 11 1 1 A 111 111 GLU N N 111 129.768 126.982 2.786 1
1 1273 . 11 1 1 A 112 112 SER H H 112 9.143 9.336 -0.193 1
1 1274 . 11 1 1 A 112 112 SER HA H 112 4.394 4.181 0.213 1
1 1276 . 11 1 1 A 112 112 SER C C 112 173.187 173.077 0.110 1
1 1277 . 11 1 1 A 112 112 SER CA C 112 60.180 59.365 0.815 1
1 1278 . 11 1 1 A 112 112 SER CB C 112 63.415 62.390 1.025 1
1 1279 . 11 1 1 A 112 112 SER N N 112 115.956 121.346 -5.390 1
1 1280 . 11 1 1 A 113 113 ASP H H 113 8.133 8.617 -0.484 1
1 1281 . 11 1 1 A 113 113 ASP HA H 113 4.573 4.446 0.127 1
1 1284 . 11 1 1 A 113 113 ASP C C 113 175.430 175.358 0.072 1
1 1285 . 11 1 1 A 113 113 ASP CA C 113 54.115 55.549 -1.434 1
1 1286 . 11 1 1 A 113 113 ASP CB C 113 40.011 39.141 0.870 1
1 1287 . 11 1 1 A 113 113 ASP N N 113 118.343 115.099 3.244 1
1 1288 . 11 1 1 A 114 114 SER H H 114 8.034 7.684 0.350 1
1 1289 . 11 1 1 A 114 114 SER HA H 114 4.057 4.733 -0.676 1
1 1291 . 11 1 1 A 114 114 SER C C 114 172.209 173.730 -1.521 1
1 1292 . 11 1 1 A 114 114 SER CA C 114 60.179 59.310 0.869 1
1 1293 . 11 1 1 A 114 114 SER CB C 114 62.702 65.886 -3.184 1
1 1294 . 11 1 1 A 114 114 SER N N 114 109.836 112.318 -2.482 1
1 1295 . 11 1 1 A 115 115 THR H H 115 7.711 8.063 -0.352 1
1 1296 . 11 1 1 A 115 115 THR HA H 115 4.250 4.237 0.013 1
1 1300 . 11 1 1 A 115 115 THR C C 115 171.500 173.967 -2.467 1
1 1301 . 11 1 1 A 115 115 THR CA C 115 63.547 63.962 -0.415 1
1 1302 . 11 1 1 A 115 115 THR CB C 115 69.595 68.946 0.649 1
1 1303 . 11 1 1 A 115 115 THR N N 115 117.407 116.404 1.003 1
1 1304 . 11 1 1 A 116 116 ILE H H 116 8.219 8.865 -0.646 1
1 1305 . 11 1 1 A 116 116 ILE HA H 116 4.769 4.935 -0.166 1
1 1315 . 11 1 1 A 116 116 ILE C C 116 174.434 174.916 -0.482 1
1 1316 . 11 1 1 A 116 116 ILE CA C 116 60.306 59.219 1.087 1
1 1317 . 11 1 1 A 116 116 ILE CB C 116 40.686 39.604 1.082 1
1 1321 . 11 1 1 A 116 116 ILE N N 116 125.480 128.329 -2.849 1
1 1322 . 11 1 1 A 117 117 VAL H H 117 8.695 9.622 -0.927 1
1 1323 . 11 1 1 A 117 117 VAL HA H 117 4.315 4.673 -0.358 1
1 1328 . 11 1 1 A 117 117 VAL C C 117 172.243 174.606 -2.363 1
1 1329 . 11 1 1 A 117 117 VAL CA C 117 60.621 61.219 -0.598 1
1 1330 . 11 1 1 A 117 117 VAL CB C 117 34.558 33.751 0.807 1
1 1332 . 11 1 1 A 117 117 VAL N N 117 127.887 127.402 0.485 1
1 1333 . 11 1 1 A 118 118 TYR H H 118 8.270 8.871 -0.601 1
1 1334 . 11 1 1 A 118 118 TYR HA H 118 5.327 5.322 0.005 1
1 1342 . 11 1 1 A 118 118 TYR C C 118 174.250 174.930 -0.680 1
1 1343 . 11 1 1 A 118 118 TYR CA C 118 57.283 57.655 -0.372 1
1 1344 . 11 1 1 A 118 118 TYR CB C 118 39.262 39.474 -0.212 1
1 1345 . 11 1 1 A 118 118 TYR N N 118 124.822 126.853 -2.031 1
1 1346 . 11 1 1 A 119 119 TYR H H 119 9.207 9.207 0.000 1
1 1347 . 11 1 1 A 119 119 TYR HA H 119 4.821 5.341 -0.520 1
1 1354 . 11 1 1 A 119 119 TYR C C 119 171.994 173.817 -1.823 1
1 1355 . 11 1 1 A 119 119 TYR CA C 119 58.116 56.638 1.478 1
1 1356 . 11 1 1 A 119 119 TYR CB C 119 43.544 42.087 1.457 1
1 1357 . 11 1 1 A 119 119 TYR N N 119 125.153 124.130 1.023 1
1 1358 . 11 1 1 A 120 120 LYS H H 120 7.700 8.512 -0.812 1
1 1359 . 11 1 1 A 120 120 LYS HA H 120 4.558 4.489 0.069 1
1 1366 . 11 1 1 A 120 120 LYS C C 120 172.017 174.732 -2.715 1
1 1367 . 11 1 1 A 120 120 LYS CA C 120 57.217 56.030 1.187 1
1 1368 . 11 1 1 A 120 120 LYS CB C 120 33.914 33.197 0.717 1
1 1372 . 11 1 1 A 120 120 LYS N N 120 129.442 129.103 0.339 1
1 1373 . 11 1 1 A 121 121 LEU H H 121 8.112 8.402 -0.290 1
1 1374 . 11 1 1 A 121 121 LEU HA H 121 5.323 5.037 0.286 1
1 1384 . 11 1 1 A 121 121 LEU C C 121 175.733 174.700 1.033 1
1 1385 . 11 1 1 A 121 121 LEU CA C 121 52.716 53.069 -0.353 1
1 1386 . 11 1 1 A 121 121 LEU CB C 121 44.098 45.118 -1.020 1
1 1389 . 11 1 1 A 121 121 LEU N N 121 123.403 128.629 -5.226 1
1 1390 . 11 1 1 A 122 122 THR H H 122 8.338 9.006 -0.668 1
1 1391 . 11 1 1 A 122 122 THR HA H 122 5.097 4.704 0.393 1
1 1396 . 11 1 1 A 122 122 THR C C 122 173.221 173.554 -0.333 1
1 1397 . 11 1 1 A 122 122 THR CA C 122 60.306 61.105 -0.799 1
1 1398 . 11 1 1 A 122 122 THR CB C 122 72.473 71.698 0.775 1
1 1400 . 11 1 1 A 122 122 THR N N 122 109.081 122.269 -13.188 1
1 7 . 12 1 1 A 2 2 GLU H H 2 8.994 7.853 1.141 1
1 8 . 12 1 1 A 2 2 GLU HA H 2 4.278 4.339 -0.061 1
1 13 . 12 1 1 A 2 2 GLU C C 2 175.315 176.317 -1.002 1
1 14 . 12 1 1 A 2 2 GLU CA C 2 57.318 56.212 1.106 1
1 15 . 12 1 1 A 2 2 GLU CB C 2 29.221 28.997 0.224 1
1 17 . 12 1 1 A 2 2 GLU N N 2 122.259 119.986 2.273 1
1 18 . 12 1 1 A 3 3 ASP H H 3 8.048 7.807 0.241 1
1 19 . 12 1 1 A 3 3 ASP HA H 3 4.580 1.783 2.797 1
1 21 . 12 1 1 A 3 3 ASP C C 3 175.636 176.018 -0.382 1
1 22 . 12 1 1 A 3 3 ASP CA C 3 54.579 54.426 0.153 1
1 23 . 12 1 1 A 3 3 ASP CB C 3 40.984 40.231 0.753 1
1 24 . 12 1 1 A 3 3 ASP N N 3 119.830 118.469 1.361 1
1 25 . 12 1 1 A 4 4 ALA H H 4 8.090 7.525 0.565 1
1 26 . 12 1 1 A 4 4 ALA HA H 4 4.216 3.937 0.279 1
1 30 . 12 1 1 A 4 4 ALA C C 4 177.157 176.953 0.204 1
1 31 . 12 1 1 A 4 4 ALA CA C 4 53.620 52.639 0.981 1
1 32 . 12 1 1 A 4 4 ALA CB C 4 18.728 17.814 0.914 1
1 33 . 12 1 1 A 4 4 ALA N N 4 123.957 120.699 3.258 1
1 34 . 12 1 1 A 5 5 TRP H H 5 7.941 7.667 0.274 1
1 35 . 12 1 1 A 5 5 TRP HA H 5 4.559 4.584 -0.025 1
1 39 . 12 1 1 A 5 5 TRP C C 5 176.072 177.465 -1.393 1
1 40 . 12 1 1 A 5 5 TRP CA C 5 57.744 59.214 -1.470 1
1 41 . 12 1 1 A 5 5 TRP CB C 5 28.906 30.476 -1.570 1
1 42 . 12 1 1 A 5 5 TRP N N 5 118.408 119.527 -1.119 1
1 44 . 12 1 1 A 6 6 MET H H 6 7.679 7.515 0.164 1
1 45 . 12 1 1 A 6 6 MET HA H 6 3.785 4.626 -0.841 1
1 52 . 12 1 1 A 6 6 MET C C 6 175.174 176.668 -1.494 1
1 53 . 12 1 1 A 6 6 MET CA C 6 57.724 56.029 1.695 1
1 54 . 12 1 1 A 6 6 MET CB C 6 31.640 35.148 -3.508 1
1 57 . 12 1 1 A 6 6 MET N N 6 121.538 114.992 6.546 1
1 58 . 12 1 1 A 7 7 GLY H H 7 7.247 7.639 -0.392 1
1 59 . 12 1 1 A 7 7 GLY HA2 H 7 3.455 2.751 0.704 1
1 60 . 12 1 1 A 7 7 GLY HA3 H 7 3.578 3.342 0.236 1
1 61 . 12 1 1 A 7 7 GLY C C 7 172.852 174.694 -1.842 1
1 62 . 12 1 1 A 7 7 GLY CA C 7 45.896 45.497 0.399 1
1 63 . 12 1 1 A 7 7 GLY N N 7 104.055 106.886 -2.831 1
1 64 . 12 1 1 A 8 8 THR H H 8 7.436 7.855 -0.419 1
1 65 . 12 1 1 A 8 8 THR HA H 8 4.428 4.504 -0.076 1
1 70 . 12 1 1 A 8 8 THR C C 8 172.973 174.145 -1.172 1
1 71 . 12 1 1 A 8 8 THR CA C 8 60.751 62.134 -1.383 1
1 72 . 12 1 1 A 8 8 THR CB C 8 69.637 69.615 0.022 1
1 74 . 12 1 1 A 8 8 THR N N 8 107.669 111.335 -3.666 1
1 75 . 12 1 1 A 9 9 HIS H H 9 8.048 7.736 0.312 1
1 76 . 12 1 1 A 9 9 HIS HA H 9 4.654 4.656 -0.002 1
1 79 . 12 1 1 A 9 9 HIS CA C 9 56.163 55.293 0.870 1
1 80 . 12 1 1 A 9 9 HIS CB C 9 32.619 31.081 1.538 1
1 81 . 12 1 1 A 9 9 HIS N N 9 127.281 124.694 2.587 1
1 82 . 12 1 1 A 10 10 PRO HA H 10 4.257 4.213 0.044 1
1 88 . 12 1 1 A 10 10 PRO C C 10 178.779 178.196 0.583 1
1 89 . 12 1 1 A 10 10 PRO CA C 10 65.565 65.903 -0.338 1
1 90 . 12 1 1 A 10 10 PRO CB C 10 32.422 31.967 0.455 1
1 93 . 12 1 1 A 11 11 LYS H H 11 10.994 8.282 2.712 1
1 94 . 12 1 1 A 11 11 LYS HA H 11 4.282 4.077 0.205 1
1 100 . 12 1 1 A 11 11 LYS C C 11 177.279 178.601 -1.322 1
1 101 . 12 1 1 A 11 11 LYS CA C 11 56.859 59.552 -2.693 1
1 102 . 12 1 1 A 11 11 LYS CB C 11 31.279 32.178 -0.899 1
1 104 . 12 1 1 A 11 11 LYS N N 11 121.398 117.332 4.066 1
1 105 . 12 1 1 A 12 12 TYR H H 12 7.146 8.155 -1.009 1
1 106 . 12 1 1 A 12 12 TYR HA H 12 3.722 4.224 -0.502 1
1 113 . 12 1 1 A 12 12 TYR C C 12 176.265 177.520 -1.255 1
1 114 . 12 1 1 A 12 12 TYR CA C 12 61.189 61.424 -0.235 1
1 115 . 12 1 1 A 12 12 TYR CB C 12 37.796 38.525 -0.729 1
1 116 . 12 1 1 A 12 12 TYR N N 12 121.579 121.012 0.567 1
1 117 . 12 1 1 A 13 13 LEU H H 13 7.778 8.414 -0.636 1
1 118 . 12 1 1 A 13 13 LEU HA H 13 3.773 4.067 -0.294 1
1 127 . 12 1 1 A 13 13 LEU C C 13 178.462 178.593 -0.131 1
1 128 . 12 1 1 A 13 13 LEU CA C 13 57.942 58.184 -0.242 1
1 129 . 12 1 1 A 13 13 LEU CB C 13 41.064 41.440 -0.376 1
1 132 . 12 1 1 A 13 13 LEU N N 13 117.518 120.911 -3.393 1
1 133 . 12 1 1 A 14 14 GLU H H 14 7.867 8.201 -0.334 1
1 134 . 12 1 1 A 14 14 GLU HA H 14 3.935 3.965 -0.030 1
1 139 . 12 1 1 A 14 14 GLU C C 14 178.326 178.669 -0.343 1
1 140 . 12 1 1 A 14 14 GLU CA C 14 59.368 59.751 -0.383 1
1 141 . 12 1 1 A 14 14 GLU CB C 14 30.147 29.119 1.028 1
1 143 . 12 1 1 A 14 14 GLU N N 14 119.135 119.048 0.087 1
1 144 . 12 1 1 A 15 15 MET H H 15 7.773 7.904 -0.131 1
1 145 . 12 1 1 A 15 15 MET HA H 15 3.936 4.202 -0.266 1
1 152 . 12 1 1 A 15 15 MET C C 15 177.886 178.381 -0.495 1
1 153 . 12 1 1 A 15 15 MET CA C 15 59.465 58.120 1.345 1
1 154 . 12 1 1 A 15 15 MET CB C 15 33.987 32.204 1.783 1
1 157 . 12 1 1 A 15 15 MET N N 15 117.884 119.400 -1.516 1
1 158 . 12 1 1 A 16 16 MET H H 16 8.145 8.458 -0.313 1
1 159 . 12 1 1 A 16 16 MET HA H 16 4.159 4.220 -0.061 1
1 166 . 12 1 1 A 16 16 MET C C 16 177.835 178.586 -0.751 1
1 167 . 12 1 1 A 16 16 MET CA C 16 57.397 58.147 -0.750 1
1 168 . 12 1 1 A 16 16 MET CB C 16 31.867 32.563 -0.696 1
1 171 . 12 1 1 A 16 16 MET N N 16 119.555 118.163 1.392 1
1 172 . 12 1 1 A 17 17 GLU H H 17 7.761 8.183 -0.422 1
1 173 . 12 1 1 A 17 17 GLU HA H 17 4.117 4.355 -0.238 1
1 176 . 12 1 1 A 17 17 GLU C C 17 175.994 177.148 -1.154 1
1 177 . 12 1 1 A 17 17 GLU CA C 17 57.392 57.951 -0.559 1
1 178 . 12 1 1 A 17 17 GLU CB C 17 29.432 29.587 -0.155 1
1 180 . 12 1 1 A 17 17 GLU N N 17 118.216 116.975 1.241 1
1 181 . 12 1 1 A 18 18 LEU H H 18 7.201 7.365 -0.164 1
1 182 . 12 1 1 A 18 18 LEU HA H 18 4.111 4.317 -0.206 1
1 191 . 12 1 1 A 18 18 LEU C C 18 175.781 177.288 -1.507 1
1 192 . 12 1 1 A 18 18 LEU CA C 18 56.366 55.187 1.179 1
1 193 . 12 1 1 A 18 18 LEU CB C 18 42.030 42.550 -0.520 1
1 196 . 12 1 1 A 18 18 LEU N N 18 117.448 122.546 -5.098 1
1 197 . 12 1 1 A 19 19 ASP H H 19 7.789 8.707 -0.918 1
1 198 . 12 1 1 A 19 19 ASP HA H 19 4.360 4.567 -0.207 1
1 201 . 12 1 1 A 19 19 ASP C C 19 173.765 176.691 -2.926 1
1 202 . 12 1 1 A 19 19 ASP CA C 19 54.851 55.257 -0.406 1
1 203 . 12 1 1 A 19 19 ASP CB C 19 39.115 40.514 -1.399 1
1 204 . 12 1 1 A 19 19 ASP N N 19 115.844 120.654 -4.810 1
1 205 . 12 1 1 A 20 20 ILE H H 20 8.142 7.598 0.544 1
1 206 . 12 1 1 A 20 20 ILE HA H 20 4.128 4.236 -0.108 1
1 216 . 12 1 1 A 20 20 ILE C C 20 174.710 176.910 -2.200 1
1 217 . 12 1 1 A 20 20 ILE CA C 20 60.465 61.879 -1.414 1
1 218 . 12 1 1 A 20 20 ILE CB C 20 40.407 39.573 0.834 1
1 222 . 12 1 1 A 20 20 ILE N N 20 117.287 114.588 2.699 1
1 223 . 12 1 1 A 21 21 GLY H H 21 8.207 8.078 0.129 1
1 224 . 12 1 1 A 21 21 GLY HA2 H 21 3.889 3.912 -0.023 1
1 225 . 12 1 1 A 21 21 GLY HA3 H 21 3.924 3.917 0.007 1
1 226 . 12 1 1 A 21 21 GLY C C 21 172.162 173.986 -1.824 1
1 227 . 12 1 1 A 21 21 GLY CA C 21 45.017 46.840 -1.823 1
1 228 . 12 1 1 A 21 21 GLY N N 21 110.656 111.895 -1.239 1
1 229 . 12 1 1 A 22 22 ASP H H 22 7.727 8.228 -0.501 1
1 230 . 12 1 1 A 22 22 ASP HA H 22 4.794 4.912 -0.118 1
1 233 . 12 1 1 A 22 22 ASP C C 22 174.884 176.887 -2.003 1
1 234 . 12 1 1 A 22 22 ASP CA C 22 52.471 52.874 -0.403 1
1 235 . 12 1 1 A 22 22 ASP CB C 22 42.069 42.474 -0.405 1
1 236 . 12 1 1 A 22 22 ASP N N 22 119.305 121.508 -2.203 1
1 237 . 12 1 1 A 23 23 ALA H H 23 8.644 9.099 -0.455 1
1 238 . 12 1 1 A 23 23 ALA HA H 23 4.120 4.013 0.107 1
1 242 . 12 1 1 A 23 23 ALA C C 23 179.546 179.934 -0.388 1
1 243 . 12 1 1 A 23 23 ALA CA C 23 55.609 55.586 0.023 1
1 244 . 12 1 1 A 23 23 ALA CB C 23 18.573 18.384 0.189 1
1 245 . 12 1 1 A 23 23 ALA N N 23 122.468 129.055 -6.587 1
1 246 . 12 1 1 A 24 24 THR H H 24 8.238 7.694 0.544 1
1 247 . 12 1 1 A 24 24 THR HA H 24 4.184 4.039 0.145 1
1 252 . 12 1 1 A 24 24 THR C C 24 174.841 176.472 -1.631 1
1 253 . 12 1 1 A 24 24 THR CA C 24 66.241 66.244 -0.003 1
1 254 . 12 1 1 A 24 24 THR CB C 24 68.376 68.368 0.008 1
1 256 . 12 1 1 A 24 24 THR N N 24 114.824 114.064 0.760 1
1 257 . 12 1 1 A 25 25 GLN H H 25 8.037 8.256 -0.219 1
1 258 . 12 1 1 A 25 25 GLN HA H 25 4.095 3.991 0.104 1
1 265 . 12 1 1 A 25 25 GLN C C 25 177.603 178.137 -0.534 1
1 266 . 12 1 1 A 25 25 GLN CA C 25 59.261 58.752 0.509 1
1 267 . 12 1 1 A 25 25 GLN CB C 25 28.437 28.489 -0.052 1
1 269 . 12 1 1 A 25 25 GLN N N 25 122.518 121.025 1.493 1
1 271 . 12 1 1 A 26 26 VAL H H 26 7.994 8.449 -0.455 1
1 272 . 12 1 1 A 26 26 VAL HA H 26 3.469 3.723 -0.254 1
1 280 . 12 1 1 A 26 26 VAL C C 26 175.552 177.740 -2.188 1
1 281 . 12 1 1 A 26 26 VAL CA C 26 66.909 65.754 1.155 1
1 282 . 12 1 1 A 26 26 VAL CB C 26 31.582 31.462 0.120 1
1 285 . 12 1 1 A 26 26 VAL N N 26 119.112 118.885 0.227 1
1 286 . 12 1 1 A 27 27 TYR H H 27 8.003 8.088 -0.085 1
1 287 . 12 1 1 A 27 27 TYR HA H 27 4.357 4.243 0.114 1
1 294 . 12 1 1 A 27 27 TYR C C 27 175.856 177.146 -1.290 1
1 295 . 12 1 1 A 27 27 TYR CA C 27 62.197 61.562 0.635 1
1 296 . 12 1 1 A 27 27 TYR CB C 27 38.394 38.840 -0.446 1
1 297 . 12 1 1 A 27 27 TYR N N 27 119.170 124.577 -5.407 1
1 298 . 12 1 1 A 28 28 VAL H H 28 8.087 8.212 -0.125 1
1 299 . 12 1 1 A 28 28 VAL HA H 28 3.652 3.466 0.186 1
1 307 . 12 1 1 A 28 28 VAL C C 28 176.134 178.075 -1.941 1
1 308 . 12 1 1 A 28 28 VAL CA C 28 66.247 66.288 -0.041 1
1 309 . 12 1 1 A 28 28 VAL CB C 28 31.241 31.344 -0.103 1
1 312 . 12 1 1 A 28 28 VAL N N 28 113.112 119.315 -6.203 1
1 313 . 12 1 1 A 29 29 ALA H H 29 7.853 8.908 -1.055 1
1 314 . 12 1 1 A 29 29 ALA HA H 29 3.913 3.946 -0.033 1
1 318 . 12 1 1 A 29 29 ALA C C 29 177.850 179.252 -1.402 1
1 319 . 12 1 1 A 29 29 ALA CA C 29 55.274 54.993 0.281 1
1 320 . 12 1 1 A 29 29 ALA CB C 29 17.876 18.033 -0.157 1
1 321 . 12 1 1 A 29 29 ALA N N 29 121.350 122.835 -1.485 1
1 322 . 12 1 1 A 30 30 PHE H H 30 8.724 8.167 0.557 1
1 323 . 12 1 1 A 30 30 PHE HA H 30 4.098 3.986 0.112 1
1 327 . 12 1 1 A 30 30 PHE C C 30 175.035 176.960 -1.925 1
1 328 . 12 1 1 A 30 30 PHE CA C 30 61.264 61.429 -0.165 1
1 329 . 12 1 1 A 30 30 PHE CB C 30 38.926 39.035 -0.109 1
1 330 . 12 1 1 A 30 30 PHE N N 30 120.478 120.005 0.473 1
1 331 . 12 1 1 A 31 31 LEU H H 31 8.146 7.900 0.246 1
1 332 . 12 1 1 A 31 31 LEU HA H 31 3.597 3.379 0.218 1
1 341 . 12 1 1 A 31 31 LEU C C 31 179.508 179.076 0.432 1
1 342 . 12 1 1 A 31 31 LEU CA C 31 57.884 57.970 -0.086 1
1 343 . 12 1 1 A 31 31 LEU CB C 31 41.829 42.201 -0.372 1
1 346 . 12 1 1 A 31 31 LEU N N 31 118.427 120.154 -1.727 1
1 347 . 12 1 1 A 32 32 VAL H H 32 7.627 7.590 0.037 1
1 348 . 12 1 1 A 32 32 VAL HA H 32 3.464 3.727 -0.263 1
1 356 . 12 1 1 A 32 32 VAL C C 32 174.956 177.466 -2.510 1
1 357 . 12 1 1 A 32 32 VAL CA C 32 66.373 65.546 0.827 1
1 358 . 12 1 1 A 32 32 VAL CB C 32 31.121 31.506 -0.385 1
1 361 . 12 1 1 A 32 32 VAL N N 32 119.497 114.338 5.159 1
1 362 . 12 1 1 A 33 33 TYR H H 33 8.366 8.503 -0.137 1
1 363 . 12 1 1 A 33 33 TYR HA H 33 3.485 3.872 -0.387 1
1 370 . 12 1 1 A 33 33 TYR C C 33 174.883 176.778 -1.895 1
1 371 . 12 1 1 A 33 33 TYR CA C 33 62.866 61.303 1.563 1
1 372 . 12 1 1 A 33 33 TYR CB C 33 37.778 38.214 -0.436 1
1 373 . 12 1 1 A 33 33 TYR N N 33 121.842 124.027 -2.185 1
1 374 . 12 1 1 A 34 34 LEU H H 34 8.000 8.265 -0.265 1
1 375 . 12 1 1 A 34 34 LEU HA H 34 3.495 3.492 0.003 1
1 385 . 12 1 1 A 34 34 LEU C C 34 178.240 178.969 -0.729 1
1 386 . 12 1 1 A 34 34 LEU CA C 34 57.453 57.331 0.122 1
1 387 . 12 1 1 A 34 34 LEU CB C 34 41.828 40.664 1.164 1
1 390 . 12 1 1 A 34 34 LEU N N 34 116.692 119.494 -2.802 1
1 391 . 12 1 1 A 35 35 ASP H H 35 7.688 7.911 -0.223 1
1 392 . 12 1 1 A 35 35 ASP HA H 35 4.302 4.292 0.010 1
1 395 . 12 1 1 A 35 35 ASP C C 35 177.507 178.436 -0.929 1
1 396 . 12 1 1 A 35 35 ASP CA C 35 58.196 57.642 0.554 1
1 397 . 12 1 1 A 35 35 ASP CB C 35 43.070 41.229 1.841 1
1 398 . 12 1 1 A 35 35 ASP N N 35 120.507 120.089 0.418 1
1 399 . 12 1 1 A 36 36 LEU H H 36 8.482 8.284 0.198 1
1 400 . 12 1 1 A 36 36 LEU HA H 36 3.328 3.716 -0.388 1
1 410 . 12 1 1 A 36 36 LEU C C 36 176.774 179.215 -2.441 1
1 411 . 12 1 1 A 36 36 LEU CA C 36 57.461 57.630 -0.169 1
1 412 . 12 1 1 A 36 36 LEU CB C 36 41.344 41.275 0.069 1
1 416 . 12 1 1 A 36 36 LEU N N 36 117.671 120.315 -2.644 1
1 417 . 12 1 1 A 37 37 MET H H 37 7.822 8.223 -0.401 1
1 418 . 12 1 1 A 37 37 MET HA H 37 4.401 4.077 0.324 1
1 425 . 12 1 1 A 37 37 MET C C 37 177.862 177.626 0.236 1
1 426 . 12 1 1 A 37 37 MET CA C 37 56.434 58.334 -1.900 1
1 427 . 12 1 1 A 37 37 MET CB C 37 31.573 31.811 -0.238 1
1 430 . 12 1 1 A 37 37 MET N N 37 112.952 118.548 -5.596 1
1 431 . 12 1 1 A 38 38 GLU H H 38 8.667 8.129 0.538 1
1 432 . 12 1 1 A 38 38 GLU HA H 38 4.457 4.190 0.267 1
1 436 . 12 1 1 A 38 38 GLU C C 38 176.582 177.926 -1.344 1
1 437 . 12 1 1 A 38 38 GLU CA C 38 57.659 57.881 -0.222 1
1 438 . 12 1 1 A 38 38 GLU CB C 38 29.936 29.822 0.114 1
1 440 . 12 1 1 A 38 38 GLU N N 38 116.463 117.161 -0.698 1
1 441 . 12 1 1 A 39 39 SER H H 39 7.657 8.201 -0.544 1
1 442 . 12 1 1 A 39 39 SER HA H 39 4.658 4.687 -0.029 1
1 445 . 12 1 1 A 39 39 SER C C 39 175.661 176.343 -0.682 1
1 446 . 12 1 1 A 39 39 SER CA C 39 60.449 59.720 0.729 1
1 447 . 12 1 1 A 39 39 SER CB C 39 63.341 64.451 -1.110 1
1 448 . 12 1 1 A 39 39 SER N N 39 113.870 115.676 -1.806 1
1 449 . 12 1 1 A 40 40 LYS H H 40 8.165 7.668 0.497 1
1 450 . 12 1 1 A 40 40 LYS HA H 40 4.454 4.259 0.195 1
1 458 . 12 1 1 A 40 40 LYS C C 40 174.970 175.935 -0.965 1
1 459 . 12 1 1 A 40 40 LYS CA C 40 55.753 56.304 -0.551 1
1 460 . 12 1 1 A 40 40 LYS CB C 40 32.337 32.782 -0.445 1
1 464 . 12 1 1 A 40 40 LYS N N 40 116.671 120.124 -3.453 1
1 465 . 12 1 1 A 41 41 SER H H 41 7.017 8.035 -1.018 1
1 466 . 12 1 1 A 41 41 SER HA H 41 4.209 4.273 -0.064 1
1 469 . 12 1 1 A 41 41 SER C C 41 173.770 173.515 0.255 1
1 470 . 12 1 1 A 41 41 SER CA C 41 58.435 59.444 -1.009 1
1 471 . 12 1 1 A 41 41 SER CB C 41 61.700 60.871 0.829 1
1 472 . 12 1 1 A 41 41 SER N N 41 109.989 112.500 -2.511 1
1 473 . 12 1 1 A 42 42 TRP H H 42 8.876 8.067 0.809 1
1 474 . 12 1 1 A 42 42 TRP HA H 42 4.698 4.515 0.183 1
1 478 . 12 1 1 A 42 42 TRP C C 42 174.477 177.301 -2.824 1
1 479 . 12 1 1 A 42 42 TRP CA C 42 59.443 58.326 1.117 1
1 480 . 12 1 1 A 42 42 TRP CB C 42 28.203 29.287 -1.084 1
1 481 . 12 1 1 A 42 42 TRP N N 42 121.116 120.693 0.423 1
1 483 . 12 1 1 A 43 43 HIS H H 43 8.132 8.717 -0.585 1
1 484 . 12 1 1 A 43 43 HIS HA H 43 4.445 4.342 0.103 1
1 488 . 12 1 1 A 43 43 HIS C C 43 174.405 174.525 -0.120 1
1 489 . 12 1 1 A 43 43 HIS CA C 43 58.556 59.525 -0.969 1
1 490 . 12 1 1 A 43 43 HIS CB C 43 29.430 30.359 -0.929 1
1 491 . 12 1 1 A 43 43 HIS N N 43 119.397 124.730 -5.333 1
1 492 . 12 1 1 A 44 44 GLU H H 44 8.140 7.591 0.549 1
1 493 . 12 1 1 A 44 44 GLU HA H 44 4.432 4.697 -0.265 1
1 497 . 12 1 1 A 44 44 GLU C C 44 173.010 174.499 -1.489 1
1 498 . 12 1 1 A 44 44 GLU CA C 44 56.421 56.105 0.316 1
1 499 . 12 1 1 A 44 44 GLU CB C 44 33.285 33.072 0.213 1
1 501 . 12 1 1 A 44 44 GLU N N 44 116.181 118.113 -1.932 1
1 502 . 12 1 1 A 45 45 VAL H H 45 8.428 9.004 -0.576 1
1 503 . 12 1 1 A 45 45 VAL HA H 45 4.492 5.201 -0.709 1
1 511 . 12 1 1 A 45 45 VAL C C 45 172.339 174.796 -2.457 1
1 512 . 12 1 1 A 45 45 VAL CA C 45 63.071 61.407 1.664 1
1 513 . 12 1 1 A 45 45 VAL CB C 45 35.145 34.823 0.322 1
1 516 . 12 1 1 A 45 45 VAL N N 45 123.272 126.090 -2.818 1
1 517 . 12 1 1 A 46 46 ASN H H 46 9.050 8.915 0.135 1
1 518 . 12 1 1 A 46 46 ASN HA H 46 5.261 5.461 -0.200 1
1 523 . 12 1 1 A 46 46 ASN C C 46 172.845 174.268 -1.423 1
1 524 . 12 1 1 A 46 46 ASN CA C 46 51.895 51.953 -0.058 1
1 525 . 12 1 1 A 46 46 ASN CB C 46 42.322 41.993 0.329 1
1 526 . 12 1 1 A 46 46 ASN N N 46 123.901 124.779 -0.878 1
1 528 . 12 1 1 A 47 47 CYS H H 47 9.039 9.206 -0.167 1
1 529 . 12 1 1 A 47 47 CYS HA H 47 5.160 5.360 -0.200 1
1 532 . 12 1 1 A 47 47 CYS C C 47 172.454 173.470 -1.016 1
1 533 . 12 1 1 A 47 47 CYS CA C 47 56.473 57.427 -0.954 1
1 534 . 12 1 1 A 47 47 CYS CB C 47 29.297 30.554 -1.257 1
1 535 . 12 1 1 A 47 47 CYS N N 47 119.663 117.629 2.034 1
1 536 . 12 1 1 A 48 48 VAL H H 48 9.083 8.828 0.255 1
1 537 . 12 1 1 A 48 48 VAL HA H 48 4.344 4.782 -0.438 1
1 542 . 12 1 1 A 48 48 VAL C C 48 173.307 174.833 -1.526 1
1 543 . 12 1 1 A 48 48 VAL CA C 48 61.368 60.733 0.635 1
1 544 . 12 1 1 A 48 48 VAL CB C 48 35.345 35.931 -0.586 1
1 546 . 12 1 1 A 48 48 VAL N N 48 124.672 123.247 1.425 1
1 547 . 12 1 1 A 49 49 GLY H H 49 9.019 9.039 -0.020 1
1 548 . 12 1 1 A 49 49 GLY HA2 H 49 3.460 4.186 -0.726 1
1 549 . 12 1 1 A 49 49 GLY HA3 H 49 4.539 4.191 0.348 1
1 550 . 12 1 1 A 49 49 GLY C C 49 171.278 172.277 -0.999 1
1 551 . 12 1 1 A 49 49 GLY CA C 49 45.075 44.534 0.541 1
1 552 . 12 1 1 A 49 49 GLY N N 49 113.131 115.386 -2.255 1
1 553 . 12 1 1 A 50 50 LEU H H 50 8.747 9.439 -0.692 1
1 554 . 12 1 1 A 50 50 LEU HA H 50 5.102 4.919 0.183 1
1 564 . 12 1 1 A 50 50 LEU CA C 50 51.417 51.316 0.101 1
1 565 . 12 1 1 A 50 50 LEU CB C 50 41.754 42.441 -0.687 1
1 569 . 12 1 1 A 50 50 LEU N N 50 124.471 126.865 -2.394 1
1 570 . 12 1 1 A 51 51 PRO HA H 51 4.106 4.236 -0.130 1
1 577 . 12 1 1 A 51 51 PRO C C 51 178.422 178.863 -0.441 1
1 578 . 12 1 1 A 51 51 PRO CA C 51 65.680 65.126 0.554 1
1 579 . 12 1 1 A 51 51 PRO CB C 51 31.939 32.006 -0.067 1
1 582 . 12 1 1 A 52 52 GLU H H 52 9.721 8.441 1.280 1
1 583 . 12 1 1 A 52 52 GLU HA H 52 4.176 4.072 0.104 1
1 588 . 12 1 1 A 52 52 GLU C C 52 176.146 178.181 -2.035 1
1 589 . 12 1 1 A 52 52 GLU CA C 52 59.158 59.258 -0.100 1
1 590 . 12 1 1 A 52 52 GLU CB C 52 28.442 29.395 -0.953 1
1 592 . 12 1 1 A 52 52 GLU N N 52 118.552 117.724 0.828 1
1 593 . 12 1 1 A 53 53 LEU H H 53 7.089 7.879 -0.790 1
1 594 . 12 1 1 A 53 53 LEU HA H 53 4.511 4.293 0.218 1
1 603 . 12 1 1 A 53 53 LEU C C 53 174.027 176.646 -2.619 1
1 604 . 12 1 1 A 53 53 LEU CA C 53 53.825 54.867 -1.042 1
1 605 . 12 1 1 A 53 53 LEU CB C 53 43.825 42.068 1.757 1
1 608 . 12 1 1 A 53 53 LEU N N 53 116.763 117.996 -1.233 1
1 609 . 12 1 1 A 54 54 GLN H H 54 7.964 7.922 0.042 1
1 610 . 12 1 1 A 54 54 GLN HA H 54 3.591 3.884 -0.293 1
1 616 . 12 1 1 A 54 54 GLN C C 54 172.604 174.697 -2.093 1
1 617 . 12 1 1 A 54 54 GLN CA C 54 56.961 57.279 -0.318 1
1 618 . 12 1 1 A 54 54 GLN CB C 54 26.545 27.884 -1.339 1
1 620 . 12 1 1 A 54 54 GLN N N 54 115.489 118.842 -3.353 1
1 622 . 12 1 1 A 55 55 LEU H H 55 7.139 7.444 -0.305 1
1 623 . 12 1 1 A 55 55 LEU HA H 55 4.750 4.967 -0.217 1
1 629 . 12 1 1 A 55 55 LEU C C 55 173.475 175.805 -2.330 1
1 630 . 12 1 1 A 55 55 LEU CA C 55 53.698 52.544 1.154 1
1 631 . 12 1 1 A 55 55 LEU CB C 55 47.859 45.064 2.795 1
1 633 . 12 1 1 A 55 55 LEU N N 55 116.422 115.489 0.933 1
1 634 . 12 1 1 A 56 56 ILE H H 56 8.223 8.637 -0.414 1
1 635 . 12 1 1 A 56 56 ILE HA H 56 4.540 5.417 -0.877 1
1 643 . 12 1 1 A 56 56 ILE C C 56 173.938 174.517 -0.579 1
1 644 . 12 1 1 A 56 56 ILE CA C 56 61.020 59.608 1.412 1
1 645 . 12 1 1 A 56 56 ILE CB C 56 39.403 41.128 -1.725 1
1 648 . 12 1 1 A 56 56 ILE N N 56 122.792 120.236 2.556 1
1 649 . 12 1 1 A 57 57 CYS H H 57 8.995 8.872 0.123 1
1 650 . 12 1 1 A 57 57 CYS HA H 57 5.036 5.206 -0.170 1
1 653 . 12 1 1 A 57 57 CYS C C 57 170.483 173.032 -2.549 1
1 654 . 12 1 1 A 57 57 CYS CA C 57 56.484 57.494 -1.010 1
1 655 . 12 1 1 A 57 57 CYS CB C 57 30.545 31.534 -0.989 1
1 656 . 12 1 1 A 57 57 CYS N N 57 121.575 123.452 -1.877 1
1 657 . 12 1 1 A 58 58 LEU H H 58 9.076 8.857 0.219 1
1 658 . 12 1 1 A 58 58 LEU HA H 58 5.472 5.687 -0.215 1
1 668 . 12 1 1 A 58 58 LEU C C 58 174.009 175.826 -1.817 1
1 669 . 12 1 1 A 58 58 LEU CA C 58 52.851 53.661 -0.810 1
1 670 . 12 1 1 A 58 58 LEU CB C 58 42.177 42.817 -0.640 1
1 674 . 12 1 1 A 58 58 LEU N N 58 121.895 125.154 -3.259 1
1 675 . 12 1 1 A 59 59 VAL H H 59 8.966 8.544 0.422 1
1 676 . 12 1 1 A 59 59 VAL HA H 59 5.488 5.344 0.144 1
1 681 . 12 1 1 A 59 59 VAL C C 59 176.034 175.913 0.121 1
1 682 . 12 1 1 A 59 59 VAL CA C 59 59.820 60.818 -0.998 1
1 683 . 12 1 1 A 59 59 VAL CB C 59 34.786 35.114 -0.328 1
1 685 . 12 1 1 A 59 59 VAL N N 59 121.702 124.195 -2.493 1
1 686 . 12 1 1 A 60 60 GLY H H 60 9.258 8.021 1.237 1
1 687 . 12 1 1 A 60 60 GLY HA2 H 60 4.673 4.385 0.288 1
1 688 . 12 1 1 A 60 60 GLY HA3 H 60 4.804 4.490 0.314 1
1 689 . 12 1 1 A 60 60 GLY C C 60 169.831 172.465 -2.634 1
1 690 . 12 1 1 A 60 60 GLY CA C 60 46.399 46.410 -0.011 1
1 691 . 12 1 1 A 60 60 GLY N N 60 114.126 112.523 1.603 1
1 692 . 12 1 1 A 61 61 THR H H 61 8.834 8.218 0.616 1
1 693 . 12 1 1 A 61 61 THR HA H 61 4.418 4.937 -0.519 1
1 698 . 12 1 1 A 61 61 THR C C 61 171.985 174.620 -2.635 1
1 699 . 12 1 1 A 61 61 THR CA C 61 60.634 60.523 0.111 1
1 700 . 12 1 1 A 61 61 THR CB C 61 70.983 70.602 0.381 1
1 702 . 12 1 1 A 61 61 THR N N 61 114.856 113.041 1.815 1
1 703 . 12 1 1 A 62 62 GLU H H 62 8.502 8.457 0.045 1
1 704 . 12 1 1 A 62 62 GLU HA H 62 2.867 3.016 -0.149 1
1 709 . 12 1 1 A 62 62 GLU C C 62 174.650 175.761 -1.111 1
1 710 . 12 1 1 A 62 62 GLU CA C 62 58.785 58.430 0.355 1
1 711 . 12 1 1 A 62 62 GLU CB C 62 28.981 29.087 -0.106 1
1 713 . 12 1 1 A 62 62 GLU N N 62 129.915 123.574 6.341 1
1 714 . 12 1 1 A 63 63 ILE H H 63 6.928 7.796 -0.868 1
1 715 . 12 1 1 A 63 63 ILE HA H 63 4.038 4.461 -0.423 1
1 725 . 12 1 1 A 63 63 ILE C C 63 173.482 174.997 -1.515 1
1 726 . 12 1 1 A 63 63 ILE CA C 63 58.664 59.649 -0.985 1
1 727 . 12 1 1 A 63 63 ILE CB C 63 40.009 41.316 -1.307 1
1 731 . 12 1 1 A 63 63 ILE N N 63 117.075 117.784 -0.709 1
1 732 . 12 1 1 A 64 64 GLU H H 64 8.585 8.279 0.306 1
1 733 . 12 1 1 A 64 64 GLU HA H 64 3.427 3.887 -0.460 1
1 738 . 12 1 1 A 64 64 GLU C C 64 175.186 176.666 -1.480 1
1 739 . 12 1 1 A 64 64 GLU CA C 64 58.703 56.817 1.886 1
1 740 . 12 1 1 A 64 64 GLU CB C 64 28.999 29.239 -0.240 1
1 742 . 12 1 1 A 64 64 GLU N N 64 126.422 127.259 -0.837 1
1 743 . 12 1 1 A 65 65 GLY H H 65 8.754 8.791 -0.037 1
1 744 . 12 1 1 A 65 65 GLY HA2 H 65 3.631 3.919 -0.288 1
1 745 . 12 1 1 A 65 65 GLY HA3 H 65 4.287 3.936 0.351 1
1 746 . 12 1 1 A 65 65 GLY C C 65 174.005 174.789 -0.784 1
1 747 . 12 1 1 A 65 65 GLY CA C 65 44.954 45.025 -0.071 1
1 748 . 12 1 1 A 65 65 GLY N N 65 114.614 112.235 2.379 1
1 749 . 12 1 1 A 66 66 GLU H H 66 7.760 7.524 0.236 1
1 750 . 12 1 1 A 66 66 GLU HA H 66 4.462 4.633 -0.171 1
1 754 . 12 1 1 A 66 66 GLU C C 66 175.255 175.782 -0.527 1
1 755 . 12 1 1 A 66 66 GLU CA C 66 55.582 55.710 -0.128 1
1 756 . 12 1 1 A 66 66 GLU CB C 66 30.654 31.418 -0.764 1
1 758 . 12 1 1 A 66 66 GLU N N 66 119.292 120.424 -1.132 1
1 759 . 12 1 1 A 67 67 GLY H H 67 8.262 8.326 -0.064 1
1 760 . 12 1 1 A 67 67 GLY HA2 H 67 3.875 4.157 -0.282 1
1 761 . 12 1 1 A 67 67 GLY HA3 H 67 4.088 4.177 -0.089 1
1 762 . 12 1 1 A 67 67 GLY C C 67 172.197 173.482 -1.285 1
1 763 . 12 1 1 A 67 67 GLY CA C 67 44.845 45.224 -0.379 1
1 764 . 12 1 1 A 67 67 GLY N N 67 106.161 108.642 -2.481 1
1 765 . 12 1 1 A 68 68 LEU H H 68 8.142 8.090 0.052 1
1 766 . 12 1 1 A 68 68 LEU HA H 68 4.491 4.766 -0.275 1
1 775 . 12 1 1 A 68 68 LEU C C 68 176.194 174.657 1.537 1
1 776 . 12 1 1 A 68 68 LEU CA C 68 55.123 54.227 0.896 1
1 777 . 12 1 1 A 68 68 LEU CB C 68 44.527 42.353 2.174 1
1 780 . 12 1 1 A 68 68 LEU N N 68 120.269 121.344 -1.075 1
1 781 . 12 1 1 A 69 69 GLN H H 69 9.253 8.328 0.925 1
1 782 . 12 1 1 A 69 69 GLN HA H 69 4.770 5.021 -0.251 1
1 788 . 12 1 1 A 69 69 GLN C C 69 173.607 174.442 -0.835 1
1 789 . 12 1 1 A 69 69 GLN CA C 69 54.736 54.836 -0.100 1
1 790 . 12 1 1 A 69 69 GLN CB C 69 33.782 31.640 2.142 1
1 792 . 12 1 1 A 69 69 GLN N N 69 119.336 124.288 -4.952 1
1 794 . 12 1 1 A 70 70 THR H H 70 8.803 9.114 -0.311 1
1 795 . 12 1 1 A 70 70 THR HA H 70 5.033 5.190 -0.157 1
1 800 . 12 1 1 A 70 70 THR C C 70 172.596 174.067 -1.471 1
1 801 . 12 1 1 A 70 70 THR CA C 70 62.768 61.940 0.828 1
1 802 . 12 1 1 A 70 70 THR CB C 70 69.990 70.903 -0.913 1
1 804 . 12 1 1 A 70 70 THR N N 70 118.372 119.769 -1.397 1
1 805 . 12 1 1 A 71 71 VAL H H 71 9.882 9.529 0.353 1
1 806 . 12 1 1 A 71 71 VAL HA H 71 5.239 5.491 -0.252 1
1 811 . 12 1 1 A 71 71 VAL C C 71 174.015 174.382 -0.367 1
1 812 . 12 1 1 A 71 71 VAL CA C 71 60.577 59.638 0.939 1
1 813 . 12 1 1 A 71 71 VAL CB C 71 34.149 34.402 -0.253 1
1 815 . 12 1 1 A 71 71 VAL N N 71 129.063 121.684 7.379 1
1 816 . 12 1 1 A 72 72 VAL H H 72 9.491 8.630 0.861 1
1 817 . 12 1 1 A 72 72 VAL HA H 72 4.672 4.732 -0.060 1
1 825 . 12 1 1 A 72 72 VAL CA C 72 59.568 57.633 1.935 1
1 826 . 12 1 1 A 72 72 VAL CB C 72 34.057 34.954 -0.897 1
1 829 . 12 1 1 A 72 72 VAL N N 72 128.521 124.786 3.735 1
1 830 . 12 1 1 A 73 73 PRO HA H 73 5.368 4.503 0.865 1
1 836 . 12 1 1 A 73 73 PRO C C 73 175.079 176.181 -1.102 1
1 837 . 12 1 1 A 73 73 PRO CA C 73 61.324 62.836 -1.512 1
1 838 . 12 1 1 A 73 73 PRO CB C 73 33.089 32.242 0.847 1
1 841 . 12 1 1 A 74 74 THR H H 74 9.103 8.807 0.296 1
1 842 . 12 1 1 A 74 74 THR HA H 74 5.191 4.798 0.393 1
1 847 . 12 1 1 A 74 74 THR CA C 74 57.986 59.425 -1.439 1
1 848 . 12 1 1 A 74 74 THR CB C 74 72.212 72.085 0.127 1
1 850 . 12 1 1 A 74 74 THR N N 74 118.075 118.314 -0.239 1
1 851 . 12 1 1 A 75 75 PRO HA H 75 5.015 4.809 0.206 1
1 858 . 12 1 1 A 75 75 PRO C C 75 178.704 177.419 1.285 1
1 859 . 12 1 1 A 75 75 PRO CA C 75 63.038 62.178 0.860 1
1 860 . 12 1 1 A 75 75 PRO CB C 75 32.529 32.986 -0.457 1
1 863 . 12 1 1 A 76 76 ILE H H 76 8.221 8.209 0.012 1
1 864 . 12 1 1 A 76 76 ILE HA H 76 4.218 3.799 0.419 1
1 873 . 12 1 1 A 76 76 ILE C C 76 172.375 176.633 -4.258 1
1 874 . 12 1 1 A 76 76 ILE CA C 76 63.509 63.772 -0.263 1
1 875 . 12 1 1 A 76 76 ILE CB C 76 39.322 37.861 1.461 1
1 879 . 12 1 1 A 76 76 ILE N N 76 122.273 122.275 -0.002 1
1 880 . 12 1 1 A 77 77 THR H H 77 6.984 7.533 -0.549 1
1 881 . 12 1 1 A 77 77 THR HA H 77 4.227 4.524 -0.297 1
1 886 . 12 1 1 A 77 77 THR C C 77 173.531 173.907 -0.376 1
1 887 . 12 1 1 A 77 77 THR CA C 77 61.435 61.523 -0.088 1
1 888 . 12 1 1 A 77 77 THR CB C 77 68.944 69.914 -0.970 1
1 890 . 12 1 1 A 77 77 THR N N 77 105.803 108.070 -2.267 1
1 891 . 12 1 1 A 78 78 ALA H H 78 7.647 7.534 0.113 1
1 892 . 12 1 1 A 78 78 ALA HA H 78 4.757 4.644 0.113 1
1 896 . 12 1 1 A 78 78 ALA C C 78 173.520 176.812 -3.292 1
1 897 . 12 1 1 A 78 78 ALA CA C 78 51.164 50.702 0.462 1
1 898 . 12 1 1 A 78 78 ALA CB C 78 20.011 22.449 -2.438 1
1 899 . 12 1 1 A 78 78 ALA N N 78 126.635 124.752 1.883 1
1 900 . 12 1 1 A 79 79 SER H H 79 7.884 8.783 -0.899 1
1 901 . 12 1 1 A 79 79 SER HA H 79 4.386 5.293 -0.907 1
1 903 . 12 1 1 A 79 79 SER C C 79 176.077 173.261 2.816 1
1 904 . 12 1 1 A 79 79 SER CA C 79 57.465 55.807 1.658 1
1 905 . 12 1 1 A 79 79 SER CB C 79 65.285 65.490 -0.205 1
1 906 . 12 1 1 A 79 79 SER N N 79 115.272 113.172 2.100 1
1 907 . 12 1 1 A 80 80 LEU H H 80 7.700 8.844 -1.144 1
1 908 . 12 1 1 A 80 80 LEU HA H 80 4.912 5.105 -0.193 1
1 915 . 12 1 1 A 80 80 LEU C C 80 173.927 175.047 -1.120 1
1 916 . 12 1 1 A 80 80 LEU CA C 80 53.829 53.611 0.218 1
1 917 . 12 1 1 A 80 80 LEU CB C 80 45.990 44.928 1.062 1
1 920 . 12 1 1 A 80 80 LEU N N 80 121.507 125.453 -3.946 1
1 921 . 12 1 1 A 81 81 SER H H 81 7.885 8.729 -0.844 1
1 922 . 12 1 1 A 81 81 SER HA H 81 5.269 4.812 0.457 1
1 925 . 12 1 1 A 81 81 SER C C 81 175.756 174.902 0.854 1
1 926 . 12 1 1 A 81 81 SER CA C 81 55.507 57.214 -1.707 1
1 927 . 12 1 1 A 81 81 SER CB C 81 65.966 65.856 0.110 1
1 928 . 12 1 1 A 81 81 SER N N 81 118.323 115.914 2.409 1
1 929 . 12 1 1 A 82 82 HIS H H 82 8.935 8.873 0.062 1
1 930 . 12 1 1 A 82 82 HIS HA H 82 4.407 4.413 -0.006 1
1 932 . 12 1 1 A 82 82 HIS C C 82 176.550 177.140 -0.590 1
1 933 . 12 1 1 A 82 82 HIS CA C 82 60.960 58.635 2.325 1
1 934 . 12 1 1 A 82 82 HIS CB C 82 30.755 29.121 1.634 1
1 935 . 12 1 1 A 82 82 HIS N N 82 124.042 118.573 5.469 1
1 936 . 12 1 1 A 83 83 ASN H H 83 8.435 8.221 0.214 1
1 937 . 12 1 1 A 83 83 ASN HA H 83 4.439 4.306 0.133 1
1 941 . 12 1 1 A 83 83 ASN C C 83 174.769 177.376 -2.607 1
1 942 . 12 1 1 A 83 83 ASN CA C 83 56.575 56.502 0.073 1
1 943 . 12 1 1 A 83 83 ASN CB C 83 38.731 38.465 0.266 1
1 944 . 12 1 1 A 83 83 ASN N N 83 118.543 119.268 -0.725 1
1 946 . 12 1 1 A 84 84 ARG H H 84 7.716 8.130 -0.414 1
1 947 . 12 1 1 A 84 84 ARG HA H 84 4.183 4.050 0.133 1
1 953 . 12 1 1 A 84 84 ARG C C 84 177.399 178.706 -1.307 1
1 954 . 12 1 1 A 84 84 ARG CA C 84 59.045 58.907 0.138 1
1 955 . 12 1 1 A 84 84 ARG CB C 84 29.992 29.911 0.081 1
1 957 . 12 1 1 A 84 84 ARG N N 84 121.312 118.543 2.769 1
1 958 . 12 1 1 A 85 85 ILE H H 85 8.354 7.510 0.844 1
1 959 . 12 1 1 A 85 85 ILE HA H 85 3.650 4.187 -0.537 1
1 967 . 12 1 1 A 85 85 ILE C C 85 176.098 178.153 -2.055 1
1 968 . 12 1 1 A 85 85 ILE CA C 85 66.704 64.736 1.968 1
1 969 . 12 1 1 A 85 85 ILE CB C 85 38.017 37.621 0.396 1
1 972 . 12 1 1 A 85 85 ILE N N 85 119.321 118.363 0.958 1
1 973 . 12 1 1 A 86 86 ARG H H 86 7.690 7.654 0.036 1
1 974 . 12 1 1 A 86 86 ARG HA H 86 3.704 3.979 -0.275 1
1 981 . 12 1 1 A 86 86 ARG C C 86 177.524 178.758 -1.234 1
1 982 . 12 1 1 A 86 86 ARG CA C 86 59.881 59.774 0.107 1
1 983 . 12 1 1 A 86 86 ARG CB C 86 29.248 29.617 -0.369 1
1 986 . 12 1 1 A 86 86 ARG N N 86 118.362 121.824 -3.462 1
1 987 . 12 1 1 A 87 87 GLU H H 87 7.884 7.902 -0.018 1
1 988 . 12 1 1 A 87 87 GLU HA H 87 4.064 4.132 -0.068 1
1 993 . 12 1 1 A 87 87 GLU C C 87 178.785 179.291 -0.506 1
1 994 . 12 1 1 A 87 87 GLU CA C 87 58.999 58.752 0.247 1
1 995 . 12 1 1 A 87 87 GLU CB C 87 29.872 30.126 -0.254 1
1 997 . 12 1 1 A 87 87 GLU N N 87 118.124 119.210 -1.086 1
1 998 . 12 1 1 A 88 88 ILE H H 88 8.715 8.104 0.611 1
1 999 . 12 1 1 A 88 88 ILE HA H 88 3.305 3.551 -0.246 1
1 1009 . 12 1 1 A 88 88 ILE C C 88 177.261 178.887 -1.626 1
1 1010 . 12 1 1 A 88 88 ILE CA C 88 65.822 64.745 1.077 1
1 1011 . 12 1 1 A 88 88 ILE CB C 88 37.370 36.930 0.440 1
1 1015 . 12 1 1 A 88 88 ILE N N 88 122.929 120.966 1.963 1
1 1016 . 12 1 1 A 89 89 LEU H H 89 8.486 8.998 -0.512 1
1 1017 . 12 1 1 A 89 89 LEU HA H 89 3.932 3.884 0.048 1
1 1023 . 12 1 1 A 89 89 LEU C C 89 177.919 179.105 -1.186 1
1 1024 . 12 1 1 A 89 89 LEU CA C 89 59.060 58.378 0.682 1
1 1025 . 12 1 1 A 89 89 LEU CB C 89 41.129 41.660 -0.531 1
1 1028 . 12 1 1 A 89 89 LEU N N 89 122.696 121.160 1.536 1
1 1029 . 12 1 1 A 90 90 LYS H H 90 7.790 7.910 -0.120 1
1 1030 . 12 1 1 A 90 90 LYS HA H 90 4.061 3.930 0.131 1
1 1035 . 12 1 1 A 90 90 LYS C C 90 178.432 178.608 -0.176 1
1 1036 . 12 1 1 A 90 90 LYS CA C 90 59.840 59.269 0.571 1
1 1037 . 12 1 1 A 90 90 LYS CB C 90 32.582 32.230 0.352 1
1 1039 . 12 1 1 A 90 90 LYS N N 90 118.640 120.049 -1.409 1
1 1040 . 12 1 1 A 91 91 ALA H H 91 8.113 8.204 -0.091 1
1 1041 . 12 1 1 A 91 91 ALA HA H 91 4.151 4.056 0.095 1
1 1045 . 12 1 1 A 91 91 ALA C C 91 179.147 179.853 -0.706 1
1 1046 . 12 1 1 A 91 91 ALA CA C 91 54.942 55.204 -0.262 1
1 1047 . 12 1 1 A 91 91 ALA CB C 91 18.242 18.583 -0.341 1
1 1048 . 12 1 1 A 91 91 ALA N N 91 122.939 121.821 1.118 1
1 1049 . 12 1 1 A 92 92 SER H H 92 8.858 8.571 0.287 1
1 1050 . 12 1 1 A 92 92 SER HA H 92 4.898 4.198 0.700 1
1 1052 . 12 1 1 A 92 92 SER C C 92 172.440 176.809 -4.369 1
1 1053 . 12 1 1 A 92 92 SER CA C 92 61.913 60.560 1.353 1
1 1054 . 12 1 1 A 92 92 SER CB C 92 63.081 62.905 0.176 1
1 1055 . 12 1 1 A 92 92 SER N N 92 114.526 113.334 1.192 1
1 1056 . 12 1 1 A 93 93 ARG H H 93 7.704 8.276 -0.572 1
1 1057 . 12 1 1 A 93 93 ARG HA H 93 4.162 4.200 -0.038 1
1 1059 . 12 1 1 A 93 93 ARG C C 93 177.757 178.606 -0.849 1
1 1060 . 12 1 1 A 93 93 ARG CA C 93 59.544 59.148 0.396 1
1 1061 . 12 1 1 A 93 93 ARG CB C 93 30.343 29.876 0.467 1
1 1062 . 12 1 1 A 93 93 ARG N N 93 121.505 121.971 -0.466 1
1 1063 . 12 1 1 A 94 94 LYS H H 94 7.456 7.521 -0.065 1
1 1064 . 12 1 1 A 94 94 LYS HA H 94 4.174 4.134 0.040 1
1 1071 . 12 1 1 A 94 94 LYS C C 94 178.861 178.773 0.088 1
1 1072 . 12 1 1 A 94 94 LYS CA C 94 59.030 59.231 -0.201 1
1 1073 . 12 1 1 A 94 94 LYS CB C 94 32.239 32.301 -0.062 1
1 1077 . 12 1 1 A 94 94 LYS N N 94 119.072 119.934 -0.862 1
1 1078 . 12 1 1 A 95 95 LEU H H 95 8.148 7.857 0.291 1
1 1079 . 12 1 1 A 95 95 LEU HA H 95 4.129 4.131 -0.002 1
1 1088 . 12 1 1 A 95 95 LEU C C 95 177.274 177.757 -0.483 1
1 1089 . 12 1 1 A 95 95 LEU CA C 95 57.136 57.201 -0.065 1
1 1090 . 12 1 1 A 95 95 LEU CB C 95 41.908 41.663 0.245 1
1 1093 . 12 1 1 A 95 95 LEU N N 95 119.717 117.041 2.676 1
1 1094 . 12 1 1 A 96 96 GLN H H 96 7.807 8.092 -0.285 1
1 1095 . 12 1 1 A 96 96 GLN HA H 96 4.242 4.431 -0.189 1
1 1102 . 12 1 1 A 96 96 GLN C C 96 175.371 176.086 -0.715 1
1 1103 . 12 1 1 A 96 96 GLN CA C 96 56.397 55.684 0.713 1
1 1104 . 12 1 1 A 96 96 GLN CB C 96 29.123 30.063 -0.940 1
1 1106 . 12 1 1 A 96 96 GLN N N 96 114.581 116.813 -2.232 1
1 1108 . 12 1 1 A 97 97 GLY H H 97 7.802 7.723 0.079 1
1 1109 . 12 1 1 A 97 97 GLY HA2 H 97 3.839 3.930 -0.091 1
1 1110 . 12 1 1 A 97 97 GLY HA3 H 97 4.096 3.930 0.166 1
1 1111 . 12 1 1 A 97 97 GLY C C 97 172.636 173.883 -1.247 1
1 1112 . 12 1 1 A 97 97 GLY CA C 97 46.372 46.692 -0.320 1
1 1113 . 12 1 1 A 97 97 GLY N N 97 106.959 109.543 -2.584 1
1 1114 . 12 1 1 A 98 98 ASP H H 98 8.156 8.559 -0.403 1
1 1115 . 12 1 1 A 98 98 ASP HA H 98 4.754 5.117 -0.363 1
1 1118 . 12 1 1 A 98 98 ASP CA C 98 52.882 50.716 2.166 1
1 1119 . 12 1 1 A 98 98 ASP CB C 98 41.603 42.297 -0.694 1
1 1120 . 12 1 1 A 98 98 ASP N N 98 118.447 122.688 -4.241 1
1 1121 . 12 1 1 A 99 99 PRO HA H 99 4.470 4.642 -0.172 1
1 1126 . 12 1 1 A 99 99 PRO C C 99 175.500 176.621 -1.121 1
1 1127 . 12 1 1 A 99 99 PRO CA C 99 63.601 63.156 0.445 1
1 1128 . 12 1 1 A 99 99 PRO CB C 99 32.423 31.277 1.146 1
1 1130 . 12 1 1 A 100 100 ASP H H 100 8.527 8.313 0.214 1
1 1131 . 12 1 1 A 100 100 ASP HA H 100 4.778 4.223 0.555 1
1 1134 . 12 1 1 A 100 100 ASP C C 100 174.931 175.546 -0.615 1
1 1135 . 12 1 1 A 100 100 ASP CA C 100 53.915 55.640 -1.725 1
1 1136 . 12 1 1 A 100 100 ASP CB C 100 40.665 40.162 0.503 1
1 1137 . 12 1 1 A 100 100 ASP N N 100 119.340 118.042 1.298 1
1 1138 . 12 1 1 A 101 101 LEU H H 101 7.379 7.505 -0.126 1
1 1139 . 12 1 1 A 101 101 LEU HA H 101 4.682 4.552 0.130 1
1 1148 . 12 1 1 A 101 101 LEU CA C 101 52.956 53.146 -0.190 1
1 1149 . 12 1 1 A 101 101 LEU CB C 101 43.393 41.880 1.513 1
1 1152 . 12 1 1 A 101 101 LEU N N 101 122.107 117.217 4.890 1
1 1153 . 12 1 1 A 102 102 PRO HA H 102 4.487 4.619 -0.132 1
1 1158 . 12 1 1 A 102 102 PRO C C 102 175.697 175.609 0.088 1
1 1159 . 12 1 1 A 102 102 PRO CA C 102 63.113 62.931 0.182 1
1 1160 . 12 1 1 A 102 102 PRO CB C 102 32.138 31.823 0.315 1
1 1163 . 12 1 1 A 103 103 MET H H 103 9.011 8.769 0.242 1
1 1164 . 12 1 1 A 103 103 MET HA H 103 4.769 5.048 -0.279 1
1 1171 . 12 1 1 A 103 103 MET C C 103 174.080 174.138 -0.058 1
1 1172 . 12 1 1 A 103 103 MET CA C 103 54.737 53.555 1.182 1
1 1173 . 12 1 1 A 103 103 MET CB C 103 34.857 35.069 -0.212 1
1 1176 . 12 1 1 A 103 103 MET N N 103 123.334 122.525 0.809 1
1 1177 . 12 1 1 A 104 104 SER H H 104 8.239 8.569 -0.330 1
1 1178 . 12 1 1 A 104 104 SER HA H 104 5.079 5.062 0.017 1
1 1181 . 12 1 1 A 104 104 SER C C 104 171.795 172.649 -0.854 1
1 1182 . 12 1 1 A 104 104 SER CA C 104 57.641 57.690 -0.049 1
1 1183 . 12 1 1 A 104 104 SER CB C 104 66.282 66.235 0.047 1
1 1184 . 12 1 1 A 104 104 SER N N 104 114.434 114.164 0.270 1
1 1185 . 12 1 1 A 105 105 PHE H H 105 9.003 8.092 0.911 1
1 1186 . 12 1 1 A 105 105 PHE HA H 105 5.209 5.210 -0.001 1
1 1193 . 12 1 1 A 105 105 PHE C C 105 170.688 171.959 -1.271 1
1 1194 . 12 1 1 A 105 105 PHE CA C 105 56.917 56.006 0.911 1
1 1195 . 12 1 1 A 105 105 PHE CB C 105 41.350 41.271 0.079 1
1 1196 . 12 1 1 A 105 105 PHE N N 105 116.224 117.302 -1.078 1
1 1197 . 12 1 1 A 106 106 THR H H 106 9.074 8.937 0.137 1
1 1198 . 12 1 1 A 106 106 THR HA H 106 4.664 4.866 -0.202 1
1 1203 . 12 1 1 A 106 106 THR C C 106 171.767 174.481 -2.714 1
1 1204 . 12 1 1 A 106 106 THR CA C 106 62.162 62.092 0.070 1
1 1205 . 12 1 1 A 106 106 THR CB C 106 70.072 69.988 0.084 1
1 1207 . 12 1 1 A 106 106 THR N N 106 117.469 116.180 1.289 1
1 1208 . 12 1 1 A 107 107 LEU H H 107 9.804 8.948 0.856 1
1 1209 . 12 1 1 A 107 107 LEU HA H 107 4.750 4.832 -0.082 1
1 1219 . 12 1 1 A 107 107 LEU C C 107 172.742 176.265 -3.523 1
1 1220 . 12 1 1 A 107 107 LEU CA C 107 54.151 54.308 -0.157 1
1 1221 . 12 1 1 A 107 107 LEU CB C 107 44.486 43.272 1.214 1
1 1224 . 12 1 1 A 107 107 LEU N N 107 133.400 127.977 5.423 1
1 1225 . 12 1 1 A 108 108 ALA H H 108 8.435 8.838 -0.403 1
1 1226 . 12 1 1 A 108 108 ALA HA H 108 4.683 4.539 0.144 1
1 1230 . 12 1 1 A 108 108 ALA C C 108 173.052 175.470 -2.418 1
1 1231 . 12 1 1 A 108 108 ALA CA C 108 49.308 50.219 -0.911 1
1 1232 . 12 1 1 A 108 108 ALA CB C 108 22.120 20.002 2.118 1
1 1233 . 12 1 1 A 108 108 ALA N N 108 131.422 126.987 4.435 1
1 1234 . 12 1 1 A 109 109 ILE H H 109 8.909 9.157 -0.248 1
1 1235 . 12 1 1 A 109 109 ILE HA H 109 4.063 5.018 -0.955 1
1 1245 . 12 1 1 A 109 109 ILE CA C 109 60.982 60.599 0.383 1
1 1246 . 12 1 1 A 109 109 ILE CB C 109 39.074 37.929 1.145 1
1 1250 . 12 1 1 A 109 109 ILE N N 109 124.415 123.830 0.585 1
1 1251 . 12 1 1 A 110 110 VAL H H 110 8.706 8.951 -0.245 1
1 1252 . 12 1 1 A 110 110 VAL HA H 110 4.324 5.160 -0.836 1
1 1260 . 12 1 1 A 110 110 VAL C C 110 175.700 173.167 2.533 1
1 1261 . 12 1 1 A 110 110 VAL CA C 110 62.316 59.498 2.818 1
1 1262 . 12 1 1 A 110 110 VAL CB C 110 31.876 34.449 -2.573 1
1 1264 . 12 1 1 A 110 110 VAL N N 110 127.457 126.468 0.989 1
1 1265 . 12 1 1 A 111 111 GLU H H 111 9.024 8.455 0.569 1
1 1266 . 12 1 1 A 111 111 GLU HA H 111 4.403 4.560 -0.157 1
1 1269 . 12 1 1 A 111 111 GLU C C 111 175.987 177.645 -1.658 1
1 1270 . 12 1 1 A 111 111 GLU CA C 111 56.842 55.379 1.463 1
1 1271 . 12 1 1 A 111 111 GLU CB C 111 31.044 31.278 -0.234 1
1 1272 . 12 1 1 A 111 111 GLU N N 111 129.768 129.728 0.040 1
1 1273 . 12 1 1 A 112 112 SER H H 112 9.143 8.819 0.324 1
1 1274 . 12 1 1 A 112 112 SER HA H 112 4.394 4.536 -0.142 1
1 1276 . 12 1 1 A 112 112 SER C C 112 173.187 174.351 -1.164 1
1 1277 . 12 1 1 A 112 112 SER CA C 112 60.180 59.660 0.520 1
1 1278 . 12 1 1 A 112 112 SER CB C 112 63.415 62.731 0.684 1
1 1279 . 12 1 1 A 112 112 SER N N 112 115.956 118.891 -2.935 1
1 1280 . 12 1 1 A 113 113 ASP H H 113 8.133 7.764 0.369 1
1 1281 . 12 1 1 A 113 113 ASP HA H 113 4.573 4.823 -0.250 1
1 1284 . 12 1 1 A 113 113 ASP C C 113 175.430 176.203 -0.773 1
1 1285 . 12 1 1 A 113 113 ASP CA C 113 54.115 55.324 -1.209 1
1 1286 . 12 1 1 A 113 113 ASP CB C 113 40.011 42.690 -2.679 1
1 1287 . 12 1 1 A 113 113 ASP N N 113 118.343 120.994 -2.651 1
1 1288 . 12 1 1 A 114 114 SER H H 114 8.034 7.695 0.339 1
1 1289 . 12 1 1 A 114 114 SER HA H 114 4.057 4.615 -0.558 1
1 1291 . 12 1 1 A 114 114 SER C C 114 172.209 173.600 -1.391 1
1 1292 . 12 1 1 A 114 114 SER CA C 114 60.179 57.646 2.533 1
1 1293 . 12 1 1 A 114 114 SER CB C 114 62.702 64.896 -2.194 1
1 1294 . 12 1 1 A 114 114 SER N N 114 109.836 110.453 -0.617 1
1 1295 . 12 1 1 A 115 115 THR H H 115 7.711 7.785 -0.074 1
1 1296 . 12 1 1 A 115 115 THR HA H 115 4.250 4.753 -0.503 1
1 1300 . 12 1 1 A 115 115 THR C C 115 171.500 172.990 -1.490 1
1 1301 . 12 1 1 A 115 115 THR CA C 115 63.547 60.928 2.619 1
1 1302 . 12 1 1 A 115 115 THR CB C 115 69.595 70.873 -1.278 1
1 1303 . 12 1 1 A 115 115 THR N N 115 117.407 115.353 2.054 1
1 1304 . 12 1 1 A 116 116 ILE H H 116 8.219 9.192 -0.973 1
1 1305 . 12 1 1 A 116 116 ILE HA H 116 4.769 5.079 -0.310 1
1 1315 . 12 1 1 A 116 116 ILE C C 116 174.434 174.636 -0.202 1
1 1316 . 12 1 1 A 116 116 ILE CA C 116 60.306 59.265 1.041 1
1 1317 . 12 1 1 A 116 116 ILE CB C 116 40.686 38.990 1.696 1
1 1321 . 12 1 1 A 116 116 ILE N N 116 125.480 128.738 -3.258 1
1 1322 . 12 1 1 A 117 117 VAL H H 117 8.695 9.265 -0.570 1
1 1323 . 12 1 1 A 117 117 VAL HA H 117 4.315 4.733 -0.418 1
1 1328 . 12 1 1 A 117 117 VAL C C 117 172.243 174.513 -2.270 1
1 1329 . 12 1 1 A 117 117 VAL CA C 117 60.621 60.671 -0.050 1
1 1330 . 12 1 1 A 117 117 VAL CB C 117 34.558 34.211 0.347 1
1 1332 . 12 1 1 A 117 117 VAL N N 117 127.887 127.076 0.811 1
1 1333 . 12 1 1 A 118 118 TYR H H 118 8.270 8.790 -0.520 1
1 1334 . 12 1 1 A 118 118 TYR HA H 118 5.327 5.497 -0.170 1
1 1342 . 12 1 1 A 118 118 TYR C C 118 174.250 174.797 -0.547 1
1 1343 . 12 1 1 A 118 118 TYR CA C 118 57.283 56.790 0.493 1
1 1344 . 12 1 1 A 118 118 TYR CB C 118 39.262 39.687 -0.425 1
1 1345 . 12 1 1 A 118 118 TYR N N 118 124.822 126.867 -2.045 1
1 1346 . 12 1 1 A 119 119 TYR H H 119 9.207 9.039 0.168 1
1 1347 . 12 1 1 A 119 119 TYR HA H 119 4.821 5.330 -0.509 1
1 1354 . 12 1 1 A 119 119 TYR C C 119 171.994 173.714 -1.720 1
1 1355 . 12 1 1 A 119 119 TYR CA C 119 58.116 56.728 1.388 1
1 1356 . 12 1 1 A 119 119 TYR CB C 119 43.544 42.118 1.426 1
1 1357 . 12 1 1 A 119 119 TYR N N 119 125.153 124.172 0.981 1
1 1358 . 12 1 1 A 120 120 LYS H H 120 7.700 8.302 -0.602 1
1 1359 . 12 1 1 A 120 120 LYS HA H 120 4.558 4.509 0.049 1
1 1366 . 12 1 1 A 120 120 LYS C C 120 172.017 174.889 -2.872 1
1 1367 . 12 1 1 A 120 120 LYS CA C 120 57.217 56.360 0.857 1
1 1368 . 12 1 1 A 120 120 LYS CB C 120 33.914 32.840 1.074 1
1 1372 . 12 1 1 A 120 120 LYS N N 120 129.442 129.220 0.222 1
1 1373 . 12 1 1 A 121 121 LEU H H 121 8.112 8.556 -0.444 1
1 1374 . 12 1 1 A 121 121 LEU HA H 121 5.323 5.120 0.203 1
1 1384 . 12 1 1 A 121 121 LEU C C 121 175.733 174.506 1.227 1
1 1385 . 12 1 1 A 121 121 LEU CA C 121 52.716 53.381 -0.665 1
1 1386 . 12 1 1 A 121 121 LEU CB C 121 44.098 44.722 -0.624 1
1 1389 . 12 1 1 A 121 121 LEU N N 121 123.403 129.361 -5.958 1
1 1390 . 12 1 1 A 122 122 THR H H 122 8.338 9.052 -0.714 1
1 1391 . 12 1 1 A 122 122 THR HA H 122 5.097 4.862 0.235 1
1 1396 . 12 1 1 A 122 122 THR C C 122 173.221 172.451 0.770 1
1 1397 . 12 1 1 A 122 122 THR CA C 122 60.306 60.932 -0.626 1
1 1398 . 12 1 1 A 122 122 THR CB C 122 72.473 73.068 -0.595 1
1 1400 . 12 1 1 A 122 122 THR N N 122 109.081 123.177 -14.096 1
1 7 . 13 1 1 A 2 2 GLU H H 2 8.994 7.894 1.100 1
1 8 . 13 1 1 A 2 2 GLU HA H 2 4.278 4.509 -0.231 1
1 13 . 13 1 1 A 2 2 GLU C C 2 175.315 176.706 -1.391 1
1 14 . 13 1 1 A 2 2 GLU CA C 2 57.318 56.395 0.923 1
1 15 . 13 1 1 A 2 2 GLU CB C 2 29.221 30.681 -1.460 1
1 17 . 13 1 1 A 2 2 GLU N N 2 122.259 118.799 3.460 1
1 18 . 13 1 1 A 3 3 ASP H H 3 8.048 8.119 -0.071 1
1 19 . 13 1 1 A 3 3 ASP HA H 3 4.580 5.056 -0.476 1
1 21 . 13 1 1 A 3 3 ASP C C 3 175.636 176.330 -0.694 1
1 22 . 13 1 1 A 3 3 ASP CA C 3 54.579 53.101 1.478 1
1 23 . 13 1 1 A 3 3 ASP CB C 3 40.984 41.286 -0.302 1
1 24 . 13 1 1 A 3 3 ASP N N 3 119.830 117.959 1.871 1
1 25 . 13 1 1 A 4 4 ALA H H 4 8.090 7.596 0.494 1
1 26 . 13 1 1 A 4 4 ALA HA H 4 4.216 4.667 -0.451 1
1 30 . 13 1 1 A 4 4 ALA C C 4 177.157 176.896 0.261 1
1 31 . 13 1 1 A 4 4 ALA CA C 4 53.620 51.207 2.413 1
1 32 . 13 1 1 A 4 4 ALA CB C 4 18.728 18.654 0.074 1
1 33 . 13 1 1 A 4 4 ALA N N 4 123.957 121.600 2.357 1
1 34 . 13 1 1 A 5 5 TRP H H 5 7.941 7.681 0.260 1
1 35 . 13 1 1 A 5 5 TRP HA H 5 4.559 4.510 0.049 1
1 39 . 13 1 1 A 5 5 TRP C C 5 176.072 178.460 -2.388 1
1 40 . 13 1 1 A 5 5 TRP CA C 5 57.744 59.386 -1.642 1
1 41 . 13 1 1 A 5 5 TRP CB C 5 28.906 30.552 -1.646 1
1 42 . 13 1 1 A 5 5 TRP N N 5 118.408 119.390 -0.982 1
1 44 . 13 1 1 A 6 6 MET H H 6 7.679 8.439 -0.760 1
1 45 . 13 1 1 A 6 6 MET HA H 6 3.785 4.487 -0.702 1
1 52 . 13 1 1 A 6 6 MET C C 6 175.174 176.846 -1.672 1
1 53 . 13 1 1 A 6 6 MET CA C 6 57.724 56.984 0.740 1
1 54 . 13 1 1 A 6 6 MET CB C 6 31.640 33.190 -1.550 1
1 57 . 13 1 1 A 6 6 MET N N 6 121.538 118.014 3.524 1
1 58 . 13 1 1 A 7 7 GLY H H 7 7.247 7.753 -0.506 1
1 59 . 13 1 1 A 7 7 GLY HA2 H 7 3.455 4.184 -0.729 1
1 60 . 13 1 1 A 7 7 GLY HA3 H 7 3.578 4.330 -0.752 1
1 61 . 13 1 1 A 7 7 GLY C C 7 172.852 172.735 0.117 1
1 62 . 13 1 1 A 7 7 GLY CA C 7 45.896 45.837 0.059 1
1 63 . 13 1 1 A 7 7 GLY N N 7 104.055 104.834 -0.779 1
1 64 . 13 1 1 A 8 8 THR H H 8 7.436 8.514 -1.078 1
1 65 . 13 1 1 A 8 8 THR HA H 8 4.428 4.465 -0.037 1
1 70 . 13 1 1 A 8 8 THR C C 8 172.973 173.343 -0.370 1
1 71 . 13 1 1 A 8 8 THR CA C 8 60.751 61.135 -0.384 1
1 72 . 13 1 1 A 8 8 THR CB C 8 69.637 70.577 -0.940 1
1 74 . 13 1 1 A 8 8 THR N N 8 107.669 115.675 -8.006 1
1 75 . 13 1 1 A 9 9 HIS H H 9 8.048 7.758 0.290 1
1 76 . 13 1 1 A 9 9 HIS HA H 9 4.654 4.972 -0.318 1
1 79 . 13 1 1 A 9 9 HIS CA C 9 56.163 53.604 2.559 1
1 80 . 13 1 1 A 9 9 HIS CB C 9 32.619 31.851 0.768 1
1 81 . 13 1 1 A 9 9 HIS N N 9 127.281 120.800 6.481 1
1 82 . 13 1 1 A 10 10 PRO HA H 10 4.257 4.283 -0.026 1
1 88 . 13 1 1 A 10 10 PRO C C 10 178.779 178.572 0.207 1
1 89 . 13 1 1 A 10 10 PRO CA C 10 65.565 65.849 -0.284 1
1 90 . 13 1 1 A 10 10 PRO CB C 10 32.422 31.938 0.484 1
1 93 . 13 1 1 A 11 11 LYS H H 11 10.994 9.056 1.938 1
1 94 . 13 1 1 A 11 11 LYS HA H 11 4.282 4.233 0.049 1
1 100 . 13 1 1 A 11 11 LYS C C 11 177.279 178.579 -1.300 1
1 101 . 13 1 1 A 11 11 LYS CA C 11 56.859 59.198 -2.339 1
1 102 . 13 1 1 A 11 11 LYS CB C 11 31.279 32.089 -0.810 1
1 104 . 13 1 1 A 11 11 LYS N N 11 121.398 116.610 4.788 1
1 105 . 13 1 1 A 12 12 TYR H H 12 7.146 8.510 -1.364 1
1 106 . 13 1 1 A 12 12 TYR HA H 12 3.722 4.390 -0.668 1
1 113 . 13 1 1 A 12 12 TYR C C 12 176.265 177.539 -1.274 1
1 114 . 13 1 1 A 12 12 TYR CA C 12 61.189 61.576 -0.387 1
1 115 . 13 1 1 A 12 12 TYR CB C 12 37.796 38.564 -0.768 1
1 116 . 13 1 1 A 12 12 TYR N N 12 121.579 121.642 -0.063 1
1 117 . 13 1 1 A 13 13 LEU H H 13 7.778 8.848 -1.070 1
1 118 . 13 1 1 A 13 13 LEU HA H 13 3.773 4.031 -0.258 1
1 127 . 13 1 1 A 13 13 LEU C C 13 178.462 178.574 -0.112 1
1 128 . 13 1 1 A 13 13 LEU CA C 13 57.942 58.235 -0.293 1
1 129 . 13 1 1 A 13 13 LEU CB C 13 41.064 41.585 -0.521 1
1 132 . 13 1 1 A 13 13 LEU N N 13 117.518 120.974 -3.456 1
1 133 . 13 1 1 A 14 14 GLU H H 14 7.867 8.576 -0.709 1
1 134 . 13 1 1 A 14 14 GLU HA H 14 3.935 3.922 0.013 1
1 139 . 13 1 1 A 14 14 GLU C C 14 178.326 178.757 -0.431 1
1 140 . 13 1 1 A 14 14 GLU CA C 14 59.368 59.732 -0.364 1
1 141 . 13 1 1 A 14 14 GLU CB C 14 30.147 29.124 1.023 1
1 143 . 13 1 1 A 14 14 GLU N N 14 119.135 119.082 0.053 1
1 144 . 13 1 1 A 15 15 MET H H 15 7.773 7.683 0.090 1
1 145 . 13 1 1 A 15 15 MET HA H 15 3.936 4.159 -0.223 1
1 152 . 13 1 1 A 15 15 MET C C 15 177.886 178.212 -0.326 1
1 153 . 13 1 1 A 15 15 MET CA C 15 59.465 58.050 1.415 1
1 154 . 13 1 1 A 15 15 MET CB C 15 33.987 32.206 1.781 1
1 157 . 13 1 1 A 15 15 MET N N 15 117.884 119.388 -1.504 1
1 158 . 13 1 1 A 16 16 MET H H 16 8.145 8.335 -0.190 1
1 159 . 13 1 1 A 16 16 MET HA H 16 4.159 4.060 0.099 1
1 166 . 13 1 1 A 16 16 MET C C 16 177.835 178.293 -0.458 1
1 167 . 13 1 1 A 16 16 MET CA C 16 57.397 58.043 -0.646 1
1 168 . 13 1 1 A 16 16 MET CB C 16 31.867 32.331 -0.464 1
1 171 . 13 1 1 A 16 16 MET N N 16 119.555 118.262 1.293 1
1 172 . 13 1 1 A 17 17 GLU H H 17 7.761 8.558 -0.797 1
1 173 . 13 1 1 A 17 17 GLU HA H 17 4.117 4.058 0.059 1
1 176 . 13 1 1 A 17 17 GLU C C 17 175.994 176.951 -0.957 1
1 177 . 13 1 1 A 17 17 GLU CA C 17 57.392 58.479 -1.087 1
1 178 . 13 1 1 A 17 17 GLU CB C 17 29.432 29.693 -0.261 1
1 180 . 13 1 1 A 17 17 GLU N N 17 118.216 120.137 -1.921 1
1 181 . 13 1 1 A 18 18 LEU H H 18 7.201 7.256 -0.055 1
1 182 . 13 1 1 A 18 18 LEU HA H 18 4.111 4.323 -0.212 1
1 191 . 13 1 1 A 18 18 LEU C C 18 175.781 176.757 -0.976 1
1 192 . 13 1 1 A 18 18 LEU CA C 18 56.366 54.850 1.516 1
1 193 . 13 1 1 A 18 18 LEU CB C 18 42.030 42.462 -0.432 1
1 196 . 13 1 1 A 18 18 LEU N N 18 117.448 122.708 -5.260 1
1 197 . 13 1 1 A 19 19 ASP H H 19 7.789 8.655 -0.866 1
1 198 . 13 1 1 A 19 19 ASP HA H 19 4.360 4.453 -0.093 1
1 201 . 13 1 1 A 19 19 ASP C C 19 173.765 176.727 -2.962 1
1 202 . 13 1 1 A 19 19 ASP CA C 19 54.851 54.445 0.406 1
1 203 . 13 1 1 A 19 19 ASP CB C 19 39.115 41.876 -2.761 1
1 204 . 13 1 1 A 19 19 ASP N N 19 115.844 120.008 -4.164 1
1 205 . 13 1 1 A 20 20 ILE H H 20 8.142 8.824 -0.682 1
1 206 . 13 1 1 A 20 20 ILE HA H 20 4.128 4.006 0.122 1
1 216 . 13 1 1 A 20 20 ILE C C 20 174.710 176.292 -1.582 1
1 217 . 13 1 1 A 20 20 ILE CA C 20 60.465 63.933 -3.468 1
1 218 . 13 1 1 A 20 20 ILE CB C 20 40.407 37.397 3.010 1
1 222 . 13 1 1 A 20 20 ILE N N 20 117.287 122.098 -4.811 1
1 223 . 13 1 1 A 21 21 GLY H H 21 8.207 8.407 -0.200 1
1 224 . 13 1 1 A 21 21 GLY HA2 H 21 3.889 3.864 0.025 1
1 225 . 13 1 1 A 21 21 GLY HA3 H 21 3.924 3.881 0.043 1
1 226 . 13 1 1 A 21 21 GLY C C 21 172.162 174.334 -2.172 1
1 227 . 13 1 1 A 21 21 GLY CA C 21 45.017 46.628 -1.611 1
1 228 . 13 1 1 A 21 21 GLY N N 21 110.656 110.989 -0.333 1
1 229 . 13 1 1 A 22 22 ASP H H 22 7.727 8.052 -0.325 1
1 230 . 13 1 1 A 22 22 ASP HA H 22 4.794 4.808 -0.014 1
1 233 . 13 1 1 A 22 22 ASP C C 22 174.884 176.606 -1.722 1
1 234 . 13 1 1 A 22 22 ASP CA C 22 52.471 53.531 -1.060 1
1 235 . 13 1 1 A 22 22 ASP CB C 22 42.069 41.340 0.729 1
1 236 . 13 1 1 A 22 22 ASP N N 22 119.305 119.934 -0.629 1
1 237 . 13 1 1 A 23 23 ALA H H 23 8.644 8.946 -0.302 1
1 238 . 13 1 1 A 23 23 ALA HA H 23 4.120 3.987 0.133 1
1 242 . 13 1 1 A 23 23 ALA C C 23 179.546 179.749 -0.203 1
1 243 . 13 1 1 A 23 23 ALA CA C 23 55.609 55.617 -0.008 1
1 244 . 13 1 1 A 23 23 ALA CB C 23 18.573 18.433 0.140 1
1 245 . 13 1 1 A 23 23 ALA N N 23 122.468 129.564 -7.096 1
1 246 . 13 1 1 A 24 24 THR H H 24 8.238 7.785 0.453 1
1 247 . 13 1 1 A 24 24 THR HA H 24 4.184 4.041 0.143 1
1 252 . 13 1 1 A 24 24 THR C C 24 174.841 176.781 -1.940 1
1 253 . 13 1 1 A 24 24 THR CA C 24 66.241 66.696 -0.455 1
1 254 . 13 1 1 A 24 24 THR CB C 24 68.376 68.546 -0.170 1
1 256 . 13 1 1 A 24 24 THR N N 24 114.824 113.306 1.518 1
1 257 . 13 1 1 A 25 25 GLN H H 25 8.037 8.503 -0.466 1
1 258 . 13 1 1 A 25 25 GLN HA H 25 4.095 4.027 0.068 1
1 265 . 13 1 1 A 25 25 GLN C C 25 177.603 178.725 -1.122 1
1 266 . 13 1 1 A 25 25 GLN CA C 25 59.261 58.792 0.469 1
1 267 . 13 1 1 A 25 25 GLN CB C 25 28.437 28.233 0.204 1
1 269 . 13 1 1 A 25 25 GLN N N 25 122.518 119.660 2.858 1
1 271 . 13 1 1 A 26 26 VAL H H 26 7.994 8.703 -0.709 1
1 272 . 13 1 1 A 26 26 VAL HA H 26 3.469 3.915 -0.446 1
1 280 . 13 1 1 A 26 26 VAL C C 26 175.552 177.868 -2.316 1
1 281 . 13 1 1 A 26 26 VAL CA C 26 66.909 65.662 1.247 1
1 282 . 13 1 1 A 26 26 VAL CB C 26 31.582 31.300 0.282 1
1 285 . 13 1 1 A 26 26 VAL N N 26 119.112 116.851 2.261 1
1 286 . 13 1 1 A 27 27 TYR H H 27 8.003 8.073 -0.070 1
1 287 . 13 1 1 A 27 27 TYR HA H 27 4.357 4.481 -0.124 1
1 294 . 13 1 1 A 27 27 TYR C C 27 175.856 177.143 -1.287 1
1 295 . 13 1 1 A 27 27 TYR CA C 27 62.197 61.719 0.478 1
1 296 . 13 1 1 A 27 27 TYR CB C 27 38.394 38.714 -0.320 1
1 297 . 13 1 1 A 27 27 TYR N N 27 119.170 124.388 -5.218 1
1 298 . 13 1 1 A 28 28 VAL H H 28 8.087 8.519 -0.432 1
1 299 . 13 1 1 A 28 28 VAL HA H 28 3.652 3.437 0.215 1
1 307 . 13 1 1 A 28 28 VAL C C 28 176.134 177.892 -1.758 1
1 308 . 13 1 1 A 28 28 VAL CA C 28 66.247 66.225 0.022 1
1 309 . 13 1 1 A 28 28 VAL CB C 28 31.241 31.312 -0.071 1
1 312 . 13 1 1 A 28 28 VAL N N 28 113.112 119.552 -6.440 1
1 313 . 13 1 1 A 29 29 ALA H H 29 7.853 8.906 -1.053 1
1 314 . 13 1 1 A 29 29 ALA HA H 29 3.913 4.077 -0.164 1
1 318 . 13 1 1 A 29 29 ALA C C 29 177.850 179.312 -1.462 1
1 319 . 13 1 1 A 29 29 ALA CA C 29 55.274 54.816 0.458 1
1 320 . 13 1 1 A 29 29 ALA CB C 29 17.876 18.393 -0.517 1
1 321 . 13 1 1 A 29 29 ALA N N 29 121.350 122.677 -1.327 1
1 322 . 13 1 1 A 30 30 PHE H H 30 8.724 8.216 0.508 1
1 323 . 13 1 1 A 30 30 PHE HA H 30 4.098 4.274 -0.176 1
1 327 . 13 1 1 A 30 30 PHE C C 30 175.035 177.363 -2.328 1
1 328 . 13 1 1 A 30 30 PHE CA C 30 61.264 61.582 -0.318 1
1 329 . 13 1 1 A 30 30 PHE CB C 30 38.926 39.281 -0.355 1
1 330 . 13 1 1 A 30 30 PHE N N 30 120.478 120.331 0.147 1
1 331 . 13 1 1 A 31 31 LEU H H 31 8.146 8.183 -0.037 1
1 332 . 13 1 1 A 31 31 LEU HA H 31 3.597 3.613 -0.016 1
1 341 . 13 1 1 A 31 31 LEU C C 31 179.508 179.352 0.156 1
1 342 . 13 1 1 A 31 31 LEU CA C 31 57.884 58.154 -0.270 1
1 343 . 13 1 1 A 31 31 LEU CB C 31 41.829 42.159 -0.330 1
1 346 . 13 1 1 A 31 31 LEU N N 31 118.427 120.183 -1.756 1
1 347 . 13 1 1 A 32 32 VAL H H 32 7.627 7.579 0.048 1
1 348 . 13 1 1 A 32 32 VAL HA H 32 3.464 3.814 -0.350 1
1 356 . 13 1 1 A 32 32 VAL C C 32 174.956 177.678 -2.722 1
1 357 . 13 1 1 A 32 32 VAL CA C 32 66.373 65.644 0.729 1
1 358 . 13 1 1 A 32 32 VAL CB C 32 31.121 31.474 -0.353 1
1 361 . 13 1 1 A 32 32 VAL N N 32 119.497 113.867 5.630 1
1 362 . 13 1 1 A 33 33 TYR H H 33 8.366 8.692 -0.326 1
1 363 . 13 1 1 A 33 33 TYR HA H 33 3.485 3.935 -0.450 1
1 370 . 13 1 1 A 33 33 TYR C C 33 174.883 176.951 -2.068 1
1 371 . 13 1 1 A 33 33 TYR CA C 33 62.866 61.285 1.581 1
1 372 . 13 1 1 A 33 33 TYR CB C 33 37.778 38.270 -0.492 1
1 373 . 13 1 1 A 33 33 TYR N N 33 121.842 124.294 -2.452 1
1 374 . 13 1 1 A 34 34 LEU H H 34 8.000 8.320 -0.320 1
1 375 . 13 1 1 A 34 34 LEU HA H 34 3.495 3.536 -0.041 1
1 385 . 13 1 1 A 34 34 LEU C C 34 178.240 179.050 -0.810 1
1 386 . 13 1 1 A 34 34 LEU CA C 34 57.453 57.241 0.212 1
1 387 . 13 1 1 A 34 34 LEU CB C 34 41.828 41.127 0.701 1
1 390 . 13 1 1 A 34 34 LEU N N 34 116.692 119.464 -2.772 1
1 391 . 13 1 1 A 35 35 ASP H H 35 7.688 8.004 -0.316 1
1 392 . 13 1 1 A 35 35 ASP HA H 35 4.302 4.324 -0.022 1
1 395 . 13 1 1 A 35 35 ASP C C 35 177.507 178.556 -1.049 1
1 396 . 13 1 1 A 35 35 ASP CA C 35 58.196 57.679 0.517 1
1 397 . 13 1 1 A 35 35 ASP CB C 35 43.070 41.415 1.655 1
1 398 . 13 1 1 A 35 35 ASP N N 35 120.507 120.059 0.448 1
1 399 . 13 1 1 A 36 36 LEU H H 36 8.482 8.520 -0.038 1
1 400 . 13 1 1 A 36 36 LEU HA H 36 3.328 3.629 -0.301 1
1 410 . 13 1 1 A 36 36 LEU C C 36 176.774 178.787 -2.013 1
1 411 . 13 1 1 A 36 36 LEU CA C 36 57.461 57.669 -0.208 1
1 412 . 13 1 1 A 36 36 LEU CB C 36 41.344 41.214 0.130 1
1 416 . 13 1 1 A 36 36 LEU N N 36 117.671 120.798 -3.127 1
1 417 . 13 1 1 A 37 37 MET H H 37 7.822 8.284 -0.462 1
1 418 . 13 1 1 A 37 37 MET HA H 37 4.401 3.930 0.471 1
1 425 . 13 1 1 A 37 37 MET C C 37 177.862 177.710 0.152 1
1 426 . 13 1 1 A 37 37 MET CA C 37 56.434 58.579 -2.145 1
1 427 . 13 1 1 A 37 37 MET CB C 37 31.573 31.716 -0.143 1
1 430 . 13 1 1 A 37 37 MET N N 37 112.952 118.298 -5.346 1
1 431 . 13 1 1 A 38 38 GLU H H 38 8.667 8.208 0.459 1
1 432 . 13 1 1 A 38 38 GLU HA H 38 4.457 4.340 0.117 1
1 436 . 13 1 1 A 38 38 GLU C C 38 176.582 177.995 -1.413 1
1 437 . 13 1 1 A 38 38 GLU CA C 38 57.659 56.786 0.873 1
1 438 . 13 1 1 A 38 38 GLU CB C 38 29.936 30.032 -0.096 1
1 440 . 13 1 1 A 38 38 GLU N N 38 116.463 116.451 0.012 1
1 441 . 13 1 1 A 39 39 SER H H 39 7.657 8.123 -0.466 1
1 442 . 13 1 1 A 39 39 SER HA H 39 4.658 4.677 -0.019 1
1 445 . 13 1 1 A 39 39 SER C C 39 175.661 176.324 -0.663 1
1 446 . 13 1 1 A 39 39 SER CA C 39 60.449 59.727 0.722 1
1 447 . 13 1 1 A 39 39 SER CB C 39 63.341 64.498 -1.157 1
1 448 . 13 1 1 A 39 39 SER N N 39 113.870 116.000 -2.130 1
1 449 . 13 1 1 A 40 40 LYS H H 40 8.165 8.187 -0.022 1
1 450 . 13 1 1 A 40 40 LYS HA H 40 4.454 4.285 0.169 1
1 458 . 13 1 1 A 40 40 LYS C C 40 174.970 176.151 -1.181 1
1 459 . 13 1 1 A 40 40 LYS CA C 40 55.753 58.017 -2.264 1
1 460 . 13 1 1 A 40 40 LYS CB C 40 32.337 32.981 -0.644 1
1 464 . 13 1 1 A 40 40 LYS N N 40 116.671 122.529 -5.858 1
1 465 . 13 1 1 A 41 41 SER H H 41 7.017 8.051 -1.034 1
1 466 . 13 1 1 A 41 41 SER HA H 41 4.209 4.322 -0.113 1
1 469 . 13 1 1 A 41 41 SER C C 41 173.770 173.707 0.063 1
1 470 . 13 1 1 A 41 41 SER CA C 41 58.435 58.882 -0.447 1
1 471 . 13 1 1 A 41 41 SER CB C 41 61.700 61.182 0.518 1
1 472 . 13 1 1 A 41 41 SER N N 41 109.989 113.156 -3.167 1
1 473 . 13 1 1 A 42 42 TRP H H 42 8.876 8.217 0.659 1
1 474 . 13 1 1 A 42 42 TRP HA H 42 4.698 4.492 0.206 1
1 478 . 13 1 1 A 42 42 TRP C C 42 174.477 177.278 -2.801 1
1 479 . 13 1 1 A 42 42 TRP CA C 42 59.443 57.597 1.846 1
1 480 . 13 1 1 A 42 42 TRP CB C 42 28.203 29.526 -1.323 1
1 481 . 13 1 1 A 42 42 TRP N N 42 121.116 120.779 0.337 1
1 483 . 13 1 1 A 43 43 HIS H H 43 8.132 8.481 -0.349 1
1 484 . 13 1 1 A 43 43 HIS HA H 43 4.445 4.390 0.055 1
1 488 . 13 1 1 A 43 43 HIS C C 43 174.405 174.496 -0.091 1
1 489 . 13 1 1 A 43 43 HIS CA C 43 58.556 59.370 -0.814 1
1 490 . 13 1 1 A 43 43 HIS CB C 43 29.430 30.490 -1.060 1
1 491 . 13 1 1 A 43 43 HIS N N 43 119.397 122.709 -3.312 1
1 492 . 13 1 1 A 44 44 GLU H H 44 8.140 7.712 0.428 1
1 493 . 13 1 1 A 44 44 GLU HA H 44 4.432 4.652 -0.220 1
1 497 . 13 1 1 A 44 44 GLU C C 44 173.010 174.388 -1.378 1
1 498 . 13 1 1 A 44 44 GLU CA C 44 56.421 56.248 0.173 1
1 499 . 13 1 1 A 44 44 GLU CB C 44 33.285 33.463 -0.178 1
1 501 . 13 1 1 A 44 44 GLU N N 44 116.181 118.068 -1.887 1
1 502 . 13 1 1 A 45 45 VAL H H 45 8.428 8.859 -0.431 1
1 503 . 13 1 1 A 45 45 VAL HA H 45 4.492 5.048 -0.556 1
1 511 . 13 1 1 A 45 45 VAL C C 45 172.339 174.822 -2.483 1
1 512 . 13 1 1 A 45 45 VAL CA C 45 63.071 61.408 1.663 1
1 513 . 13 1 1 A 45 45 VAL CB C 45 35.145 34.837 0.308 1
1 516 . 13 1 1 A 45 45 VAL N N 45 123.272 125.919 -2.647 1
1 517 . 13 1 1 A 46 46 ASN H H 46 9.050 8.983 0.067 1
1 518 . 13 1 1 A 46 46 ASN HA H 46 5.261 5.420 -0.159 1
1 523 . 13 1 1 A 46 46 ASN C C 46 172.845 174.191 -1.346 1
1 524 . 13 1 1 A 46 46 ASN CA C 46 51.895 51.818 0.077 1
1 525 . 13 1 1 A 46 46 ASN CB C 46 42.322 41.682 0.640 1
1 526 . 13 1 1 A 46 46 ASN N N 46 123.901 125.815 -1.914 1
1 528 . 13 1 1 A 47 47 CYS H H 47 9.039 8.662 0.377 1
1 529 . 13 1 1 A 47 47 CYS HA H 47 5.160 5.227 -0.067 1
1 532 . 13 1 1 A 47 47 CYS C C 47 172.454 173.327 -0.873 1
1 533 . 13 1 1 A 47 47 CYS CA C 47 56.473 56.966 -0.493 1
1 534 . 13 1 1 A 47 47 CYS CB C 47 29.297 28.786 0.511 1
1 535 . 13 1 1 A 47 47 CYS N N 47 119.663 120.344 -0.681 1
1 536 . 13 1 1 A 48 48 VAL H H 48 9.083 9.284 -0.201 1
1 537 . 13 1 1 A 48 48 VAL HA H 48 4.344 4.739 -0.395 1
1 542 . 13 1 1 A 48 48 VAL C C 48 173.307 175.077 -1.770 1
1 543 . 13 1 1 A 48 48 VAL CA C 48 61.368 60.772 0.596 1
1 544 . 13 1 1 A 48 48 VAL CB C 48 35.345 34.847 0.498 1
1 546 . 13 1 1 A 48 48 VAL N N 48 124.672 125.615 -0.943 1
1 547 . 13 1 1 A 49 49 GLY H H 49 9.019 9.086 -0.067 1
1 548 . 13 1 1 A 49 49 GLY HA2 H 49 3.460 4.157 -0.697 1
1 549 . 13 1 1 A 49 49 GLY HA3 H 49 4.539 4.158 0.381 1
1 550 . 13 1 1 A 49 49 GLY C C 49 171.278 172.318 -1.040 1
1 551 . 13 1 1 A 49 49 GLY CA C 49 45.075 44.661 0.414 1
1 552 . 13 1 1 A 49 49 GLY N N 49 113.131 116.065 -2.934 1
1 553 . 13 1 1 A 50 50 LEU H H 50 8.747 9.379 -0.632 1
1 554 . 13 1 1 A 50 50 LEU HA H 50 5.102 4.933 0.169 1
1 564 . 13 1 1 A 50 50 LEU CA C 50 51.417 51.281 0.136 1
1 565 . 13 1 1 A 50 50 LEU CB C 50 41.754 42.658 -0.904 1
1 569 . 13 1 1 A 50 50 LEU N N 50 124.471 126.700 -2.229 1
1 570 . 13 1 1 A 51 51 PRO HA H 51 4.106 4.423 -0.317 1
1 577 . 13 1 1 A 51 51 PRO C C 51 178.422 177.689 0.733 1
1 578 . 13 1 1 A 51 51 PRO CA C 51 65.680 64.513 1.167 1
1 579 . 13 1 1 A 51 51 PRO CB C 51 31.939 31.994 -0.055 1
1 582 . 13 1 1 A 52 52 GLU H H 52 9.721 8.913 0.808 1
1 583 . 13 1 1 A 52 52 GLU HA H 52 4.176 4.119 0.057 1
1 588 . 13 1 1 A 52 52 GLU C C 52 176.146 177.532 -1.386 1
1 589 . 13 1 1 A 52 52 GLU CA C 52 59.158 58.383 0.775 1
1 590 . 13 1 1 A 52 52 GLU CB C 52 28.442 28.846 -0.404 1
1 592 . 13 1 1 A 52 52 GLU N N 52 118.552 115.570 2.982 1
1 593 . 13 1 1 A 53 53 LEU H H 53 7.089 7.753 -0.664 1
1 594 . 13 1 1 A 53 53 LEU HA H 53 4.511 4.279 0.232 1
1 603 . 13 1 1 A 53 53 LEU C C 53 174.027 176.015 -1.988 1
1 604 . 13 1 1 A 53 53 LEU CA C 53 53.825 54.845 -1.020 1
1 605 . 13 1 1 A 53 53 LEU CB C 53 43.825 42.286 1.539 1
1 608 . 13 1 1 A 53 53 LEU N N 53 116.763 118.559 -1.796 1
1 609 . 13 1 1 A 54 54 GLN H H 54 7.964 7.810 0.154 1
1 610 . 13 1 1 A 54 54 GLN HA H 54 3.591 3.854 -0.263 1
1 616 . 13 1 1 A 54 54 GLN C C 54 172.604 174.199 -1.595 1
1 617 . 13 1 1 A 54 54 GLN CA C 54 56.961 57.056 -0.095 1
1 618 . 13 1 1 A 54 54 GLN CB C 54 26.545 26.188 0.357 1
1 620 . 13 1 1 A 54 54 GLN N N 54 115.489 116.183 -0.694 1
1 622 . 13 1 1 A 55 55 LEU H H 55 7.139 7.403 -0.264 1
1 623 . 13 1 1 A 55 55 LEU HA H 55 4.750 5.006 -0.256 1
1 629 . 13 1 1 A 55 55 LEU C C 55 173.475 175.613 -2.138 1
1 630 . 13 1 1 A 55 55 LEU CA C 55 53.698 52.545 1.153 1
1 631 . 13 1 1 A 55 55 LEU CB C 55 47.859 45.593 2.266 1
1 633 . 13 1 1 A 55 55 LEU N N 55 116.422 114.509 1.913 1
1 634 . 13 1 1 A 56 56 ILE H H 56 8.223 8.545 -0.322 1
1 635 . 13 1 1 A 56 56 ILE HA H 56 4.540 5.288 -0.748 1
1 643 . 13 1 1 A 56 56 ILE C C 56 173.938 174.931 -0.993 1
1 644 . 13 1 1 A 56 56 ILE CA C 56 61.020 60.031 0.989 1
1 645 . 13 1 1 A 56 56 ILE CB C 56 39.403 40.179 -0.776 1
1 648 . 13 1 1 A 56 56 ILE N N 56 122.792 120.850 1.942 1
1 649 . 13 1 1 A 57 57 CYS H H 57 8.995 9.147 -0.152 1
1 650 . 13 1 1 A 57 57 CYS HA H 57 5.036 5.389 -0.353 1
1 653 . 13 1 1 A 57 57 CYS C C 57 170.483 173.114 -2.631 1
1 654 . 13 1 1 A 57 57 CYS CA C 57 56.484 56.846 -0.362 1
1 655 . 13 1 1 A 57 57 CYS CB C 57 30.545 31.160 -0.615 1
1 656 . 13 1 1 A 57 57 CYS N N 57 121.575 124.282 -2.707 1
1 657 . 13 1 1 A 58 58 LEU H H 58 9.076 8.736 0.340 1
1 658 . 13 1 1 A 58 58 LEU HA H 58 5.472 5.620 -0.148 1
1 668 . 13 1 1 A 58 58 LEU C C 58 174.009 176.214 -2.205 1
1 669 . 13 1 1 A 58 58 LEU CA C 58 52.851 53.622 -0.771 1
1 670 . 13 1 1 A 58 58 LEU CB C 58 42.177 42.996 -0.819 1
1 674 . 13 1 1 A 58 58 LEU N N 58 121.895 124.120 -2.225 1
1 675 . 13 1 1 A 59 59 VAL H H 59 8.966 8.714 0.252 1
1 676 . 13 1 1 A 59 59 VAL HA H 59 5.488 5.140 0.348 1
1 681 . 13 1 1 A 59 59 VAL C C 59 176.034 175.644 0.390 1
1 682 . 13 1 1 A 59 59 VAL CA C 59 59.820 60.810 -0.990 1
1 683 . 13 1 1 A 59 59 VAL CB C 59 34.786 34.592 0.194 1
1 685 . 13 1 1 A 59 59 VAL N N 59 121.702 124.656 -2.954 1
1 686 . 13 1 1 A 60 60 GLY H H 60 9.258 8.871 0.387 1
1 687 . 13 1 1 A 60 60 GLY HA2 H 60 4.673 4.426 0.247 1
1 688 . 13 1 1 A 60 60 GLY HA3 H 60 4.804 4.553 0.251 1
1 689 . 13 1 1 A 60 60 GLY C C 60 169.831 172.854 -3.023 1
1 690 . 13 1 1 A 60 60 GLY CA C 60 46.399 46.046 0.353 1
1 691 . 13 1 1 A 60 60 GLY N N 60 114.126 112.912 1.214 1
1 692 . 13 1 1 A 61 61 THR H H 61 8.834 8.478 0.356 1
1 693 . 13 1 1 A 61 61 THR HA H 61 4.418 4.995 -0.577 1
1 698 . 13 1 1 A 61 61 THR C C 61 171.985 174.857 -2.872 1
1 699 . 13 1 1 A 61 61 THR CA C 61 60.634 60.500 0.134 1
1 700 . 13 1 1 A 61 61 THR CB C 61 70.983 70.717 0.266 1
1 702 . 13 1 1 A 61 61 THR N N 61 114.856 112.406 2.450 1
1 703 . 13 1 1 A 62 62 GLU H H 62 8.502 8.610 -0.108 1
1 704 . 13 1 1 A 62 62 GLU HA H 62 2.867 3.262 -0.395 1
1 709 . 13 1 1 A 62 62 GLU C C 62 174.650 175.737 -1.087 1
1 710 . 13 1 1 A 62 62 GLU CA C 62 58.785 58.305 0.480 1
1 711 . 13 1 1 A 62 62 GLU CB C 62 28.981 29.341 -0.360 1
1 713 . 13 1 1 A 62 62 GLU N N 62 129.915 123.673 6.242 1
1 714 . 13 1 1 A 63 63 ILE H H 63 6.928 7.619 -0.691 1
1 715 . 13 1 1 A 63 63 ILE HA H 63 4.038 4.333 -0.295 1
1 725 . 13 1 1 A 63 63 ILE C C 63 173.482 174.999 -1.517 1
1 726 . 13 1 1 A 63 63 ILE CA C 63 58.664 59.855 -1.191 1
1 727 . 13 1 1 A 63 63 ILE CB C 63 40.009 40.651 -0.642 1
1 731 . 13 1 1 A 63 63 ILE N N 63 117.075 118.479 -1.404 1
1 732 . 13 1 1 A 64 64 GLU H H 64 8.585 8.250 0.335 1
1 733 . 13 1 1 A 64 64 GLU HA H 64 3.427 3.994 -0.567 1
1 738 . 13 1 1 A 64 64 GLU C C 64 175.186 176.717 -1.531 1
1 739 . 13 1 1 A 64 64 GLU CA C 64 58.703 57.144 1.559 1
1 740 . 13 1 1 A 64 64 GLU CB C 64 28.999 29.190 -0.191 1
1 742 . 13 1 1 A 64 64 GLU N N 64 126.422 127.589 -1.167 1
1 743 . 13 1 1 A 65 65 GLY H H 65 8.754 8.850 -0.096 1
1 744 . 13 1 1 A 65 65 GLY HA2 H 65 3.631 3.934 -0.303 1
1 745 . 13 1 1 A 65 65 GLY HA3 H 65 4.287 3.955 0.332 1
1 746 . 13 1 1 A 65 65 GLY C C 65 174.005 174.943 -0.938 1
1 747 . 13 1 1 A 65 65 GLY CA C 65 44.954 45.051 -0.097 1
1 748 . 13 1 1 A 65 65 GLY N N 65 114.614 112.673 1.941 1
1 749 . 13 1 1 A 66 66 GLU H H 66 7.760 7.891 -0.131 1
1 750 . 13 1 1 A 66 66 GLU HA H 66 4.462 4.540 -0.078 1
1 754 . 13 1 1 A 66 66 GLU C C 66 175.255 176.224 -0.969 1
1 755 . 13 1 1 A 66 66 GLU CA C 66 55.582 56.034 -0.452 1
1 756 . 13 1 1 A 66 66 GLU CB C 66 30.654 31.466 -0.812 1
1 758 . 13 1 1 A 66 66 GLU N N 66 119.292 120.427 -1.135 1
1 759 . 13 1 1 A 67 67 GLY H H 67 8.262 8.523 -0.261 1
1 760 . 13 1 1 A 67 67 GLY HA2 H 67 3.875 4.114 -0.239 1
1 761 . 13 1 1 A 67 67 GLY HA3 H 67 4.088 4.119 -0.031 1
1 762 . 13 1 1 A 67 67 GLY C C 67 172.197 173.917 -1.720 1
1 763 . 13 1 1 A 67 67 GLY CA C 67 44.845 45.219 -0.374 1
1 764 . 13 1 1 A 67 67 GLY N N 67 106.161 109.359 -3.198 1
1 765 . 13 1 1 A 68 68 LEU H H 68 8.142 8.165 -0.023 1
1 766 . 13 1 1 A 68 68 LEU HA H 68 4.491 4.638 -0.147 1
1 775 . 13 1 1 A 68 68 LEU C C 68 176.194 176.322 -0.128 1
1 776 . 13 1 1 A 68 68 LEU CA C 68 55.123 54.905 0.218 1
1 777 . 13 1 1 A 68 68 LEU CB C 68 44.527 45.065 -0.538 1
1 780 . 13 1 1 A 68 68 LEU N N 68 120.269 121.445 -1.176 1
1 781 . 13 1 1 A 69 69 GLN H H 69 9.253 7.675 1.578 1
1 782 . 13 1 1 A 69 69 GLN HA H 69 4.770 4.696 0.074 1
1 788 . 13 1 1 A 69 69 GLN C C 69 173.607 175.078 -1.471 1
1 789 . 13 1 1 A 69 69 GLN CA C 69 54.736 55.031 -0.295 1
1 790 . 13 1 1 A 69 69 GLN CB C 69 33.782 29.602 4.180 1
1 792 . 13 1 1 A 69 69 GLN N N 69 119.336 115.476 3.860 1
1 794 . 13 1 1 A 70 70 THR H H 70 8.803 9.163 -0.360 1
1 795 . 13 1 1 A 70 70 THR HA H 70 5.033 5.160 -0.127 1
1 800 . 13 1 1 A 70 70 THR C C 70 172.596 173.789 -1.193 1
1 801 . 13 1 1 A 70 70 THR CA C 70 62.768 62.109 0.659 1
1 802 . 13 1 1 A 70 70 THR CB C 70 69.990 70.735 -0.745 1
1 804 . 13 1 1 A 70 70 THR N N 70 118.372 120.321 -1.949 1
1 805 . 13 1 1 A 71 71 VAL H H 71 9.882 9.468 0.414 1
1 806 . 13 1 1 A 71 71 VAL HA H 71 5.239 5.333 -0.094 1
1 811 . 13 1 1 A 71 71 VAL C C 71 174.015 175.298 -1.283 1
1 812 . 13 1 1 A 71 71 VAL CA C 71 60.577 60.751 -0.174 1
1 813 . 13 1 1 A 71 71 VAL CB C 71 34.149 35.263 -1.114 1
1 815 . 13 1 1 A 71 71 VAL N N 71 129.063 126.203 2.860 1
1 816 . 13 1 1 A 72 72 VAL H H 72 9.491 8.689 0.802 1
1 817 . 13 1 1 A 72 72 VAL HA H 72 4.672 4.870 -0.198 1
1 825 . 13 1 1 A 72 72 VAL CA C 72 59.568 57.936 1.632 1
1 826 . 13 1 1 A 72 72 VAL CB C 72 34.057 34.360 -0.303 1
1 829 . 13 1 1 A 72 72 VAL N N 72 128.521 121.335 7.186 1
1 830 . 13 1 1 A 73 73 PRO HA H 73 5.368 4.624 0.744 1
1 836 . 13 1 1 A 73 73 PRO C C 73 175.079 175.921 -0.842 1
1 837 . 13 1 1 A 73 73 PRO CA C 73 61.324 62.960 -1.636 1
1 838 . 13 1 1 A 73 73 PRO CB C 73 33.089 31.871 1.218 1
1 841 . 13 1 1 A 74 74 THR H H 74 9.103 8.879 0.224 1
1 842 . 13 1 1 A 74 74 THR HA H 74 5.191 4.741 0.450 1
1 847 . 13 1 1 A 74 74 THR CA C 74 57.986 58.976 -0.990 1
1 848 . 13 1 1 A 74 74 THR CB C 74 72.212 71.413 0.799 1
1 850 . 13 1 1 A 74 74 THR N N 74 118.075 119.138 -1.063 1
1 851 . 13 1 1 A 75 75 PRO HA H 75 5.015 4.871 0.144 1
1 858 . 13 1 1 A 75 75 PRO C C 75 178.704 177.248 1.456 1
1 859 . 13 1 1 A 75 75 PRO CA C 75 63.038 62.125 0.913 1
1 860 . 13 1 1 A 75 75 PRO CB C 75 32.529 32.856 -0.327 1
1 863 . 13 1 1 A 76 76 ILE H H 76 8.221 8.091 0.130 1
1 864 . 13 1 1 A 76 76 ILE HA H 76 4.218 3.930 0.288 1
1 873 . 13 1 1 A 76 76 ILE C C 76 172.375 177.009 -4.634 1
1 874 . 13 1 1 A 76 76 ILE CA C 76 63.509 63.272 0.237 1
1 875 . 13 1 1 A 76 76 ILE CB C 76 39.322 37.547 1.775 1
1 879 . 13 1 1 A 76 76 ILE N N 76 122.273 121.771 0.502 1
1 880 . 13 1 1 A 77 77 THR H H 77 6.984 7.632 -0.648 1
1 881 . 13 1 1 A 77 77 THR HA H 77 4.227 4.370 -0.143 1
1 886 . 13 1 1 A 77 77 THR C C 77 173.531 174.228 -0.697 1
1 887 . 13 1 1 A 77 77 THR CA C 77 61.435 61.956 -0.521 1
1 888 . 13 1 1 A 77 77 THR CB C 77 68.944 69.541 -0.597 1
1 890 . 13 1 1 A 77 77 THR N N 77 105.803 110.553 -4.750 1
1 891 . 13 1 1 A 78 78 ALA H H 78 7.647 7.314 0.333 1
1 892 . 13 1 1 A 78 78 ALA HA H 78 4.757 4.690 0.067 1
1 896 . 13 1 1 A 78 78 ALA C C 78 173.520 176.545 -3.025 1
1 897 . 13 1 1 A 78 78 ALA CA C 78 51.164 50.650 0.514 1
1 898 . 13 1 1 A 78 78 ALA CB C 78 20.011 22.603 -2.592 1
1 899 . 13 1 1 A 78 78 ALA N N 78 126.635 124.854 1.781 1
1 900 . 13 1 1 A 79 79 SER H H 79 7.884 8.925 -1.041 1
1 901 . 13 1 1 A 79 79 SER HA H 79 4.386 5.434 -1.048 1
1 903 . 13 1 1 A 79 79 SER C C 79 176.077 172.499 3.578 1
1 904 . 13 1 1 A 79 79 SER CA C 79 57.465 56.227 1.238 1
1 905 . 13 1 1 A 79 79 SER CB C 79 65.285 65.895 -0.610 1
1 906 . 13 1 1 A 79 79 SER N N 79 115.272 112.809 2.463 1
1 907 . 13 1 1 A 80 80 LEU H H 80 7.700 8.716 -1.016 1
1 908 . 13 1 1 A 80 80 LEU HA H 80 4.912 4.776 0.136 1
1 915 . 13 1 1 A 80 80 LEU C C 80 173.927 175.123 -1.196 1
1 916 . 13 1 1 A 80 80 LEU CA C 80 53.829 53.876 -0.047 1
1 917 . 13 1 1 A 80 80 LEU CB C 80 45.990 44.356 1.634 1
1 920 . 13 1 1 A 80 80 LEU N N 80 121.507 126.906 -5.399 1
1 921 . 13 1 1 A 81 81 SER H H 81 7.885 8.699 -0.814 1
1 922 . 13 1 1 A 81 81 SER HA H 81 5.269 4.866 0.403 1
1 925 . 13 1 1 A 81 81 SER C C 81 175.756 174.885 0.871 1
1 926 . 13 1 1 A 81 81 SER CA C 81 55.507 57.319 -1.812 1
1 927 . 13 1 1 A 81 81 SER CB C 81 65.966 65.822 0.144 1
1 928 . 13 1 1 A 81 81 SER N N 81 118.323 117.191 1.132 1
1 929 . 13 1 1 A 82 82 HIS H H 82 8.935 8.945 -0.010 1
1 930 . 13 1 1 A 82 82 HIS HA H 82 4.407 4.377 0.030 1
1 932 . 13 1 1 A 82 82 HIS C C 82 176.550 177.020 -0.470 1
1 933 . 13 1 1 A 82 82 HIS CA C 82 60.960 58.906 2.054 1
1 934 . 13 1 1 A 82 82 HIS CB C 82 30.755 29.278 1.477 1
1 935 . 13 1 1 A 82 82 HIS N N 82 124.042 120.600 3.442 1
1 936 . 13 1 1 A 83 83 ASN H H 83 8.435 8.144 0.291 1
1 937 . 13 1 1 A 83 83 ASN HA H 83 4.439 4.137 0.302 1
1 941 . 13 1 1 A 83 83 ASN C C 83 174.769 177.952 -3.183 1
1 942 . 13 1 1 A 83 83 ASN CA C 83 56.575 56.644 -0.069 1
1 943 . 13 1 1 A 83 83 ASN CB C 83 38.731 39.085 -0.354 1
1 944 . 13 1 1 A 83 83 ASN N N 83 118.543 119.949 -1.406 1
1 946 . 13 1 1 A 84 84 ARG H H 84 7.716 7.672 0.044 1
1 947 . 13 1 1 A 84 84 ARG HA H 84 4.183 4.297 -0.114 1
1 953 . 13 1 1 A 84 84 ARG C C 84 177.399 178.587 -1.188 1
1 954 . 13 1 1 A 84 84 ARG CA C 84 59.045 58.554 0.491 1
1 955 . 13 1 1 A 84 84 ARG CB C 84 29.992 29.998 -0.006 1
1 957 . 13 1 1 A 84 84 ARG N N 84 121.312 119.546 1.766 1
1 958 . 13 1 1 A 85 85 ILE H H 85 8.354 8.040 0.314 1
1 959 . 13 1 1 A 85 85 ILE HA H 85 3.650 3.953 -0.303 1
1 967 . 13 1 1 A 85 85 ILE C C 85 176.098 178.009 -1.911 1
1 968 . 13 1 1 A 85 85 ILE CA C 85 66.704 65.320 1.384 1
1 969 . 13 1 1 A 85 85 ILE CB C 85 38.017 38.153 -0.136 1
1 972 . 13 1 1 A 85 85 ILE N N 85 119.321 120.234 -0.913 1
1 973 . 13 1 1 A 86 86 ARG H H 86 7.690 8.113 -0.423 1
1 974 . 13 1 1 A 86 86 ARG HA H 86 3.704 4.024 -0.320 1
1 981 . 13 1 1 A 86 86 ARG C C 86 177.524 179.265 -1.741 1
1 982 . 13 1 1 A 86 86 ARG CA C 86 59.881 59.574 0.307 1
1 983 . 13 1 1 A 86 86 ARG CB C 86 29.248 29.757 -0.509 1
1 986 . 13 1 1 A 86 86 ARG N N 86 118.362 119.485 -1.123 1
1 987 . 13 1 1 A 87 87 GLU H H 87 7.884 7.886 -0.002 1
1 988 . 13 1 1 A 87 87 GLU HA H 87 4.064 4.095 -0.031 1
1 993 . 13 1 1 A 87 87 GLU C C 87 178.785 179.550 -0.765 1
1 994 . 13 1 1 A 87 87 GLU CA C 87 58.999 58.752 0.247 1
1 995 . 13 1 1 A 87 87 GLU CB C 87 29.872 30.068 -0.196 1
1 997 . 13 1 1 A 87 87 GLU N N 87 118.124 119.255 -1.131 1
1 998 . 13 1 1 A 88 88 ILE H H 88 8.715 8.451 0.264 1
1 999 . 13 1 1 A 88 88 ILE HA H 88 3.305 3.502 -0.197 1
1 1009 . 13 1 1 A 88 88 ILE C C 88 177.261 177.974 -0.713 1
1 1010 . 13 1 1 A 88 88 ILE CA C 88 65.822 65.518 0.304 1
1 1011 . 13 1 1 A 88 88 ILE CB C 88 37.370 37.151 0.219 1
1 1015 . 13 1 1 A 88 88 ILE N N 88 122.929 120.946 1.983 1
1 1016 . 13 1 1 A 89 89 LEU H H 89 8.486 8.353 0.133 1
1 1017 . 13 1 1 A 89 89 LEU HA H 89 3.932 3.930 0.002 1
1 1023 . 13 1 1 A 89 89 LEU C C 89 177.919 179.070 -1.151 1
1 1024 . 13 1 1 A 89 89 LEU CA C 89 59.060 58.185 0.875 1
1 1025 . 13 1 1 A 89 89 LEU CB C 89 41.129 41.847 -0.718 1
1 1028 . 13 1 1 A 89 89 LEU N N 89 122.696 120.108 2.588 1
1 1029 . 13 1 1 A 90 90 LYS H H 90 7.790 7.997 -0.207 1
1 1030 . 13 1 1 A 90 90 LYS HA H 90 4.061 3.902 0.159 1
1 1035 . 13 1 1 A 90 90 LYS C C 90 178.432 178.519 -0.087 1
1 1036 . 13 1 1 A 90 90 LYS CA C 90 59.840 59.307 0.533 1
1 1037 . 13 1 1 A 90 90 LYS CB C 90 32.582 32.172 0.410 1
1 1039 . 13 1 1 A 90 90 LYS N N 90 118.640 118.857 -0.217 1
1 1040 . 13 1 1 A 91 91 ALA H H 91 8.113 8.166 -0.053 1
1 1041 . 13 1 1 A 91 91 ALA HA H 91 4.151 4.087 0.064 1
1 1045 . 13 1 1 A 91 91 ALA C C 91 179.147 179.849 -0.702 1
1 1046 . 13 1 1 A 91 91 ALA CA C 91 54.942 55.319 -0.377 1
1 1047 . 13 1 1 A 91 91 ALA CB C 91 18.242 18.522 -0.280 1
1 1048 . 13 1 1 A 91 91 ALA N N 91 122.939 121.992 0.947 1
1 1049 . 13 1 1 A 92 92 SER H H 92 8.858 8.578 0.280 1
1 1050 . 13 1 1 A 92 92 SER HA H 92 4.898 4.150 0.748 1
1 1052 . 13 1 1 A 92 92 SER C C 92 172.440 176.698 -4.258 1
1 1053 . 13 1 1 A 92 92 SER CA C 92 61.913 61.545 0.368 1
1 1054 . 13 1 1 A 92 92 SER CB C 92 63.081 62.540 0.541 1
1 1055 . 13 1 1 A 92 92 SER N N 92 114.526 112.795 1.731 1
1 1056 . 13 1 1 A 93 93 ARG H H 93 7.704 8.431 -0.727 1
1 1057 . 13 1 1 A 93 93 ARG HA H 93 4.162 4.196 -0.034 1
1 1059 . 13 1 1 A 93 93 ARG C C 93 177.757 178.617 -0.860 1
1 1060 . 13 1 1 A 93 93 ARG CA C 93 59.544 57.751 1.793 1
1 1061 . 13 1 1 A 93 93 ARG CB C 93 30.343 28.889 1.454 1
1 1062 . 13 1 1 A 93 93 ARG N N 93 121.505 120.266 1.239 1
1 1063 . 13 1 1 A 94 94 LYS H H 94 7.456 7.573 -0.117 1
1 1064 . 13 1 1 A 94 94 LYS HA H 94 4.174 4.180 -0.006 1
1 1071 . 13 1 1 A 94 94 LYS C C 94 178.861 179.033 -0.172 1
1 1072 . 13 1 1 A 94 94 LYS CA C 94 59.030 59.132 -0.102 1
1 1073 . 13 1 1 A 94 94 LYS CB C 94 32.239 31.975 0.264 1
1 1077 . 13 1 1 A 94 94 LYS N N 94 119.072 119.945 -0.873 1
1 1078 . 13 1 1 A 95 95 LEU H H 95 8.148 7.933 0.215 1
1 1079 . 13 1 1 A 95 95 LEU HA H 95 4.129 4.125 0.004 1
1 1088 . 13 1 1 A 95 95 LEU C C 95 177.274 177.881 -0.607 1
1 1089 . 13 1 1 A 95 95 LEU CA C 95 57.136 57.006 0.130 1
1 1090 . 13 1 1 A 95 95 LEU CB C 95 41.908 41.697 0.211 1
1 1093 . 13 1 1 A 95 95 LEU N N 95 119.717 119.547 0.170 1
1 1094 . 13 1 1 A 96 96 GLN H H 96 7.807 7.813 -0.006 1
1 1095 . 13 1 1 A 96 96 GLN HA H 96 4.242 4.385 -0.143 1
1 1102 . 13 1 1 A 96 96 GLN C C 96 175.371 176.463 -1.092 1
1 1103 . 13 1 1 A 96 96 GLN CA C 96 56.397 55.678 0.719 1
1 1104 . 13 1 1 A 96 96 GLN CB C 96 29.123 29.082 0.041 1
1 1106 . 13 1 1 A 96 96 GLN N N 96 114.581 116.555 -1.974 1
1 1108 . 13 1 1 A 97 97 GLY H H 97 7.802 8.303 -0.501 1
1 1109 . 13 1 1 A 97 97 GLY HA2 H 97 3.839 3.971 -0.132 1
1 1110 . 13 1 1 A 97 97 GLY HA3 H 97 4.096 3.972 0.124 1
1 1111 . 13 1 1 A 97 97 GLY C C 97 172.636 174.132 -1.496 1
1 1112 . 13 1 1 A 97 97 GLY CA C 97 46.372 46.311 0.061 1
1 1113 . 13 1 1 A 97 97 GLY N N 97 106.959 107.860 -0.901 1
1 1114 . 13 1 1 A 98 98 ASP H H 98 8.156 7.630 0.526 1
1 1115 . 13 1 1 A 98 98 ASP HA H 98 4.754 4.715 0.039 1
1 1118 . 13 1 1 A 98 98 ASP CA C 98 52.882 51.962 0.920 1
1 1119 . 13 1 1 A 98 98 ASP CB C 98 41.603 40.898 0.705 1
1 1120 . 13 1 1 A 98 98 ASP N N 98 118.447 121.262 -2.815 1
1 1121 . 13 1 1 A 99 99 PRO HA H 99 4.470 4.491 -0.021 1
1 1126 . 13 1 1 A 99 99 PRO C C 99 175.500 176.132 -0.632 1
1 1127 . 13 1 1 A 99 99 PRO CA C 99 63.601 63.958 -0.357 1
1 1128 . 13 1 1 A 99 99 PRO CB C 99 32.423 32.501 -0.078 1
1 1130 . 13 1 1 A 100 100 ASP H H 100 8.527 8.493 0.034 1
1 1131 . 13 1 1 A 100 100 ASP HA H 100 4.778 4.847 -0.069 1
1 1134 . 13 1 1 A 100 100 ASP C C 100 174.931 176.312 -1.381 1
1 1135 . 13 1 1 A 100 100 ASP CA C 100 53.915 53.543 0.372 1
1 1136 . 13 1 1 A 100 100 ASP CB C 100 40.665 42.312 -1.647 1
1 1137 . 13 1 1 A 100 100 ASP N N 100 119.340 116.633 2.707 1
1 1138 . 13 1 1 A 101 101 LEU H H 101 7.379 7.343 0.036 1
1 1139 . 13 1 1 A 101 101 LEU HA H 101 4.682 4.367 0.315 1
1 1148 . 13 1 1 A 101 101 LEU CA C 101 52.956 53.760 -0.804 1
1 1149 . 13 1 1 A 101 101 LEU CB C 101 43.393 41.993 1.400 1
1 1152 . 13 1 1 A 101 101 LEU N N 101 122.107 124.842 -2.735 1
1 1153 . 13 1 1 A 102 102 PRO HA H 102 4.487 4.597 -0.110 1
1 1158 . 13 1 1 A 102 102 PRO C C 102 175.697 175.528 0.169 1
1 1159 . 13 1 1 A 102 102 PRO CA C 102 63.113 62.904 0.209 1
1 1160 . 13 1 1 A 102 102 PRO CB C 102 32.138 31.814 0.324 1
1 1163 . 13 1 1 A 103 103 MET H H 103 9.011 8.707 0.304 1
1 1164 . 13 1 1 A 103 103 MET HA H 103 4.769 5.206 -0.437 1
1 1171 . 13 1 1 A 103 103 MET C C 103 174.080 173.981 0.099 1
1 1172 . 13 1 1 A 103 103 MET CA C 103 54.737 53.998 0.739 1
1 1173 . 13 1 1 A 103 103 MET CB C 103 34.857 36.465 -1.608 1
1 1176 . 13 1 1 A 103 103 MET N N 103 123.334 123.106 0.228 1
1 1177 . 13 1 1 A 104 104 SER H H 104 8.239 8.877 -0.638 1
1 1178 . 13 1 1 A 104 104 SER HA H 104 5.079 4.973 0.106 1
1 1181 . 13 1 1 A 104 104 SER C C 104 171.795 172.500 -0.705 1
1 1182 . 13 1 1 A 104 104 SER CA C 104 57.641 56.916 0.725 1
1 1183 . 13 1 1 A 104 104 SER CB C 104 66.282 64.806 1.476 1
1 1184 . 13 1 1 A 104 104 SER N N 104 114.434 117.678 -3.244 1
1 1185 . 13 1 1 A 105 105 PHE H H 105 9.003 8.329 0.674 1
1 1186 . 13 1 1 A 105 105 PHE HA H 105 5.209 5.569 -0.360 1
1 1193 . 13 1 1 A 105 105 PHE C C 105 170.688 172.232 -1.544 1
1 1194 . 13 1 1 A 105 105 PHE CA C 105 56.917 55.901 1.016 1
1 1195 . 13 1 1 A 105 105 PHE CB C 105 41.350 42.365 -1.015 1
1 1196 . 13 1 1 A 105 105 PHE N N 105 116.224 118.627 -2.403 1
1 1197 . 13 1 1 A 106 106 THR H H 106 9.074 9.407 -0.333 1
1 1198 . 13 1 1 A 106 106 THR HA H 106 4.664 4.998 -0.334 1
1 1203 . 13 1 1 A 106 106 THR C C 106 171.767 174.352 -2.585 1
1 1204 . 13 1 1 A 106 106 THR CA C 106 62.162 61.599 0.563 1
1 1205 . 13 1 1 A 106 106 THR CB C 106 70.072 70.634 -0.562 1
1 1207 . 13 1 1 A 106 106 THR N N 106 117.469 116.202 1.267 1
1 1208 . 13 1 1 A 107 107 LEU H H 107 9.804 9.387 0.417 1
1 1209 . 13 1 1 A 107 107 LEU HA H 107 4.750 4.748 0.002 1
1 1219 . 13 1 1 A 107 107 LEU C C 107 172.742 176.083 -3.341 1
1 1220 . 13 1 1 A 107 107 LEU CA C 107 54.151 54.571 -0.420 1
1 1221 . 13 1 1 A 107 107 LEU CB C 107 44.486 42.557 1.929 1
1 1224 . 13 1 1 A 107 107 LEU N N 107 133.400 128.043 5.357 1
1 1225 . 13 1 1 A 108 108 ALA H H 108 8.435 8.976 -0.541 1
1 1226 . 13 1 1 A 108 108 ALA HA H 108 4.683 4.475 0.208 1
1 1230 . 13 1 1 A 108 108 ALA C C 108 173.052 175.781 -2.729 1
1 1231 . 13 1 1 A 108 108 ALA CA C 108 49.308 50.787 -1.479 1
1 1232 . 13 1 1 A 108 108 ALA CB C 108 22.120 19.912 2.208 1
1 1233 . 13 1 1 A 108 108 ALA N N 108 131.422 127.068 4.354 1
1 1234 . 13 1 1 A 109 109 ILE H H 109 8.909 8.889 0.020 1
1 1235 . 13 1 1 A 109 109 ILE HA H 109 4.063 4.919 -0.856 1
1 1245 . 13 1 1 A 109 109 ILE CA C 109 60.982 60.281 0.701 1
1 1246 . 13 1 1 A 109 109 ILE CB C 109 39.074 37.927 1.147 1
1 1250 . 13 1 1 A 109 109 ILE N N 109 124.415 123.884 0.531 1
1 1251 . 13 1 1 A 110 110 VAL H H 110 8.706 8.922 -0.216 1
1 1252 . 13 1 1 A 110 110 VAL HA H 110 4.324 5.420 -1.096 1
1 1260 . 13 1 1 A 110 110 VAL C C 110 175.700 173.204 2.496 1
1 1261 . 13 1 1 A 110 110 VAL CA C 110 62.316 59.895 2.421 1
1 1262 . 13 1 1 A 110 110 VAL CB C 110 31.876 34.309 -2.433 1
1 1264 . 13 1 1 A 110 110 VAL N N 110 127.457 127.430 0.027 1
1 1265 . 13 1 1 A 111 111 GLU H H 111 9.024 8.552 0.472 1
1 1266 . 13 1 1 A 111 111 GLU HA H 111 4.403 4.454 -0.051 1
1 1269 . 13 1 1 A 111 111 GLU C C 111 175.987 177.284 -1.297 1
1 1270 . 13 1 1 A 111 111 GLU CA C 111 56.842 55.452 1.390 1
1 1271 . 13 1 1 A 111 111 GLU CB C 111 31.044 31.044 0.000 1
1 1272 . 13 1 1 A 111 111 GLU N N 111 129.768 129.256 0.512 1
1 1273 . 13 1 1 A 112 112 SER H H 112 9.143 9.042 0.101 1
1 1274 . 13 1 1 A 112 112 SER HA H 112 4.394 4.195 0.199 1
1 1276 . 13 1 1 A 112 112 SER C C 112 173.187 175.356 -2.169 1
1 1277 . 13 1 1 A 112 112 SER CA C 112 60.180 61.080 -0.900 1
1 1278 . 13 1 1 A 112 112 SER CB C 112 63.415 62.750 0.665 1
1 1279 . 13 1 1 A 112 112 SER N N 112 115.956 121.022 -5.066 1
1 1280 . 13 1 1 A 113 113 ASP H H 113 8.133 7.751 0.382 1
1 1281 . 13 1 1 A 113 113 ASP HA H 113 4.573 4.694 -0.121 1
1 1284 . 13 1 1 A 113 113 ASP C C 113 175.430 175.306 0.124 1
1 1285 . 13 1 1 A 113 113 ASP CA C 113 54.115 53.913 0.202 1
1 1286 . 13 1 1 A 113 113 ASP CB C 113 40.011 40.761 -0.750 1
1 1287 . 13 1 1 A 113 113 ASP N N 113 118.343 118.737 -0.394 1
1 1288 . 13 1 1 A 114 114 SER H H 114 8.034 8.200 -0.166 1
1 1289 . 13 1 1 A 114 114 SER HA H 114 4.057 4.105 -0.048 1
1 1291 . 13 1 1 A 114 114 SER C C 114 172.209 172.782 -0.573 1
1 1292 . 13 1 1 A 114 114 SER CA C 114 60.179 59.521 0.658 1
1 1293 . 13 1 1 A 114 114 SER CB C 114 62.702 61.143 1.559 1
1 1294 . 13 1 1 A 114 114 SER N N 114 109.836 112.606 -2.770 1
1 1295 . 13 1 1 A 115 115 THR H H 115 7.711 7.791 -0.080 1
1 1296 . 13 1 1 A 115 115 THR HA H 115 4.250 4.496 -0.246 1
1 1300 . 13 1 1 A 115 115 THR C C 115 171.500 173.903 -2.403 1
1 1301 . 13 1 1 A 115 115 THR CA C 115 63.547 60.808 2.739 1
1 1302 . 13 1 1 A 115 115 THR CB C 115 69.595 69.541 0.054 1
1 1303 . 13 1 1 A 115 115 THR N N 115 117.407 111.346 6.061 1
1 1304 . 13 1 1 A 116 116 ILE H H 116 8.219 9.190 -0.971 1
1 1305 . 13 1 1 A 116 116 ILE HA H 116 4.769 5.197 -0.428 1
1 1315 . 13 1 1 A 116 116 ILE C C 116 174.434 174.190 0.244 1
1 1316 . 13 1 1 A 116 116 ILE CA C 116 60.306 59.527 0.779 1
1 1317 . 13 1 1 A 116 116 ILE CB C 116 40.686 38.897 1.789 1
1 1321 . 13 1 1 A 116 116 ILE N N 116 125.480 127.148 -1.668 1
1 1322 . 13 1 1 A 117 117 VAL H H 117 8.695 9.065 -0.370 1
1 1323 . 13 1 1 A 117 117 VAL HA H 117 4.315 4.977 -0.662 1
1 1328 . 13 1 1 A 117 117 VAL C C 117 172.243 173.118 -0.875 1
1 1329 . 13 1 1 A 117 117 VAL CA C 117 60.621 59.632 0.989 1
1 1330 . 13 1 1 A 117 117 VAL CB C 117 34.558 35.040 -0.482 1
1 1332 . 13 1 1 A 117 117 VAL N N 117 127.887 126.766 1.121 1
1 1333 . 13 1 1 A 118 118 TYR H H 118 8.270 8.724 -0.454 1
1 1334 . 13 1 1 A 118 118 TYR HA H 118 5.327 5.517 -0.190 1
1 1342 . 13 1 1 A 118 118 TYR C C 118 174.250 174.708 -0.458 1
1 1343 . 13 1 1 A 118 118 TYR CA C 118 57.283 56.398 0.885 1
1 1344 . 13 1 1 A 118 118 TYR CB C 118 39.262 39.760 -0.498 1
1 1345 . 13 1 1 A 118 118 TYR N N 118 124.822 128.561 -3.739 1
1 1346 . 13 1 1 A 119 119 TYR H H 119 9.207 9.059 0.148 1
1 1347 . 13 1 1 A 119 119 TYR HA H 119 4.821 5.339 -0.518 1
1 1354 . 13 1 1 A 119 119 TYR C C 119 171.994 173.758 -1.764 1
1 1355 . 13 1 1 A 119 119 TYR CA C 119 58.116 56.718 1.398 1
1 1356 . 13 1 1 A 119 119 TYR CB C 119 43.544 42.093 1.451 1
1 1357 . 13 1 1 A 119 119 TYR N N 119 125.153 124.405 0.748 1
1 1358 . 13 1 1 A 120 120 LYS H H 120 7.700 8.720 -1.020 1
1 1359 . 13 1 1 A 120 120 LYS HA H 120 4.558 4.632 -0.074 1
1 1366 . 13 1 1 A 120 120 LYS C C 120 172.017 175.583 -3.566 1
1 1367 . 13 1 1 A 120 120 LYS CA C 120 57.217 55.071 2.146 1
1 1368 . 13 1 1 A 120 120 LYS CB C 120 33.914 33.843 0.071 1
1 1372 . 13 1 1 A 120 120 LYS N N 120 129.442 128.880 0.562 1
1 1373 . 13 1 1 A 121 121 LEU H H 121 8.112 8.388 -0.276 1
1 1374 . 13 1 1 A 121 121 LEU HA H 121 5.323 4.997 0.326 1
1 1384 . 13 1 1 A 121 121 LEU C C 121 175.733 175.119 0.614 1
1 1385 . 13 1 1 A 121 121 LEU CA C 121 52.716 52.543 0.173 1
1 1386 . 13 1 1 A 121 121 LEU CB C 121 44.098 44.955 -0.857 1
1 1389 . 13 1 1 A 121 121 LEU N N 121 123.403 122.503 0.900 1
1 1390 . 13 1 1 A 122 122 THR H H 122 8.338 8.929 -0.591 1
1 1391 . 13 1 1 A 122 122 THR HA H 122 5.097 4.641 0.456 1
1 1396 . 13 1 1 A 122 122 THR C C 122 173.221 173.237 -0.016 1
1 1397 . 13 1 1 A 122 122 THR CA C 122 60.306 60.602 -0.296 1
1 1398 . 13 1 1 A 122 122 THR CB C 122 72.473 72.049 0.424 1
1 1400 . 13 1 1 A 122 122 THR N N 122 109.081 116.114 -7.033 1
1 7 . 14 1 1 A 2 2 GLU H H 2 8.994 8.643 0.351 1
1 8 . 14 1 1 A 2 2 GLU HA H 2 4.278 4.777 -0.499 1
1 13 . 14 1 1 A 2 2 GLU C C 2 175.315 175.850 -0.535 1
1 14 . 14 1 1 A 2 2 GLU CA C 2 57.318 55.797 1.521 1
1 15 . 14 1 1 A 2 2 GLU CB C 2 29.221 30.330 -1.109 1
1 17 . 14 1 1 A 2 2 GLU N N 2 122.259 121.147 1.112 1
1 18 . 14 1 1 A 3 3 ASP H H 3 8.048 7.903 0.145 1
1 19 . 14 1 1 A 3 3 ASP HA H 3 4.580 5.269 -0.689 1
1 21 . 14 1 1 A 3 3 ASP C C 3 175.636 174.867 0.769 1
1 22 . 14 1 1 A 3 3 ASP CA C 3 54.579 53.330 1.249 1
1 23 . 14 1 1 A 3 3 ASP CB C 3 40.984 42.702 -1.718 1
1 24 . 14 1 1 A 3 3 ASP N N 3 119.830 119.204 0.626 1
1 25 . 14 1 1 A 4 4 ALA H H 4 8.090 7.952 0.138 1
1 26 . 14 1 1 A 4 4 ALA HA H 4 4.216 4.413 -0.197 1
1 30 . 14 1 1 A 4 4 ALA C C 4 177.157 177.683 -0.526 1
1 31 . 14 1 1 A 4 4 ALA CA C 4 53.620 51.425 2.195 1
1 32 . 14 1 1 A 4 4 ALA CB C 4 18.728 19.489 -0.761 1
1 33 . 14 1 1 A 4 4 ALA N N 4 123.957 123.253 0.704 1
1 34 . 14 1 1 A 5 5 TRP H H 5 7.941 7.417 0.524 1
1 35 . 14 1 1 A 5 5 TRP HA H 5 4.559 4.542 0.017 1
1 39 . 14 1 1 A 5 5 TRP C C 5 176.072 177.587 -1.515 1
1 40 . 14 1 1 A 5 5 TRP CA C 5 57.744 59.590 -1.846 1
1 41 . 14 1 1 A 5 5 TRP CB C 5 28.906 30.459 -1.553 1
1 42 . 14 1 1 A 5 5 TRP N N 5 118.408 120.022 -1.614 1
1 44 . 14 1 1 A 6 6 MET H H 6 7.679 8.264 -0.585 1
1 45 . 14 1 1 A 6 6 MET HA H 6 3.785 4.686 -0.901 1
1 52 . 14 1 1 A 6 6 MET C C 6 175.174 176.533 -1.359 1
1 53 . 14 1 1 A 6 6 MET CA C 6 57.724 56.889 0.835 1
1 54 . 14 1 1 A 6 6 MET CB C 6 31.640 34.721 -3.081 1
1 57 . 14 1 1 A 6 6 MET N N 6 121.538 116.125 5.413 1
1 58 . 14 1 1 A 7 7 GLY H H 7 7.247 8.152 -0.905 1
1 59 . 14 1 1 A 7 7 GLY HA2 H 7 3.455 4.391 -0.936 1
1 60 . 14 1 1 A 7 7 GLY HA3 H 7 3.578 4.510 -0.932 1
1 61 . 14 1 1 A 7 7 GLY C C 7 172.852 174.839 -1.987 1
1 62 . 14 1 1 A 7 7 GLY CA C 7 45.896 43.788 2.108 1
1 63 . 14 1 1 A 7 7 GLY N N 7 104.055 105.025 -0.970 1
1 64 . 14 1 1 A 8 8 THR H H 8 7.436 8.275 -0.839 1
1 65 . 14 1 1 A 8 8 THR HA H 8 4.428 4.333 0.095 1
1 70 . 14 1 1 A 8 8 THR C C 8 172.973 174.514 -1.541 1
1 71 . 14 1 1 A 8 8 THR CA C 8 60.751 63.877 -3.126 1
1 72 . 14 1 1 A 8 8 THR CB C 8 69.637 69.717 -0.080 1
1 74 . 14 1 1 A 8 8 THR N N 8 107.669 112.971 -5.302 1
1 75 . 14 1 1 A 9 9 HIS H H 9 8.048 7.967 0.081 1
1 76 . 14 1 1 A 9 9 HIS HA H 9 4.654 4.833 -0.179 1
1 79 . 14 1 1 A 9 9 HIS CA C 9 56.163 54.463 1.700 1
1 80 . 14 1 1 A 9 9 HIS CB C 9 32.619 30.631 1.988 1
1 81 . 14 1 1 A 9 9 HIS N N 9 127.281 117.683 9.598 1
1 82 . 14 1 1 A 10 10 PRO HA H 10 4.257 4.297 -0.040 1
1 88 . 14 1 1 A 10 10 PRO C C 10 178.779 179.172 -0.393 1
1 89 . 14 1 1 A 10 10 PRO CA C 10 65.565 66.039 -0.474 1
1 90 . 14 1 1 A 10 10 PRO CB C 10 32.422 31.918 0.504 1
1 93 . 14 1 1 A 11 11 LYS H H 11 10.994 8.553 2.441 1
1 94 . 14 1 1 A 11 11 LYS HA H 11 4.282 4.178 0.104 1
1 100 . 14 1 1 A 11 11 LYS C C 11 177.279 178.688 -1.409 1
1 101 . 14 1 1 A 11 11 LYS CA C 11 56.859 59.533 -2.674 1
1 102 . 14 1 1 A 11 11 LYS CB C 11 31.279 32.313 -1.034 1
1 104 . 14 1 1 A 11 11 LYS N N 11 121.398 118.457 2.941 1
1 105 . 14 1 1 A 12 12 TYR H H 12 7.146 8.356 -1.210 1
1 106 . 14 1 1 A 12 12 TYR HA H 12 3.722 4.360 -0.638 1
1 113 . 14 1 1 A 12 12 TYR C C 12 176.265 177.613 -1.348 1
1 114 . 14 1 1 A 12 12 TYR CA C 12 61.189 61.425 -0.236 1
1 115 . 14 1 1 A 12 12 TYR CB C 12 37.796 38.434 -0.638 1
1 116 . 14 1 1 A 12 12 TYR N N 12 121.579 122.026 -0.447 1
1 117 . 14 1 1 A 13 13 LEU H H 13 7.778 8.999 -1.221 1
1 118 . 14 1 1 A 13 13 LEU HA H 13 3.773 4.017 -0.244 1
1 127 . 14 1 1 A 13 13 LEU C C 13 178.462 178.626 -0.164 1
1 128 . 14 1 1 A 13 13 LEU CA C 13 57.942 58.314 -0.372 1
1 129 . 14 1 1 A 13 13 LEU CB C 13 41.064 41.614 -0.550 1
1 132 . 14 1 1 A 13 13 LEU N N 13 117.518 120.960 -3.442 1
1 133 . 14 1 1 A 14 14 GLU H H 14 7.867 8.816 -0.949 1
1 134 . 14 1 1 A 14 14 GLU HA H 14 3.935 3.983 -0.048 1
1 139 . 14 1 1 A 14 14 GLU C C 14 178.326 178.790 -0.464 1
1 140 . 14 1 1 A 14 14 GLU CA C 14 59.368 59.832 -0.464 1
1 141 . 14 1 1 A 14 14 GLU CB C 14 30.147 29.334 0.813 1
1 143 . 14 1 1 A 14 14 GLU N N 14 119.135 119.145 -0.010 1
1 144 . 14 1 1 A 15 15 MET H H 15 7.773 7.766 0.007 1
1 145 . 14 1 1 A 15 15 MET HA H 15 3.936 4.099 -0.163 1
1 152 . 14 1 1 A 15 15 MET C C 15 177.886 178.199 -0.313 1
1 153 . 14 1 1 A 15 15 MET CA C 15 59.465 58.300 1.165 1
1 154 . 14 1 1 A 15 15 MET CB C 15 33.987 32.217 1.770 1
1 157 . 14 1 1 A 15 15 MET N N 15 117.884 119.316 -1.432 1
1 158 . 14 1 1 A 16 16 MET H H 16 8.145 8.027 0.118 1
1 159 . 14 1 1 A 16 16 MET HA H 16 4.159 4.289 -0.130 1
1 166 . 14 1 1 A 16 16 MET C C 16 177.835 178.468 -0.633 1
1 167 . 14 1 1 A 16 16 MET CA C 16 57.397 57.057 0.340 1
1 168 . 14 1 1 A 16 16 MET CB C 16 31.867 31.196 0.671 1
1 171 . 14 1 1 A 16 16 MET N N 16 119.555 117.861 1.694 1
1 172 . 14 1 1 A 17 17 GLU H H 17 7.761 7.899 -0.138 1
1 173 . 14 1 1 A 17 17 GLU HA H 17 4.117 4.073 0.044 1
1 176 . 14 1 1 A 17 17 GLU C C 17 175.994 178.231 -2.237 1
1 177 . 14 1 1 A 17 17 GLU CA C 17 57.392 58.986 -1.594 1
1 178 . 14 1 1 A 17 17 GLU CB C 17 29.432 29.565 -0.133 1
1 180 . 14 1 1 A 17 17 GLU N N 17 118.216 121.134 -2.918 1
1 181 . 14 1 1 A 18 18 LEU H H 18 7.201 7.342 -0.141 1
1 182 . 14 1 1 A 18 18 LEU HA H 18 4.111 4.234 -0.123 1
1 191 . 14 1 1 A 18 18 LEU C C 18 175.781 177.225 -1.444 1
1 192 . 14 1 1 A 18 18 LEU CA C 18 56.366 54.461 1.905 1
1 193 . 14 1 1 A 18 18 LEU CB C 18 42.030 41.642 0.388 1
1 196 . 14 1 1 A 18 18 LEU N N 18 117.448 116.451 0.997 1
1 197 . 14 1 1 A 19 19 ASP H H 19 7.789 8.117 -0.328 1
1 198 . 14 1 1 A 19 19 ASP HA H 19 4.360 4.451 -0.091 1
1 201 . 14 1 1 A 19 19 ASP C C 19 173.765 175.419 -1.654 1
1 202 . 14 1 1 A 19 19 ASP CA C 19 54.851 56.660 -1.809 1
1 203 . 14 1 1 A 19 19 ASP CB C 19 39.115 40.890 -1.775 1
1 204 . 14 1 1 A 19 19 ASP N N 19 115.844 119.344 -3.500 1
1 205 . 14 1 1 A 20 20 ILE H H 20 8.142 7.684 0.458 1
1 206 . 14 1 1 A 20 20 ILE HA H 20 4.128 3.707 0.421 1
1 216 . 14 1 1 A 20 20 ILE C C 20 174.710 176.212 -1.502 1
1 217 . 14 1 1 A 20 20 ILE CA C 20 60.465 64.258 -3.793 1
1 218 . 14 1 1 A 20 20 ILE CB C 20 40.407 36.235 4.172 1
1 222 . 14 1 1 A 20 20 ILE N N 20 117.287 119.183 -1.896 1
1 223 . 14 1 1 A 21 21 GLY H H 21 8.207 8.397 -0.190 1
1 224 . 14 1 1 A 21 21 GLY HA2 H 21 3.889 4.058 -0.169 1
1 225 . 14 1 1 A 21 21 GLY HA3 H 21 3.924 4.058 -0.134 1
1 226 . 14 1 1 A 21 21 GLY C C 21 172.162 173.379 -1.217 1
1 227 . 14 1 1 A 21 21 GLY CA C 21 45.017 44.954 0.063 1
1 228 . 14 1 1 A 21 21 GLY N N 21 110.656 108.416 2.240 1
1 229 . 14 1 1 A 22 22 ASP H H 22 7.727 8.005 -0.278 1
1 230 . 14 1 1 A 22 22 ASP HA H 22 4.794 4.949 -0.155 1
1 233 . 14 1 1 A 22 22 ASP C C 22 174.884 175.640 -0.756 1
1 234 . 14 1 1 A 22 22 ASP CA C 22 52.471 53.532 -1.061 1
1 235 . 14 1 1 A 22 22 ASP CB C 22 42.069 42.490 -0.421 1
1 236 . 14 1 1 A 22 22 ASP N N 22 119.305 120.321 -1.016 1
1 237 . 14 1 1 A 23 23 ALA H H 23 8.644 8.985 -0.341 1
1 238 . 14 1 1 A 23 23 ALA HA H 23 4.120 4.077 0.043 1
1 242 . 14 1 1 A 23 23 ALA C C 23 179.546 179.710 -0.164 1
1 243 . 14 1 1 A 23 23 ALA CA C 23 55.609 54.613 0.996 1
1 244 . 14 1 1 A 23 23 ALA CB C 23 18.573 18.663 -0.090 1
1 245 . 14 1 1 A 23 23 ALA N N 23 122.468 128.397 -5.929 1
1 246 . 14 1 1 A 24 24 THR H H 24 8.238 7.899 0.339 1
1 247 . 14 1 1 A 24 24 THR HA H 24 4.184 4.018 0.166 1
1 252 . 14 1 1 A 24 24 THR C C 24 174.841 176.560 -1.719 1
1 253 . 14 1 1 A 24 24 THR CA C 24 66.241 66.637 -0.396 1
1 254 . 14 1 1 A 24 24 THR CB C 24 68.376 68.283 0.093 1
1 256 . 14 1 1 A 24 24 THR N N 24 114.824 114.495 0.329 1
1 257 . 14 1 1 A 25 25 GLN H H 25 8.037 8.470 -0.433 1
1 258 . 14 1 1 A 25 25 GLN HA H 25 4.095 4.034 0.061 1
1 265 . 14 1 1 A 25 25 GLN C C 25 177.603 178.650 -1.047 1
1 266 . 14 1 1 A 25 25 GLN CA C 25 59.261 58.797 0.464 1
1 267 . 14 1 1 A 25 25 GLN CB C 25 28.437 28.286 0.151 1
1 269 . 14 1 1 A 25 25 GLN N N 25 122.518 119.961 2.557 1
1 271 . 14 1 1 A 26 26 VAL H H 26 7.994 7.851 0.143 1
1 272 . 14 1 1 A 26 26 VAL HA H 26 3.469 3.690 -0.221 1
1 280 . 14 1 1 A 26 26 VAL C C 26 175.552 177.942 -2.390 1
1 281 . 14 1 1 A 26 26 VAL CA C 26 66.909 66.219 0.690 1
1 282 . 14 1 1 A 26 26 VAL CB C 26 31.582 31.499 0.083 1
1 285 . 14 1 1 A 26 26 VAL N N 26 119.112 120.918 -1.806 1
1 286 . 14 1 1 A 27 27 TYR H H 27 8.003 8.851 -0.848 1
1 287 . 14 1 1 A 27 27 TYR HA H 27 4.357 4.436 -0.079 1
1 294 . 14 1 1 A 27 27 TYR C C 27 175.856 177.186 -1.330 1
1 295 . 14 1 1 A 27 27 TYR CA C 27 62.197 61.760 0.437 1
1 296 . 14 1 1 A 27 27 TYR CB C 27 38.394 38.842 -0.448 1
1 297 . 14 1 1 A 27 27 TYR N N 27 119.170 120.979 -1.809 1
1 298 . 14 1 1 A 28 28 VAL H H 28 8.087 8.768 -0.681 1
1 299 . 14 1 1 A 28 28 VAL HA H 28 3.652 3.473 0.179 1
1 307 . 14 1 1 A 28 28 VAL C C 28 176.134 177.895 -1.761 1
1 308 . 14 1 1 A 28 28 VAL CA C 28 66.247 66.246 0.001 1
1 309 . 14 1 1 A 28 28 VAL CB C 28 31.241 31.326 -0.085 1
1 312 . 14 1 1 A 28 28 VAL N N 28 113.112 119.628 -6.516 1
1 313 . 14 1 1 A 29 29 ALA H H 29 7.853 8.804 -0.951 1
1 314 . 14 1 1 A 29 29 ALA HA H 29 3.913 4.088 -0.175 1
1 318 . 14 1 1 A 29 29 ALA C C 29 177.850 179.286 -1.436 1
1 319 . 14 1 1 A 29 29 ALA CA C 29 55.274 54.960 0.314 1
1 320 . 14 1 1 A 29 29 ALA CB C 29 17.876 18.552 -0.676 1
1 321 . 14 1 1 A 29 29 ALA N N 29 121.350 122.289 -0.939 1
1 322 . 14 1 1 A 30 30 PHE H H 30 8.724 8.245 0.479 1
1 323 . 14 1 1 A 30 30 PHE HA H 30 4.098 4.237 -0.139 1
1 327 . 14 1 1 A 30 30 PHE C C 30 175.035 177.253 -2.218 1
1 328 . 14 1 1 A 30 30 PHE CA C 30 61.264 61.636 -0.372 1
1 329 . 14 1 1 A 30 30 PHE CB C 30 38.926 39.400 -0.474 1
1 330 . 14 1 1 A 30 30 PHE N N 30 120.478 120.316 0.162 1
1 331 . 14 1 1 A 31 31 LEU H H 31 8.146 8.180 -0.034 1
1 332 . 14 1 1 A 31 31 LEU HA H 31 3.597 3.573 0.024 1
1 341 . 14 1 1 A 31 31 LEU C C 31 179.508 179.252 0.256 1
1 342 . 14 1 1 A 31 31 LEU CA C 31 57.884 58.120 -0.236 1
1 343 . 14 1 1 A 31 31 LEU CB C 31 41.829 42.231 -0.402 1
1 346 . 14 1 1 A 31 31 LEU N N 31 118.427 120.260 -1.833 1
1 347 . 14 1 1 A 32 32 VAL H H 32 7.627 7.637 -0.010 1
1 348 . 14 1 1 A 32 32 VAL HA H 32 3.464 3.804 -0.340 1
1 356 . 14 1 1 A 32 32 VAL C C 32 174.956 177.655 -2.699 1
1 357 . 14 1 1 A 32 32 VAL CA C 32 66.373 65.606 0.767 1
1 358 . 14 1 1 A 32 32 VAL CB C 32 31.121 31.436 -0.315 1
1 361 . 14 1 1 A 32 32 VAL N N 32 119.497 113.906 5.591 1
1 362 . 14 1 1 A 33 33 TYR H H 33 8.366 8.684 -0.318 1
1 363 . 14 1 1 A 33 33 TYR HA H 33 3.485 4.004 -0.519 1
1 370 . 14 1 1 A 33 33 TYR C C 33 174.883 176.826 -1.943 1
1 371 . 14 1 1 A 33 33 TYR CA C 33 62.866 61.388 1.478 1
1 372 . 14 1 1 A 33 33 TYR CB C 33 37.778 38.336 -0.558 1
1 373 . 14 1 1 A 33 33 TYR N N 33 121.842 124.185 -2.343 1
1 374 . 14 1 1 A 34 34 LEU H H 34 8.000 8.456 -0.456 1
1 375 . 14 1 1 A 34 34 LEU HA H 34 3.495 3.662 -0.167 1
1 385 . 14 1 1 A 34 34 LEU C C 34 178.240 179.040 -0.800 1
1 386 . 14 1 1 A 34 34 LEU CA C 34 57.453 57.418 0.035 1
1 387 . 14 1 1 A 34 34 LEU CB C 34 41.828 40.828 1.000 1
1 390 . 14 1 1 A 34 34 LEU N N 34 116.692 119.410 -2.718 1
1 391 . 14 1 1 A 35 35 ASP H H 35 7.688 8.032 -0.344 1
1 392 . 14 1 1 A 35 35 ASP HA H 35 4.302 4.272 0.030 1
1 395 . 14 1 1 A 35 35 ASP C C 35 177.507 178.501 -0.994 1
1 396 . 14 1 1 A 35 35 ASP CA C 35 58.196 57.644 0.552 1
1 397 . 14 1 1 A 35 35 ASP CB C 35 43.070 41.322 1.748 1
1 398 . 14 1 1 A 35 35 ASP N N 35 120.507 120.156 0.351 1
1 399 . 14 1 1 A 36 36 LEU H H 36 8.482 8.406 0.076 1
1 400 . 14 1 1 A 36 36 LEU HA H 36 3.328 3.517 -0.189 1
1 410 . 14 1 1 A 36 36 LEU C C 36 176.774 179.043 -2.269 1
1 411 . 14 1 1 A 36 36 LEU CA C 36 57.461 57.473 -0.012 1
1 412 . 14 1 1 A 36 36 LEU CB C 36 41.344 41.049 0.295 1
1 416 . 14 1 1 A 36 36 LEU N N 36 117.671 119.951 -2.280 1
1 417 . 14 1 1 A 37 37 MET H H 37 7.822 7.551 0.271 1
1 418 . 14 1 1 A 37 37 MET HA H 37 4.401 4.266 0.135 1
1 425 . 14 1 1 A 37 37 MET C C 37 177.862 177.178 0.684 1
1 426 . 14 1 1 A 37 37 MET CA C 37 56.434 57.891 -1.457 1
1 427 . 14 1 1 A 37 37 MET CB C 37 31.573 32.889 -1.316 1
1 430 . 14 1 1 A 37 37 MET N N 37 112.952 116.502 -3.550 1
1 431 . 14 1 1 A 38 38 GLU H H 38 8.667 8.054 0.613 1
1 432 . 14 1 1 A 38 38 GLU HA H 38 4.457 4.267 0.190 1
1 436 . 14 1 1 A 38 38 GLU C C 38 176.582 177.334 -0.752 1
1 437 . 14 1 1 A 38 38 GLU CA C 38 57.659 58.008 -0.349 1
1 438 . 14 1 1 A 38 38 GLU CB C 38 29.936 30.480 -0.544 1
1 440 . 14 1 1 A 38 38 GLU N N 38 116.463 118.317 -1.854 1
1 441 . 14 1 1 A 39 39 SER H H 39 7.657 8.157 -0.500 1
1 442 . 14 1 1 A 39 39 SER HA H 39 4.658 4.566 0.092 1
1 445 . 14 1 1 A 39 39 SER C C 39 175.661 176.229 -0.568 1
1 446 . 14 1 1 A 39 39 SER CA C 39 60.449 59.877 0.572 1
1 447 . 14 1 1 A 39 39 SER CB C 39 63.341 64.203 -0.862 1
1 448 . 14 1 1 A 39 39 SER N N 39 113.870 115.134 -1.264 1
1 449 . 14 1 1 A 40 40 LYS H H 40 8.165 7.911 0.254 1
1 450 . 14 1 1 A 40 40 LYS HA H 40 4.454 4.032 0.422 1
1 458 . 14 1 1 A 40 40 LYS C C 40 174.970 176.130 -1.160 1
1 459 . 14 1 1 A 40 40 LYS CA C 40 55.753 58.469 -2.716 1
1 460 . 14 1 1 A 40 40 LYS CB C 40 32.337 32.429 -0.092 1
1 464 . 14 1 1 A 40 40 LYS N N 40 116.671 122.310 -5.639 1
1 465 . 14 1 1 A 41 41 SER H H 41 7.017 7.882 -0.865 1
1 466 . 14 1 1 A 41 41 SER HA H 41 4.209 4.426 -0.217 1
1 469 . 14 1 1 A 41 41 SER C C 41 173.770 173.426 0.344 1
1 470 . 14 1 1 A 41 41 SER CA C 41 58.435 58.977 -0.542 1
1 471 . 14 1 1 A 41 41 SER CB C 41 61.700 61.467 0.233 1
1 472 . 14 1 1 A 41 41 SER N N 41 109.989 114.264 -4.275 1
1 473 . 14 1 1 A 42 42 TRP H H 42 8.876 7.942 0.934 1
1 474 . 14 1 1 A 42 42 TRP HA H 42 4.698 4.850 -0.152 1
1 478 . 14 1 1 A 42 42 TRP C C 42 174.477 177.658 -3.181 1
1 479 . 14 1 1 A 42 42 TRP CA C 42 59.443 57.097 2.346 1
1 480 . 14 1 1 A 42 42 TRP CB C 42 28.203 30.596 -2.393 1
1 481 . 14 1 1 A 42 42 TRP N N 42 121.116 125.018 -3.902 1
1 483 . 14 1 1 A 43 43 HIS H H 43 8.132 8.512 -0.380 1
1 484 . 14 1 1 A 43 43 HIS HA H 43 4.445 4.373 0.072 1
1 488 . 14 1 1 A 43 43 HIS C C 43 174.405 174.314 0.091 1
1 489 . 14 1 1 A 43 43 HIS CA C 43 58.556 59.487 -0.931 1
1 490 . 14 1 1 A 43 43 HIS CB C 43 29.430 30.625 -1.195 1
1 491 . 14 1 1 A 43 43 HIS N N 43 119.397 121.620 -2.223 1
1 492 . 14 1 1 A 44 44 GLU H H 44 8.140 7.523 0.617 1
1 493 . 14 1 1 A 44 44 GLU HA H 44 4.432 4.555 -0.123 1
1 497 . 14 1 1 A 44 44 GLU C C 44 173.010 174.277 -1.267 1
1 498 . 14 1 1 A 44 44 GLU CA C 44 56.421 56.211 0.210 1
1 499 . 14 1 1 A 44 44 GLU CB C 44 33.285 33.582 -0.297 1
1 501 . 14 1 1 A 44 44 GLU N N 44 116.181 118.014 -1.833 1
1 502 . 14 1 1 A 45 45 VAL H H 45 8.428 8.610 -0.182 1
1 503 . 14 1 1 A 45 45 VAL HA H 45 4.492 5.097 -0.605 1
1 511 . 14 1 1 A 45 45 VAL C C 45 172.339 175.015 -2.676 1
1 512 . 14 1 1 A 45 45 VAL CA C 45 63.071 61.062 2.009 1
1 513 . 14 1 1 A 45 45 VAL CB C 45 35.145 35.108 0.037 1
1 516 . 14 1 1 A 45 45 VAL N N 45 123.272 125.217 -1.945 1
1 517 . 14 1 1 A 46 46 ASN H H 46 9.050 9.100 -0.050 1
1 518 . 14 1 1 A 46 46 ASN HA H 46 5.261 5.670 -0.409 1
1 523 . 14 1 1 A 46 46 ASN C C 46 172.845 173.393 -0.548 1
1 524 . 14 1 1 A 46 46 ASN CA C 46 51.895 51.256 0.639 1
1 525 . 14 1 1 A 46 46 ASN CB C 46 42.322 42.812 -0.490 1
1 526 . 14 1 1 A 46 46 ASN N N 46 123.901 123.345 0.556 1
1 528 . 14 1 1 A 47 47 CYS H H 47 9.039 9.050 -0.011 1
1 529 . 14 1 1 A 47 47 CYS HA H 47 5.160 5.414 -0.254 1
1 532 . 14 1 1 A 47 47 CYS C C 47 172.454 173.155 -0.701 1
1 533 . 14 1 1 A 47 47 CYS CA C 47 56.473 57.038 -0.565 1
1 534 . 14 1 1 A 47 47 CYS CB C 47 29.297 30.433 -1.136 1
1 535 . 14 1 1 A 47 47 CYS N N 47 119.663 119.214 0.449 1
1 536 . 14 1 1 A 48 48 VAL H H 48 9.083 9.022 0.061 1
1 537 . 14 1 1 A 48 48 VAL HA H 48 4.344 4.762 -0.418 1
1 542 . 14 1 1 A 48 48 VAL C C 48 173.307 174.631 -1.324 1
1 543 . 14 1 1 A 48 48 VAL CA C 48 61.368 60.772 0.596 1
1 544 . 14 1 1 A 48 48 VAL CB C 48 35.345 35.461 -0.116 1
1 546 . 14 1 1 A 48 48 VAL N N 48 124.672 126.386 -1.714 1
1 547 . 14 1 1 A 49 49 GLY H H 49 9.019 9.087 -0.068 1
1 548 . 14 1 1 A 49 49 GLY HA2 H 49 3.460 4.213 -0.753 1
1 549 . 14 1 1 A 49 49 GLY HA3 H 49 4.539 4.217 0.322 1
1 550 . 14 1 1 A 49 49 GLY C C 49 171.278 172.085 -0.807 1
1 551 . 14 1 1 A 49 49 GLY CA C 49 45.075 44.382 0.693 1
1 552 . 14 1 1 A 49 49 GLY N N 49 113.131 115.710 -2.579 1
1 553 . 14 1 1 A 50 50 LEU H H 50 8.747 9.461 -0.714 1
1 554 . 14 1 1 A 50 50 LEU HA H 50 5.102 4.987 0.115 1
1 564 . 14 1 1 A 50 50 LEU CA C 50 51.417 51.376 0.041 1
1 565 . 14 1 1 A 50 50 LEU CB C 50 41.754 42.488 -0.734 1
1 569 . 14 1 1 A 50 50 LEU N N 50 124.471 125.864 -1.393 1
1 570 . 14 1 1 A 51 51 PRO HA H 51 4.106 4.230 -0.124 1
1 577 . 14 1 1 A 51 51 PRO C C 51 178.422 178.175 0.247 1
1 578 . 14 1 1 A 51 51 PRO CA C 51 65.680 65.095 0.585 1
1 579 . 14 1 1 A 51 51 PRO CB C 51 31.939 32.028 -0.089 1
1 582 . 14 1 1 A 52 52 GLU H H 52 9.721 8.271 1.450 1
1 583 . 14 1 1 A 52 52 GLU HA H 52 4.176 4.141 0.035 1
1 588 . 14 1 1 A 52 52 GLU C C 52 176.146 178.118 -1.972 1
1 589 . 14 1 1 A 52 52 GLU CA C 52 59.158 59.401 -0.243 1
1 590 . 14 1 1 A 52 52 GLU CB C 52 28.442 29.242 -0.800 1
1 592 . 14 1 1 A 52 52 GLU N N 52 118.552 117.835 0.717 1
1 593 . 14 1 1 A 53 53 LEU H H 53 7.089 7.816 -0.727 1
1 594 . 14 1 1 A 53 53 LEU HA H 53 4.511 4.256 0.255 1
1 603 . 14 1 1 A 53 53 LEU C C 53 174.027 176.320 -2.293 1
1 604 . 14 1 1 A 53 53 LEU CA C 53 53.825 54.971 -1.146 1
1 605 . 14 1 1 A 53 53 LEU CB C 53 43.825 42.316 1.509 1
1 608 . 14 1 1 A 53 53 LEU N N 53 116.763 118.034 -1.271 1
1 609 . 14 1 1 A 54 54 GLN H H 54 7.964 7.795 0.169 1
1 610 . 14 1 1 A 54 54 GLN HA H 54 3.591 3.940 -0.349 1
1 616 . 14 1 1 A 54 54 GLN C C 54 172.604 174.495 -1.891 1
1 617 . 14 1 1 A 54 54 GLN CA C 54 56.961 57.126 -0.165 1
1 618 . 14 1 1 A 54 54 GLN CB C 54 26.545 27.776 -1.231 1
1 620 . 14 1 1 A 54 54 GLN N N 54 115.489 119.030 -3.541 1
1 622 . 14 1 1 A 55 55 LEU H H 55 7.139 7.391 -0.252 1
1 623 . 14 1 1 A 55 55 LEU HA H 55 4.750 5.052 -0.302 1
1 629 . 14 1 1 A 55 55 LEU C C 55 173.475 175.143 -1.668 1
1 630 . 14 1 1 A 55 55 LEU CA C 55 53.698 52.655 1.043 1
1 631 . 14 1 1 A 55 55 LEU CB C 55 47.859 46.221 1.638 1
1 633 . 14 1 1 A 55 55 LEU N N 55 116.422 114.817 1.605 1
1 634 . 14 1 1 A 56 56 ILE H H 56 8.223 8.422 -0.199 1
1 635 . 14 1 1 A 56 56 ILE HA H 56 4.540 5.319 -0.779 1
1 643 . 14 1 1 A 56 56 ILE C C 56 173.938 174.619 -0.681 1
1 644 . 14 1 1 A 56 56 ILE CA C 56 61.020 59.589 1.431 1
1 645 . 14 1 1 A 56 56 ILE CB C 56 39.403 41.106 -1.703 1
1 648 . 14 1 1 A 56 56 ILE N N 56 122.792 119.516 3.276 1
1 649 . 14 1 1 A 57 57 CYS H H 57 8.995 9.070 -0.075 1
1 650 . 14 1 1 A 57 57 CYS HA H 57 5.036 5.198 -0.162 1
1 653 . 14 1 1 A 57 57 CYS C C 57 170.483 173.249 -2.766 1
1 654 . 14 1 1 A 57 57 CYS CA C 57 56.484 57.827 -1.343 1
1 655 . 14 1 1 A 57 57 CYS CB C 57 30.545 31.867 -1.322 1
1 656 . 14 1 1 A 57 57 CYS N N 57 121.575 124.540 -2.965 1
1 657 . 14 1 1 A 58 58 LEU H H 58 9.076 8.964 0.112 1
1 658 . 14 1 1 A 58 58 LEU HA H 58 5.472 5.585 -0.113 1
1 668 . 14 1 1 A 58 58 LEU C C 58 174.009 176.151 -2.142 1
1 669 . 14 1 1 A 58 58 LEU CA C 58 52.851 53.772 -0.921 1
1 670 . 14 1 1 A 58 58 LEU CB C 58 42.177 43.430 -1.253 1
1 674 . 14 1 1 A 58 58 LEU N N 58 121.895 124.298 -2.403 1
1 675 . 14 1 1 A 59 59 VAL H H 59 8.966 8.769 0.197 1
1 676 . 14 1 1 A 59 59 VAL HA H 59 5.488 4.919 0.569 1
1 681 . 14 1 1 A 59 59 VAL C C 59 176.034 175.178 0.856 1
1 682 . 14 1 1 A 59 59 VAL CA C 59 59.820 60.857 -1.037 1
1 683 . 14 1 1 A 59 59 VAL CB C 59 34.786 34.403 0.383 1
1 685 . 14 1 1 A 59 59 VAL N N 59 121.702 124.940 -3.238 1
1 686 . 14 1 1 A 60 60 GLY H H 60 9.258 9.042 0.216 1
1 687 . 14 1 1 A 60 60 GLY HA2 H 60 4.673 4.374 0.299 1
1 688 . 14 1 1 A 60 60 GLY HA3 H 60 4.804 4.525 0.279 1
1 689 . 14 1 1 A 60 60 GLY C C 60 169.831 172.753 -2.922 1
1 690 . 14 1 1 A 60 60 GLY CA C 60 46.399 43.889 2.510 1
1 691 . 14 1 1 A 60 60 GLY N N 60 114.126 115.807 -1.681 1
1 692 . 14 1 1 A 61 61 THR H H 61 8.834 8.436 0.398 1
1 693 . 14 1 1 A 61 61 THR HA H 61 4.418 4.888 -0.470 1
1 698 . 14 1 1 A 61 61 THR C C 61 171.985 175.077 -3.092 1
1 699 . 14 1 1 A 61 61 THR CA C 61 60.634 60.481 0.153 1
1 700 . 14 1 1 A 61 61 THR CB C 61 70.983 70.180 0.803 1
1 702 . 14 1 1 A 61 61 THR N N 61 114.856 111.371 3.485 1
1 703 . 14 1 1 A 62 62 GLU H H 62 8.502 8.401 0.101 1
1 704 . 14 1 1 A 62 62 GLU HA H 62 2.867 3.720 -0.853 1
1 709 . 14 1 1 A 62 62 GLU C C 62 174.650 176.380 -1.730 1
1 710 . 14 1 1 A 62 62 GLU CA C 62 58.785 58.228 0.557 1
1 711 . 14 1 1 A 62 62 GLU CB C 62 28.981 28.784 0.197 1
1 713 . 14 1 1 A 62 62 GLU N N 62 129.915 122.111 7.804 1
1 714 . 14 1 1 A 63 63 ILE H H 63 6.928 7.831 -0.903 1
1 715 . 14 1 1 A 63 63 ILE HA H 63 4.038 4.456 -0.418 1
1 725 . 14 1 1 A 63 63 ILE C C 63 173.482 174.975 -1.493 1
1 726 . 14 1 1 A 63 63 ILE CA C 63 58.664 60.039 -1.375 1
1 727 . 14 1 1 A 63 63 ILE CB C 63 40.009 41.351 -1.342 1
1 731 . 14 1 1 A 63 63 ILE N N 63 117.075 118.483 -1.408 1
1 732 . 14 1 1 A 64 64 GLU H H 64 8.585 8.206 0.379 1
1 733 . 14 1 1 A 64 64 GLU HA H 64 3.427 3.994 -0.567 1
1 738 . 14 1 1 A 64 64 GLU C C 64 175.186 176.779 -1.593 1
1 739 . 14 1 1 A 64 64 GLU CA C 64 58.703 57.345 1.358 1
1 740 . 14 1 1 A 64 64 GLU CB C 64 28.999 28.757 0.242 1
1 742 . 14 1 1 A 64 64 GLU N N 64 126.422 127.245 -0.823 1
1 743 . 14 1 1 A 65 65 GLY H H 65 8.754 8.863 -0.109 1
1 744 . 14 1 1 A 65 65 GLY HA2 H 65 3.631 3.923 -0.292 1
1 745 . 14 1 1 A 65 65 GLY HA3 H 65 4.287 3.939 0.348 1
1 746 . 14 1 1 A 65 65 GLY C C 65 174.005 173.821 0.184 1
1 747 . 14 1 1 A 65 65 GLY CA C 65 44.954 45.040 -0.086 1
1 748 . 14 1 1 A 65 65 GLY N N 65 114.614 113.281 1.333 1
1 749 . 14 1 1 A 66 66 GLU H H 66 7.760 7.955 -0.195 1
1 750 . 14 1 1 A 66 66 GLU HA H 66 4.462 4.387 0.075 1
1 754 . 14 1 1 A 66 66 GLU C C 66 175.255 177.105 -1.850 1
1 755 . 14 1 1 A 66 66 GLU CA C 66 55.582 55.560 0.022 1
1 756 . 14 1 1 A 66 66 GLU CB C 66 30.654 29.678 0.976 1
1 758 . 14 1 1 A 66 66 GLU N N 66 119.292 121.120 -1.828 1
1 759 . 14 1 1 A 67 67 GLY H H 67 8.262 8.082 0.180 1
1 760 . 14 1 1 A 67 67 GLY HA2 H 67 3.875 3.747 0.128 1
1 761 . 14 1 1 A 67 67 GLY HA3 H 67 4.088 3.812 0.276 1
1 762 . 14 1 1 A 67 67 GLY C C 67 172.197 173.853 -1.656 1
1 763 . 14 1 1 A 67 67 GLY CA C 67 44.845 46.758 -1.913 1
1 764 . 14 1 1 A 67 67 GLY N N 67 106.161 108.858 -2.697 1
1 765 . 14 1 1 A 68 68 LEU H H 68 8.142 8.272 -0.130 1
1 766 . 14 1 1 A 68 68 LEU HA H 68 4.491 4.685 -0.194 1
1 775 . 14 1 1 A 68 68 LEU C C 68 176.194 175.109 1.085 1
1 776 . 14 1 1 A 68 68 LEU CA C 68 55.123 53.765 1.358 1
1 777 . 14 1 1 A 68 68 LEU CB C 68 44.527 42.849 1.678 1
1 780 . 14 1 1 A 68 68 LEU N N 68 120.269 126.295 -6.026 1
1 781 . 14 1 1 A 69 69 GLN H H 69 9.253 8.075 1.178 1
1 782 . 14 1 1 A 69 69 GLN HA H 69 4.770 4.886 -0.116 1
1 788 . 14 1 1 A 69 69 GLN C C 69 173.607 174.420 -0.813 1
1 789 . 14 1 1 A 69 69 GLN CA C 69 54.736 54.855 -0.119 1
1 790 . 14 1 1 A 69 69 GLN CB C 69 33.782 31.589 2.193 1
1 792 . 14 1 1 A 69 69 GLN N N 69 119.336 120.671 -1.335 1
1 794 . 14 1 1 A 70 70 THR H H 70 8.803 8.958 -0.155 1
1 795 . 14 1 1 A 70 70 THR HA H 70 5.033 4.974 0.059 1
1 800 . 14 1 1 A 70 70 THR C C 70 172.596 173.824 -1.228 1
1 801 . 14 1 1 A 70 70 THR CA C 70 62.768 61.901 0.867 1
1 802 . 14 1 1 A 70 70 THR CB C 70 69.990 70.317 -0.327 1
1 804 . 14 1 1 A 70 70 THR N N 70 118.372 119.937 -1.565 1
1 805 . 14 1 1 A 71 71 VAL H H 71 9.882 9.328 0.554 1
1 806 . 14 1 1 A 71 71 VAL HA H 71 5.239 5.456 -0.217 1
1 811 . 14 1 1 A 71 71 VAL C C 71 174.015 174.879 -0.864 1
1 812 . 14 1 1 A 71 71 VAL CA C 71 60.577 60.558 0.019 1
1 813 . 14 1 1 A 71 71 VAL CB C 71 34.149 33.968 0.181 1
1 815 . 14 1 1 A 71 71 VAL N N 71 129.063 121.749 7.314 1
1 816 . 14 1 1 A 72 72 VAL H H 72 9.491 8.714 0.777 1
1 817 . 14 1 1 A 72 72 VAL HA H 72 4.672 4.764 -0.092 1
1 825 . 14 1 1 A 72 72 VAL CA C 72 59.568 58.147 1.421 1
1 826 . 14 1 1 A 72 72 VAL CB C 72 34.057 34.537 -0.480 1
1 829 . 14 1 1 A 72 72 VAL N N 72 128.521 125.916 2.605 1
1 830 . 14 1 1 A 73 73 PRO HA H 73 5.368 4.433 0.935 1
1 836 . 14 1 1 A 73 73 PRO C C 73 175.079 175.860 -0.781 1
1 837 . 14 1 1 A 73 73 PRO CA C 73 61.324 63.142 -1.818 1
1 838 . 14 1 1 A 73 73 PRO CB C 73 33.089 31.929 1.160 1
1 841 . 14 1 1 A 74 74 THR H H 74 9.103 8.803 0.300 1
1 842 . 14 1 1 A 74 74 THR HA H 74 5.191 4.850 0.341 1
1 847 . 14 1 1 A 74 74 THR CA C 74 57.986 59.171 -1.185 1
1 848 . 14 1 1 A 74 74 THR CB C 74 72.212 71.933 0.279 1
1 850 . 14 1 1 A 74 74 THR N N 74 118.075 118.864 -0.789 1
1 851 . 14 1 1 A 75 75 PRO HA H 75 5.015 4.750 0.265 1
1 858 . 14 1 1 A 75 75 PRO C C 75 178.704 177.304 1.400 1
1 859 . 14 1 1 A 75 75 PRO CA C 75 63.038 62.122 0.916 1
1 860 . 14 1 1 A 75 75 PRO CB C 75 32.529 33.053 -0.524 1
1 863 . 14 1 1 A 76 76 ILE H H 76 8.221 8.105 0.116 1
1 864 . 14 1 1 A 76 76 ILE HA H 76 4.218 3.821 0.397 1
1 873 . 14 1 1 A 76 76 ILE C C 76 172.375 177.820 -5.445 1
1 874 . 14 1 1 A 76 76 ILE CA C 76 63.509 63.888 -0.379 1
1 875 . 14 1 1 A 76 76 ILE CB C 76 39.322 37.759 1.563 1
1 879 . 14 1 1 A 76 76 ILE N N 76 122.273 122.398 -0.125 1
1 880 . 14 1 1 A 77 77 THR H H 77 6.984 7.613 -0.629 1
1 881 . 14 1 1 A 77 77 THR HA H 77 4.227 4.301 -0.074 1
1 886 . 14 1 1 A 77 77 THR C C 77 173.531 174.199 -0.668 1
1 887 . 14 1 1 A 77 77 THR CA C 77 61.435 63.975 -2.540 1
1 888 . 14 1 1 A 77 77 THR CB C 77 68.944 69.510 -0.566 1
1 890 . 14 1 1 A 77 77 THR N N 77 105.803 115.798 -9.995 1
1 891 . 14 1 1 A 78 78 ALA H H 78 7.647 7.372 0.275 1
1 892 . 14 1 1 A 78 78 ALA HA H 78 4.757 4.466 0.291 1
1 896 . 14 1 1 A 78 78 ALA C C 78 173.520 176.433 -2.913 1
1 897 . 14 1 1 A 78 78 ALA CA C 78 51.164 51.741 -0.577 1
1 898 . 14 1 1 A 78 78 ALA CB C 78 20.011 20.902 -0.891 1
1 899 . 14 1 1 A 78 78 ALA N N 78 126.635 123.518 3.117 1
1 900 . 14 1 1 A 79 79 SER H H 79 7.884 8.835 -0.951 1
1 901 . 14 1 1 A 79 79 SER HA H 79 4.386 5.201 -0.815 1
1 903 . 14 1 1 A 79 79 SER C C 79 176.077 172.416 3.661 1
1 904 . 14 1 1 A 79 79 SER CA C 79 57.465 56.454 1.011 1
1 905 . 14 1 1 A 79 79 SER CB C 79 65.285 66.236 -0.951 1
1 906 . 14 1 1 A 79 79 SER N N 79 115.272 111.797 3.475 1
1 907 . 14 1 1 A 80 80 LEU H H 80 7.700 8.933 -1.233 1
1 908 . 14 1 1 A 80 80 LEU HA H 80 4.912 5.322 -0.410 1
1 915 . 14 1 1 A 80 80 LEU C C 80 173.927 174.830 -0.903 1
1 916 . 14 1 1 A 80 80 LEU CA C 80 53.829 53.552 0.277 1
1 917 . 14 1 1 A 80 80 LEU CB C 80 45.990 46.213 -0.223 1
1 920 . 14 1 1 A 80 80 LEU N N 80 121.507 125.061 -3.554 1
1 921 . 14 1 1 A 81 81 SER H H 81 7.885 8.752 -0.867 1
1 922 . 14 1 1 A 81 81 SER HA H 81 5.269 4.932 0.337 1
1 925 . 14 1 1 A 81 81 SER C C 81 175.756 174.420 1.336 1
1 926 . 14 1 1 A 81 81 SER CA C 81 55.507 57.750 -2.243 1
1 927 . 14 1 1 A 81 81 SER CB C 81 65.966 67.109 -1.143 1
1 928 . 14 1 1 A 81 81 SER N N 81 118.323 117.987 0.336 1
1 929 . 14 1 1 A 82 82 HIS H H 82 8.935 8.910 0.025 1
1 930 . 14 1 1 A 82 82 HIS HA H 82 4.407 4.435 -0.028 1
1 932 . 14 1 1 A 82 82 HIS C C 82 176.550 177.147 -0.597 1
1 933 . 14 1 1 A 82 82 HIS CA C 82 60.960 58.810 2.150 1
1 934 . 14 1 1 A 82 82 HIS CB C 82 30.755 29.203 1.552 1
1 935 . 14 1 1 A 82 82 HIS N N 82 124.042 121.680 2.362 1
1 936 . 14 1 1 A 83 83 ASN H H 83 8.435 8.139 0.296 1
1 937 . 14 1 1 A 83 83 ASN HA H 83 4.439 4.265 0.174 1
1 941 . 14 1 1 A 83 83 ASN C C 83 174.769 177.514 -2.745 1
1 942 . 14 1 1 A 83 83 ASN CA C 83 56.575 56.329 0.246 1
1 943 . 14 1 1 A 83 83 ASN CB C 83 38.731 38.556 0.175 1
1 944 . 14 1 1 A 83 83 ASN N N 83 118.543 119.880 -1.337 1
1 946 . 14 1 1 A 84 84 ARG H H 84 7.716 7.933 -0.217 1
1 947 . 14 1 1 A 84 84 ARG HA H 84 4.183 4.150 0.033 1
1 953 . 14 1 1 A 84 84 ARG C C 84 177.399 178.817 -1.418 1
1 954 . 14 1 1 A 84 84 ARG CA C 84 59.045 58.547 0.498 1
1 955 . 14 1 1 A 84 84 ARG CB C 84 29.992 29.907 0.085 1
1 957 . 14 1 1 A 84 84 ARG N N 84 121.312 119.973 1.339 1
1 958 . 14 1 1 A 85 85 ILE H H 85 8.354 7.885 0.469 1
1 959 . 14 1 1 A 85 85 ILE HA H 85 3.650 3.824 -0.174 1
1 967 . 14 1 1 A 85 85 ILE C C 85 176.098 177.864 -1.766 1
1 968 . 14 1 1 A 85 85 ILE CA C 85 66.704 63.866 2.838 1
1 969 . 14 1 1 A 85 85 ILE CB C 85 38.017 37.433 0.584 1
1 972 . 14 1 1 A 85 85 ILE N N 85 119.321 119.120 0.201 1
1 973 . 14 1 1 A 86 86 ARG H H 86 7.690 8.100 -0.410 1
1 974 . 14 1 1 A 86 86 ARG HA H 86 3.704 3.943 -0.239 1
1 981 . 14 1 1 A 86 86 ARG C C 86 177.524 178.688 -1.164 1
1 982 . 14 1 1 A 86 86 ARG CA C 86 59.881 59.636 0.245 1
1 983 . 14 1 1 A 86 86 ARG CB C 86 29.248 29.735 -0.487 1
1 986 . 14 1 1 A 86 86 ARG N N 86 118.362 121.708 -3.346 1
1 987 . 14 1 1 A 87 87 GLU H H 87 7.884 7.757 0.127 1
1 988 . 14 1 1 A 87 87 GLU HA H 87 4.064 4.041 0.023 1
1 993 . 14 1 1 A 87 87 GLU C C 87 178.785 179.224 -0.439 1
1 994 . 14 1 1 A 87 87 GLU CA C 87 58.999 58.859 0.140 1
1 995 . 14 1 1 A 87 87 GLU CB C 87 29.872 29.675 0.197 1
1 997 . 14 1 1 A 87 87 GLU N N 87 118.124 119.011 -0.887 1
1 998 . 14 1 1 A 88 88 ILE H H 88 8.715 8.010 0.705 1
1 999 . 14 1 1 A 88 88 ILE HA H 88 3.305 3.536 -0.231 1
1 1009 . 14 1 1 A 88 88 ILE C C 88 177.261 177.697 -0.436 1
1 1010 . 14 1 1 A 88 88 ILE CA C 88 65.822 65.346 0.476 1
1 1011 . 14 1 1 A 88 88 ILE CB C 88 37.370 37.788 -0.418 1
1 1015 . 14 1 1 A 88 88 ILE N N 88 122.929 121.025 1.904 1
1 1016 . 14 1 1 A 89 89 LEU H H 89 8.486 8.664 -0.178 1
1 1017 . 14 1 1 A 89 89 LEU HA H 89 3.932 3.865 0.067 1
1 1023 . 14 1 1 A 89 89 LEU C C 89 177.919 179.348 -1.429 1
1 1024 . 14 1 1 A 89 89 LEU CA C 89 59.060 57.766 1.294 1
1 1025 . 14 1 1 A 89 89 LEU CB C 89 41.129 41.586 -0.457 1
1 1028 . 14 1 1 A 89 89 LEU N N 89 122.696 118.938 3.758 1
1 1029 . 14 1 1 A 90 90 LYS H H 90 7.790 7.811 -0.021 1
1 1030 . 14 1 1 A 90 90 LYS HA H 90 4.061 3.977 0.084 1
1 1035 . 14 1 1 A 90 90 LYS C C 90 178.432 178.521 -0.089 1
1 1036 . 14 1 1 A 90 90 LYS CA C 90 59.840 58.628 1.212 1
1 1037 . 14 1 1 A 90 90 LYS CB C 90 32.582 32.115 0.467 1
1 1039 . 14 1 1 A 90 90 LYS N N 90 118.640 121.120 -2.480 1
1 1040 . 14 1 1 A 91 91 ALA H H 91 8.113 7.750 0.363 1
1 1041 . 14 1 1 A 91 91 ALA HA H 91 4.151 4.079 0.072 1
1 1045 . 14 1 1 A 91 91 ALA C C 91 179.147 179.705 -0.558 1
1 1046 . 14 1 1 A 91 91 ALA CA C 91 54.942 55.347 -0.405 1
1 1047 . 14 1 1 A 91 91 ALA CB C 91 18.242 18.671 -0.429 1
1 1048 . 14 1 1 A 91 91 ALA N N 91 122.939 122.294 0.645 1
1 1049 . 14 1 1 A 92 92 SER H H 92 8.858 7.855 1.003 1
1 1050 . 14 1 1 A 92 92 SER HA H 92 4.898 4.373 0.525 1
1 1052 . 14 1 1 A 92 92 SER C C 92 172.440 177.173 -4.733 1
1 1053 . 14 1 1 A 92 92 SER CA C 92 61.913 60.708 1.205 1
1 1054 . 14 1 1 A 92 92 SER CB C 92 63.081 63.059 0.022 1
1 1055 . 14 1 1 A 92 92 SER N N 92 114.526 112.294 2.232 1
1 1056 . 14 1 1 A 93 93 ARG H H 93 7.704 7.603 0.101 1
1 1057 . 14 1 1 A 93 93 ARG HA H 93 4.162 4.099 0.063 1
1 1059 . 14 1 1 A 93 93 ARG C C 93 177.757 178.223 -0.466 1
1 1060 . 14 1 1 A 93 93 ARG CA C 93 59.544 58.699 0.845 1
1 1061 . 14 1 1 A 93 93 ARG CB C 93 30.343 29.802 0.541 1
1 1062 . 14 1 1 A 93 93 ARG N N 93 121.505 122.280 -0.775 1
1 1063 . 14 1 1 A 94 94 LYS H H 94 7.456 7.507 -0.051 1
1 1064 . 14 1 1 A 94 94 LYS HA H 94 4.174 4.320 -0.146 1
1 1071 . 14 1 1 A 94 94 LYS C C 94 178.861 178.881 -0.020 1
1 1072 . 14 1 1 A 94 94 LYS CA C 94 59.030 59.160 -0.130 1
1 1073 . 14 1 1 A 94 94 LYS CB C 94 32.239 32.427 -0.188 1
1 1077 . 14 1 1 A 94 94 LYS N N 94 119.072 119.680 -0.608 1
1 1078 . 14 1 1 A 95 95 LEU H H 95 8.148 7.798 0.350 1
1 1079 . 14 1 1 A 95 95 LEU HA H 95 4.129 4.047 0.082 1
1 1088 . 14 1 1 A 95 95 LEU C C 95 177.274 178.593 -1.319 1
1 1089 . 14 1 1 A 95 95 LEU CA C 95 57.136 57.818 -0.682 1
1 1090 . 14 1 1 A 95 95 LEU CB C 95 41.908 42.176 -0.268 1
1 1093 . 14 1 1 A 95 95 LEU N N 95 119.717 121.172 -1.455 1
1 1094 . 14 1 1 A 96 96 GLN H H 96 7.807 7.861 -0.054 1
1 1095 . 14 1 1 A 96 96 GLN HA H 96 4.242 4.357 -0.115 1
1 1102 . 14 1 1 A 96 96 GLN C C 96 175.371 176.144 -0.773 1
1 1103 . 14 1 1 A 96 96 GLN CA C 96 56.397 55.716 0.681 1
1 1104 . 14 1 1 A 96 96 GLN CB C 96 29.123 29.213 -0.090 1
1 1106 . 14 1 1 A 96 96 GLN N N 96 114.581 115.446 -0.865 1
1 1108 . 14 1 1 A 97 97 GLY H H 97 7.802 8.668 -0.866 1
1 1109 . 14 1 1 A 97 97 GLY HA2 H 97 3.839 3.931 -0.092 1
1 1110 . 14 1 1 A 97 97 GLY HA3 H 97 4.096 3.932 0.164 1
1 1111 . 14 1 1 A 97 97 GLY C C 97 172.636 173.391 -0.755 1
1 1112 . 14 1 1 A 97 97 GLY CA C 97 46.372 46.038 0.334 1
1 1113 . 14 1 1 A 97 97 GLY N N 97 106.959 108.051 -1.092 1
1 1114 . 14 1 1 A 98 98 ASP H H 98 8.156 8.286 -0.130 1
1 1115 . 14 1 1 A 98 98 ASP HA H 98 4.754 5.143 -0.389 1
1 1118 . 14 1 1 A 98 98 ASP CA C 98 52.882 50.837 2.045 1
1 1119 . 14 1 1 A 98 98 ASP CB C 98 41.603 42.956 -1.353 1
1 1120 . 14 1 1 A 98 98 ASP N N 98 118.447 119.769 -1.322 1
1 1121 . 14 1 1 A 99 99 PRO HA H 99 4.470 4.513 -0.043 1
1 1126 . 14 1 1 A 99 99 PRO C C 99 175.500 176.393 -0.893 1
1 1127 . 14 1 1 A 99 99 PRO CA C 99 63.601 64.503 -0.902 1
1 1128 . 14 1 1 A 99 99 PRO CB C 99 32.423 32.103 0.320 1
1 1130 . 14 1 1 A 100 100 ASP H H 100 8.527 7.808 0.719 1
1 1131 . 14 1 1 A 100 100 ASP HA H 100 4.778 4.898 -0.120 1
1 1134 . 14 1 1 A 100 100 ASP C C 100 174.931 174.876 0.055 1
1 1135 . 14 1 1 A 100 100 ASP CA C 100 53.915 53.295 0.620 1
1 1136 . 14 1 1 A 100 100 ASP CB C 100 40.665 41.902 -1.237 1
1 1137 . 14 1 1 A 100 100 ASP N N 100 119.340 117.120 2.220 1
1 1138 . 14 1 1 A 101 101 LEU H H 101 7.379 7.586 -0.207 1
1 1139 . 14 1 1 A 101 101 LEU HA H 101 4.682 4.685 -0.003 1
1 1148 . 14 1 1 A 101 101 LEU CA C 101 52.956 52.576 0.380 1
1 1149 . 14 1 1 A 101 101 LEU CB C 101 43.393 43.988 -0.595 1
1 1152 . 14 1 1 A 101 101 LEU N N 101 122.107 122.370 -0.263 1
1 1153 . 14 1 1 A 102 102 PRO HA H 102 4.487 4.600 -0.113 1
1 1158 . 14 1 1 A 102 102 PRO C C 102 175.697 176.140 -0.443 1
1 1159 . 14 1 1 A 102 102 PRO CA C 102 63.113 63.053 0.060 1
1 1160 . 14 1 1 A 102 102 PRO CB C 102 32.138 32.073 0.065 1
1 1163 . 14 1 1 A 103 103 MET H H 103 9.011 8.628 0.383 1
1 1164 . 14 1 1 A 103 103 MET HA H 103 4.769 4.840 -0.071 1
1 1171 . 14 1 1 A 103 103 MET C C 103 174.080 174.873 -0.793 1
1 1172 . 14 1 1 A 103 103 MET CA C 103 54.737 53.345 1.392 1
1 1173 . 14 1 1 A 103 103 MET CB C 103 34.857 34.825 0.032 1
1 1176 . 14 1 1 A 103 103 MET N N 103 123.334 122.036 1.298 1
1 1177 . 14 1 1 A 104 104 SER H H 104 8.239 8.885 -0.646 1
1 1178 . 14 1 1 A 104 104 SER HA H 104 5.079 5.593 -0.514 1
1 1181 . 14 1 1 A 104 104 SER C C 104 171.795 173.996 -2.201 1
1 1182 . 14 1 1 A 104 104 SER CA C 104 57.641 56.099 1.542 1
1 1183 . 14 1 1 A 104 104 SER CB C 104 66.282 66.009 0.273 1
1 1184 . 14 1 1 A 104 104 SER N N 104 114.434 114.347 0.087 1
1 1185 . 14 1 1 A 105 105 PHE H H 105 9.003 8.220 0.783 1
1 1186 . 14 1 1 A 105 105 PHE HA H 105 5.209 5.373 -0.164 1
1 1193 . 14 1 1 A 105 105 PHE C C 105 170.688 172.264 -1.576 1
1 1194 . 14 1 1 A 105 105 PHE CA C 105 56.917 55.930 0.987 1
1 1195 . 14 1 1 A 105 105 PHE CB C 105 41.350 42.004 -0.654 1
1 1196 . 14 1 1 A 105 105 PHE N N 105 116.224 118.425 -2.201 1
1 1197 . 14 1 1 A 106 106 THR H H 106 9.074 8.787 0.287 1
1 1198 . 14 1 1 A 106 106 THR HA H 106 4.664 4.882 -0.218 1
1 1203 . 14 1 1 A 106 106 THR C C 106 171.767 174.539 -2.772 1
1 1204 . 14 1 1 A 106 106 THR CA C 106 62.162 61.732 0.430 1
1 1205 . 14 1 1 A 106 106 THR CB C 106 70.072 69.869 0.203 1
1 1207 . 14 1 1 A 106 106 THR N N 106 117.469 116.376 1.093 1
1 1208 . 14 1 1 A 107 107 LEU H H 107 9.804 9.097 0.707 1
1 1209 . 14 1 1 A 107 107 LEU HA H 107 4.750 4.720 0.030 1
1 1219 . 14 1 1 A 107 107 LEU C C 107 172.742 176.110 -3.368 1
1 1220 . 14 1 1 A 107 107 LEU CA C 107 54.151 54.806 -0.655 1
1 1221 . 14 1 1 A 107 107 LEU CB C 107 44.486 42.599 1.887 1
1 1224 . 14 1 1 A 107 107 LEU N N 107 133.400 128.332 5.068 1
1 1225 . 14 1 1 A 108 108 ALA H H 108 8.435 8.780 -0.345 1
1 1226 . 14 1 1 A 108 108 ALA HA H 108 4.683 4.524 0.159 1
1 1230 . 14 1 1 A 108 108 ALA C C 108 173.052 175.558 -2.506 1
1 1231 . 14 1 1 A 108 108 ALA CA C 108 49.308 50.612 -1.304 1
1 1232 . 14 1 1 A 108 108 ALA CB C 108 22.120 20.058 2.062 1
1 1233 . 14 1 1 A 108 108 ALA N N 108 131.422 127.124 4.298 1
1 1234 . 14 1 1 A 109 109 ILE H H 109 8.909 9.196 -0.287 1
1 1235 . 14 1 1 A 109 109 ILE HA H 109 4.063 4.941 -0.878 1
1 1245 . 14 1 1 A 109 109 ILE CA C 109 60.982 60.205 0.777 1
1 1246 . 14 1 1 A 109 109 ILE CB C 109 39.074 37.829 1.245 1
1 1250 . 14 1 1 A 109 109 ILE N N 109 124.415 123.905 0.510 1
1 1251 . 14 1 1 A 110 110 VAL H H 110 8.706 9.102 -0.396 1
1 1252 . 14 1 1 A 110 110 VAL HA H 110 4.324 5.169 -0.845 1
1 1260 . 14 1 1 A 110 110 VAL C C 110 175.700 174.333 1.367 1
1 1261 . 14 1 1 A 110 110 VAL CA C 110 62.316 59.144 3.172 1
1 1262 . 14 1 1 A 110 110 VAL CB C 110 31.876 34.654 -2.778 1
1 1264 . 14 1 1 A 110 110 VAL N N 110 127.457 122.075 5.382 1
1 1265 . 14 1 1 A 111 111 GLU H H 111 9.024 8.975 0.049 1
1 1266 . 14 1 1 A 111 111 GLU HA H 111 4.403 4.385 0.018 1
1 1269 . 14 1 1 A 111 111 GLU C C 111 175.987 177.743 -1.756 1
1 1270 . 14 1 1 A 111 111 GLU CA C 111 56.842 56.421 0.421 1
1 1271 . 14 1 1 A 111 111 GLU CB C 111 31.044 31.774 -0.730 1
1 1272 . 14 1 1 A 111 111 GLU N N 111 129.768 125.566 4.202 1
1 1273 . 14 1 1 A 112 112 SER H H 112 9.143 8.898 0.245 1
1 1274 . 14 1 1 A 112 112 SER HA H 112 4.394 4.257 0.137 1
1 1276 . 14 1 1 A 112 112 SER C C 112 173.187 175.825 -2.638 1
1 1277 . 14 1 1 A 112 112 SER CA C 112 60.180 60.742 -0.562 1
1 1278 . 14 1 1 A 112 112 SER CB C 112 63.415 62.909 0.506 1
1 1279 . 14 1 1 A 112 112 SER N N 112 115.956 121.740 -5.784 1
1 1280 . 14 1 1 A 113 113 ASP H H 113 8.133 8.029 0.104 1
1 1281 . 14 1 1 A 113 113 ASP HA H 113 4.573 4.574 -0.001 1
1 1284 . 14 1 1 A 113 113 ASP C C 113 175.430 176.963 -1.533 1
1 1285 . 14 1 1 A 113 113 ASP CA C 113 54.115 56.427 -2.312 1
1 1286 . 14 1 1 A 113 113 ASP CB C 113 40.011 42.100 -2.089 1
1 1287 . 14 1 1 A 113 113 ASP N N 113 118.343 121.909 -3.566 1
1 1288 . 14 1 1 A 114 114 SER H H 114 8.034 8.057 -0.023 1
1 1289 . 14 1 1 A 114 114 SER HA H 114 4.057 4.676 -0.619 1
1 1291 . 14 1 1 A 114 114 SER C C 114 172.209 173.780 -1.571 1
1 1292 . 14 1 1 A 114 114 SER CA C 114 60.179 58.484 1.695 1
1 1293 . 14 1 1 A 114 114 SER CB C 114 62.702 65.749 -3.047 1
1 1294 . 14 1 1 A 114 114 SER N N 114 109.836 111.584 -1.748 1
1 1295 . 14 1 1 A 115 115 THR H H 115 7.711 7.345 0.366 1
1 1296 . 14 1 1 A 115 115 THR HA H 115 4.250 4.146 0.104 1
1 1300 . 14 1 1 A 115 115 THR C C 115 171.500 173.876 -2.376 1
1 1301 . 14 1 1 A 115 115 THR CA C 115 63.547 64.170 -0.623 1
1 1302 . 14 1 1 A 115 115 THR CB C 115 69.595 69.141 0.454 1
1 1303 . 14 1 1 A 115 115 THR N N 115 117.407 115.671 1.736 1
1 1304 . 14 1 1 A 116 116 ILE H H 116 8.219 8.864 -0.645 1
1 1305 . 14 1 1 A 116 116 ILE HA H 116 4.769 4.763 0.006 1
1 1315 . 14 1 1 A 116 116 ILE C C 116 174.434 174.772 -0.338 1
1 1316 . 14 1 1 A 116 116 ILE CA C 116 60.306 59.628 0.678 1
1 1317 . 14 1 1 A 116 116 ILE CB C 116 40.686 39.082 1.604 1
1 1321 . 14 1 1 A 116 116 ILE N N 116 125.480 128.668 -3.188 1
1 1322 . 14 1 1 A 117 117 VAL H H 117 8.695 9.525 -0.830 1
1 1323 . 14 1 1 A 117 117 VAL HA H 117 4.315 4.758 -0.443 1
1 1328 . 14 1 1 A 117 117 VAL C C 117 172.243 174.585 -2.342 1
1 1329 . 14 1 1 A 117 117 VAL CA C 117 60.621 60.840 -0.219 1
1 1330 . 14 1 1 A 117 117 VAL CB C 117 34.558 33.842 0.716 1
1 1332 . 14 1 1 A 117 117 VAL N N 117 127.887 127.226 0.661 1
1 1333 . 14 1 1 A 118 118 TYR H H 118 8.270 8.850 -0.580 1
1 1334 . 14 1 1 A 118 118 TYR HA H 118 5.327 5.315 0.012 1
1 1342 . 14 1 1 A 118 118 TYR C C 118 174.250 174.759 -0.509 1
1 1343 . 14 1 1 A 118 118 TYR CA C 118 57.283 57.032 0.251 1
1 1344 . 14 1 1 A 118 118 TYR CB C 118 39.262 39.630 -0.368 1
1 1345 . 14 1 1 A 118 118 TYR N N 118 124.822 126.913 -2.091 1
1 1346 . 14 1 1 A 119 119 TYR H H 119 9.207 9.003 0.204 1
1 1347 . 14 1 1 A 119 119 TYR HA H 119 4.821 5.314 -0.493 1
1 1354 . 14 1 1 A 119 119 TYR C C 119 171.994 173.518 -1.524 1
1 1355 . 14 1 1 A 119 119 TYR CA C 119 58.116 56.628 1.488 1
1 1356 . 14 1 1 A 119 119 TYR CB C 119 43.544 42.234 1.310 1
1 1357 . 14 1 1 A 119 119 TYR N N 119 125.153 123.897 1.256 1
1 1358 . 14 1 1 A 120 120 LYS H H 120 7.700 8.280 -0.580 1
1 1359 . 14 1 1 A 120 120 LYS HA H 120 4.558 4.510 0.048 1
1 1366 . 14 1 1 A 120 120 LYS C C 120 172.017 174.771 -2.754 1
1 1367 . 14 1 1 A 120 120 LYS CA C 120 57.217 55.822 1.395 1
1 1368 . 14 1 1 A 120 120 LYS CB C 120 33.914 33.311 0.603 1
1 1372 . 14 1 1 A 120 120 LYS N N 120 129.442 127.770 1.672 1
1 1373 . 14 1 1 A 121 121 LEU H H 121 8.112 8.322 -0.210 1
1 1374 . 14 1 1 A 121 121 LEU HA H 121 5.323 5.165 0.158 1
1 1384 . 14 1 1 A 121 121 LEU C C 121 175.733 174.478 1.255 1
1 1385 . 14 1 1 A 121 121 LEU CA C 121 52.716 53.061 -0.345 1
1 1386 . 14 1 1 A 121 121 LEU CB C 121 44.098 45.400 -1.302 1
1 1389 . 14 1 1 A 121 121 LEU N N 121 123.403 127.937 -4.534 1
1 1390 . 14 1 1 A 122 122 THR H H 122 8.338 8.924 -0.586 1
1 1391 . 14 1 1 A 122 122 THR HA H 122 5.097 4.619 0.478 1
1 1396 . 14 1 1 A 122 122 THR C C 122 173.221 173.819 -0.598 1
1 1397 . 14 1 1 A 122 122 THR CA C 122 60.306 61.182 -0.876 1
1 1398 . 14 1 1 A 122 122 THR CB C 122 72.473 71.308 1.165 1
1 1400 . 14 1 1 A 122 122 THR N N 122 109.081 121.133 -12.052 1
1 7 . 15 1 1 A 2 2 GLU H H 2 8.994 8.214 0.780 1
1 8 . 15 1 1 A 2 2 GLU HA H 2 4.278 4.680 -0.402 1
1 13 . 15 1 1 A 2 2 GLU C C 2 175.315 175.747 -0.432 1
1 14 . 15 1 1 A 2 2 GLU CA C 2 57.318 58.593 -1.275 1
1 15 . 15 1 1 A 2 2 GLU CB C 2 29.221 28.557 0.664 1
1 17 . 15 1 1 A 2 2 GLU N N 2 122.259 118.285 3.974 1
1 18 . 15 1 1 A 3 3 ASP H H 3 8.048 9.114 -1.066 1
1 19 . 15 1 1 A 3 3 ASP HA H 3 4.580 4.698 -0.118 1
1 21 . 15 1 1 A 3 3 ASP C C 3 175.636 176.511 -0.875 1
1 22 . 15 1 1 A 3 3 ASP CA C 3 54.579 56.268 -1.689 1
1 23 . 15 1 1 A 3 3 ASP CB C 3 40.984 39.848 1.136 1
1 24 . 15 1 1 A 3 3 ASP N N 3 119.830 123.035 -3.205 1
1 25 . 15 1 1 A 4 4 ALA H H 4 8.090 8.562 -0.472 1
1 26 . 15 1 1 A 4 4 ALA HA H 4 4.216 4.165 0.051 1
1 30 . 15 1 1 A 4 4 ALA C C 4 177.157 177.331 -0.174 1
1 31 . 15 1 1 A 4 4 ALA CA C 4 53.620 52.747 0.873 1
1 32 . 15 1 1 A 4 4 ALA CB C 4 18.728 17.791 0.937 1
1 33 . 15 1 1 A 4 4 ALA N N 4 123.957 120.699 3.258 1
1 34 . 15 1 1 A 5 5 TRP H H 5 7.941 7.621 0.320 1
1 35 . 15 1 1 A 5 5 TRP HA H 5 4.559 4.424 0.135 1
1 39 . 15 1 1 A 5 5 TRP C C 5 176.072 177.517 -1.445 1
1 40 . 15 1 1 A 5 5 TRP CA C 5 57.744 59.840 -2.096 1
1 41 . 15 1 1 A 5 5 TRP CB C 5 28.906 30.301 -1.395 1
1 42 . 15 1 1 A 5 5 TRP N N 5 118.408 119.384 -0.976 1
1 44 . 15 1 1 A 6 6 MET H H 6 7.679 7.890 -0.211 1
1 45 . 15 1 1 A 6 6 MET HA H 6 3.785 4.710 -0.925 1
1 52 . 15 1 1 A 6 6 MET C C 6 175.174 176.499 -1.325 1
1 53 . 15 1 1 A 6 6 MET CA C 6 57.724 56.091 1.633 1
1 54 . 15 1 1 A 6 6 MET CB C 6 31.640 35.248 -3.608 1
1 57 . 15 1 1 A 6 6 MET N N 6 121.538 114.671 6.867 1
1 58 . 15 1 1 A 7 7 GLY H H 7 7.247 7.724 -0.477 1
1 59 . 15 1 1 A 7 7 GLY HA2 H 7 3.455 4.272 -0.817 1
1 60 . 15 1 1 A 7 7 GLY HA3 H 7 3.578 4.280 -0.702 1
1 61 . 15 1 1 A 7 7 GLY C C 7 172.852 173.913 -1.061 1
1 62 . 15 1 1 A 7 7 GLY CA C 7 45.896 44.414 1.482 1
1 63 . 15 1 1 A 7 7 GLY N N 7 104.055 109.698 -5.643 1
1 64 . 15 1 1 A 8 8 THR H H 8 7.436 8.533 -1.097 1
1 65 . 15 1 1 A 8 8 THR HA H 8 4.428 4.444 -0.016 1
1 70 . 15 1 1 A 8 8 THR C C 8 172.973 172.946 0.027 1
1 71 . 15 1 1 A 8 8 THR CA C 8 60.751 62.218 -1.467 1
1 72 . 15 1 1 A 8 8 THR CB C 8 69.637 72.023 -2.386 1
1 74 . 15 1 1 A 8 8 THR N N 8 107.669 116.127 -8.458 1
1 75 . 15 1 1 A 9 9 HIS H H 9 8.048 8.057 -0.009 1
1 76 . 15 1 1 A 9 9 HIS HA H 9 4.654 4.965 -0.311 1
1 79 . 15 1 1 A 9 9 HIS CA C 9 56.163 53.793 2.370 1
1 80 . 15 1 1 A 9 9 HIS CB C 9 32.619 32.209 0.410 1
1 81 . 15 1 1 A 9 9 HIS N N 9 127.281 117.631 9.650 1
1 82 . 15 1 1 A 10 10 PRO HA H 10 4.257 4.268 -0.011 1
1 88 . 15 1 1 A 10 10 PRO C C 10 178.779 179.252 -0.473 1
1 89 . 15 1 1 A 10 10 PRO CA C 10 65.565 66.157 -0.592 1
1 90 . 15 1 1 A 10 10 PRO CB C 10 32.422 31.932 0.490 1
1 93 . 15 1 1 A 11 11 LYS H H 11 10.994 8.530 2.464 1
1 94 . 15 1 1 A 11 11 LYS HA H 11 4.282 4.174 0.108 1
1 100 . 15 1 1 A 11 11 LYS C C 11 177.279 178.785 -1.506 1
1 101 . 15 1 1 A 11 11 LYS CA C 11 56.859 59.608 -2.749 1
1 102 . 15 1 1 A 11 11 LYS CB C 11 31.279 32.416 -1.137 1
1 104 . 15 1 1 A 11 11 LYS N N 11 121.398 118.387 3.011 1
1 105 . 15 1 1 A 12 12 TYR H H 12 7.146 8.257 -1.111 1
1 106 . 15 1 1 A 12 12 TYR HA H 12 3.722 4.333 -0.611 1
1 113 . 15 1 1 A 12 12 TYR C C 12 176.265 177.543 -1.278 1
1 114 . 15 1 1 A 12 12 TYR CA C 12 61.189 61.415 -0.226 1
1 115 . 15 1 1 A 12 12 TYR CB C 12 37.796 38.482 -0.686 1
1 116 . 15 1 1 A 12 12 TYR N N 12 121.579 121.309 0.270 1
1 117 . 15 1 1 A 13 13 LEU H H 13 7.778 9.073 -1.295 1
1 118 . 15 1 1 A 13 13 LEU HA H 13 3.773 4.006 -0.233 1
1 127 . 15 1 1 A 13 13 LEU C C 13 178.462 178.488 -0.026 1
1 128 . 15 1 1 A 13 13 LEU CA C 13 57.942 58.159 -0.217 1
1 129 . 15 1 1 A 13 13 LEU CB C 13 41.064 41.536 -0.472 1
1 132 . 15 1 1 A 13 13 LEU N N 13 117.518 120.965 -3.447 1
1 133 . 15 1 1 A 14 14 GLU H H 14 7.867 8.745 -0.878 1
1 134 . 15 1 1 A 14 14 GLU HA H 14 3.935 3.966 -0.031 1
1 139 . 15 1 1 A 14 14 GLU C C 14 178.326 178.510 -0.184 1
1 140 . 15 1 1 A 14 14 GLU CA C 14 59.368 59.751 -0.383 1
1 141 . 15 1 1 A 14 14 GLU CB C 14 30.147 29.145 1.002 1
1 143 . 15 1 1 A 14 14 GLU N N 14 119.135 119.286 -0.151 1
1 144 . 15 1 1 A 15 15 MET H H 15 7.773 8.148 -0.375 1
1 145 . 15 1 1 A 15 15 MET HA H 15 3.936 4.248 -0.312 1
1 152 . 15 1 1 A 15 15 MET C C 15 177.886 178.491 -0.605 1
1 153 . 15 1 1 A 15 15 MET CA C 15 59.465 57.827 1.638 1
1 154 . 15 1 1 A 15 15 MET CB C 15 33.987 31.487 2.500 1
1 157 . 15 1 1 A 15 15 MET N N 15 117.884 118.497 -0.613 1
1 158 . 15 1 1 A 16 16 MET H H 16 8.145 8.361 -0.216 1
1 159 . 15 1 1 A 16 16 MET HA H 16 4.159 4.232 -0.073 1
1 166 . 15 1 1 A 16 16 MET C C 16 177.835 178.173 -0.338 1
1 167 . 15 1 1 A 16 16 MET CA C 16 57.397 57.029 0.368 1
1 168 . 15 1 1 A 16 16 MET CB C 16 31.867 31.279 0.588 1
1 171 . 15 1 1 A 16 16 MET N N 16 119.555 118.888 0.667 1
1 172 . 15 1 1 A 17 17 GLU H H 17 7.761 8.158 -0.397 1
1 173 . 15 1 1 A 17 17 GLU HA H 17 4.117 4.139 -0.022 1
1 176 . 15 1 1 A 17 17 GLU C C 17 175.994 176.974 -0.980 1
1 177 . 15 1 1 A 17 17 GLU CA C 17 57.392 58.259 -0.867 1
1 178 . 15 1 1 A 17 17 GLU CB C 17 29.432 29.824 -0.392 1
1 180 . 15 1 1 A 17 17 GLU N N 17 118.216 120.230 -2.014 1
1 181 . 15 1 1 A 18 18 LEU H H 18 7.201 7.148 0.053 1
1 182 . 15 1 1 A 18 18 LEU HA H 18 4.111 4.278 -0.167 1
1 191 . 15 1 1 A 18 18 LEU C C 18 175.781 177.246 -1.465 1
1 192 . 15 1 1 A 18 18 LEU CA C 18 56.366 55.036 1.330 1
1 193 . 15 1 1 A 18 18 LEU CB C 18 42.030 42.495 -0.465 1
1 196 . 15 1 1 A 18 18 LEU N N 18 117.448 122.878 -5.430 1
1 197 . 15 1 1 A 19 19 ASP H H 19 7.789 8.623 -0.834 1
1 198 . 15 1 1 A 19 19 ASP HA H 19 4.360 4.611 -0.251 1
1 201 . 15 1 1 A 19 19 ASP C C 19 173.765 175.754 -1.989 1
1 202 . 15 1 1 A 19 19 ASP CA C 19 54.851 55.031 -0.180 1
1 203 . 15 1 1 A 19 19 ASP CB C 19 39.115 41.094 -1.979 1
1 204 . 15 1 1 A 19 19 ASP N N 19 115.844 120.619 -4.775 1
1 205 . 15 1 1 A 20 20 ILE H H 20 8.142 7.333 0.809 1
1 206 . 15 1 1 A 20 20 ILE HA H 20 4.128 4.672 -0.544 1
1 216 . 15 1 1 A 20 20 ILE C C 20 174.710 174.860 -0.150 1
1 217 . 15 1 1 A 20 20 ILE CA C 20 60.465 59.459 1.006 1
1 218 . 15 1 1 A 20 20 ILE CB C 20 40.407 40.789 -0.382 1
1 222 . 15 1 1 A 20 20 ILE N N 20 117.287 115.155 2.132 1
1 223 . 15 1 1 A 21 21 GLY H H 21 8.207 8.960 -0.753 1
1 224 . 15 1 1 A 21 21 GLY HA2 H 21 3.889 3.864 0.025 1
1 225 . 15 1 1 A 21 21 GLY HA3 H 21 3.924 3.872 0.052 1
1 226 . 15 1 1 A 21 21 GLY C C 21 172.162 172.559 -0.397 1
1 227 . 15 1 1 A 21 21 GLY CA C 21 45.017 47.388 -2.371 1
1 228 . 15 1 1 A 21 21 GLY N N 21 110.656 111.845 -1.189 1
1 229 . 15 1 1 A 22 22 ASP H H 22 7.727 8.402 -0.675 1
1 230 . 15 1 1 A 22 22 ASP HA H 22 4.794 5.026 -0.232 1
1 233 . 15 1 1 A 22 22 ASP C C 22 174.884 176.033 -1.149 1
1 234 . 15 1 1 A 22 22 ASP CA C 22 52.471 52.764 -0.293 1
1 235 . 15 1 1 A 22 22 ASP CB C 22 42.069 42.353 -0.284 1
1 236 . 15 1 1 A 22 22 ASP N N 22 119.305 123.782 -4.477 1
1 237 . 15 1 1 A 23 23 ALA H H 23 8.644 9.020 -0.376 1
1 238 . 15 1 1 A 23 23 ALA HA H 23 4.120 4.044 0.076 1
1 242 . 15 1 1 A 23 23 ALA C C 23 179.546 179.938 -0.392 1
1 243 . 15 1 1 A 23 23 ALA CA C 23 55.609 55.165 0.444 1
1 244 . 15 1 1 A 23 23 ALA CB C 23 18.573 18.539 0.034 1
1 245 . 15 1 1 A 23 23 ALA N N 23 122.468 128.079 -5.611 1
1 246 . 15 1 1 A 24 24 THR H H 24 8.238 7.450 0.788 1
1 247 . 15 1 1 A 24 24 THR HA H 24 4.184 4.033 0.151 1
1 252 . 15 1 1 A 24 24 THR C C 24 174.841 176.773 -1.932 1
1 253 . 15 1 1 A 24 24 THR CA C 24 66.241 66.444 -0.203 1
1 254 . 15 1 1 A 24 24 THR CB C 24 68.376 68.267 0.109 1
1 256 . 15 1 1 A 24 24 THR N N 24 114.824 114.035 0.789 1
1 257 . 15 1 1 A 25 25 GLN H H 25 8.037 8.471 -0.434 1
1 258 . 15 1 1 A 25 25 GLN HA H 25 4.095 4.040 0.055 1
1 265 . 15 1 1 A 25 25 GLN C C 25 177.603 178.653 -1.050 1
1 266 . 15 1 1 A 25 25 GLN CA C 25 59.261 58.805 0.456 1
1 267 . 15 1 1 A 25 25 GLN CB C 25 28.437 28.274 0.163 1
1 269 . 15 1 1 A 25 25 GLN N N 25 122.518 120.269 2.249 1
1 271 . 15 1 1 A 26 26 VAL H H 26 7.994 8.257 -0.263 1
1 272 . 15 1 1 A 26 26 VAL HA H 26 3.469 3.585 -0.116 1
1 280 . 15 1 1 A 26 26 VAL C C 26 175.552 178.019 -2.467 1
1 281 . 15 1 1 A 26 26 VAL CA C 26 66.909 66.348 0.561 1
1 282 . 15 1 1 A 26 26 VAL CB C 26 31.582 31.450 0.132 1
1 285 . 15 1 1 A 26 26 VAL N N 26 119.112 120.850 -1.738 1
1 286 . 15 1 1 A 27 27 TYR H H 27 8.003 8.631 -0.628 1
1 287 . 15 1 1 A 27 27 TYR HA H 27 4.357 4.526 -0.169 1
1 294 . 15 1 1 A 27 27 TYR C C 27 175.856 177.067 -1.211 1
1 295 . 15 1 1 A 27 27 TYR CA C 27 62.197 61.818 0.379 1
1 296 . 15 1 1 A 27 27 TYR CB C 27 38.394 38.995 -0.601 1
1 297 . 15 1 1 A 27 27 TYR N N 27 119.170 121.028 -1.858 1
1 298 . 15 1 1 A 28 28 VAL H H 28 8.087 8.609 -0.522 1
1 299 . 15 1 1 A 28 28 VAL HA H 28 3.652 3.524 0.128 1
1 307 . 15 1 1 A 28 28 VAL C C 28 176.134 177.893 -1.759 1
1 308 . 15 1 1 A 28 28 VAL CA C 28 66.247 66.258 -0.011 1
1 309 . 15 1 1 A 28 28 VAL CB C 28 31.241 31.352 -0.111 1
1 312 . 15 1 1 A 28 28 VAL N N 28 113.112 119.428 -6.316 1
1 313 . 15 1 1 A 29 29 ALA H H 29 7.853 8.724 -0.871 1
1 314 . 15 1 1 A 29 29 ALA HA H 29 3.913 4.123 -0.210 1
1 318 . 15 1 1 A 29 29 ALA C C 29 177.850 179.240 -1.390 1
1 319 . 15 1 1 A 29 29 ALA CA C 29 55.274 54.927 0.347 1
1 320 . 15 1 1 A 29 29 ALA CB C 29 17.876 18.433 -0.557 1
1 321 . 15 1 1 A 29 29 ALA N N 29 121.350 122.503 -1.153 1
1 322 . 15 1 1 A 30 30 PHE H H 30 8.724 8.221 0.503 1
1 323 . 15 1 1 A 30 30 PHE HA H 30 4.098 4.351 -0.253 1
1 327 . 15 1 1 A 30 30 PHE C C 30 175.035 177.238 -2.203 1
1 328 . 15 1 1 A 30 30 PHE CA C 30 61.264 61.624 -0.360 1
1 329 . 15 1 1 A 30 30 PHE CB C 30 38.926 39.441 -0.515 1
1 330 . 15 1 1 A 30 30 PHE N N 30 120.478 120.378 0.100 1
1 331 . 15 1 1 A 31 31 LEU H H 31 8.146 8.040 0.106 1
1 332 . 15 1 1 A 31 31 LEU HA H 31 3.597 3.646 -0.049 1
1 341 . 15 1 1 A 31 31 LEU C C 31 179.508 179.362 0.146 1
1 342 . 15 1 1 A 31 31 LEU CA C 31 57.884 58.179 -0.295 1
1 343 . 15 1 1 A 31 31 LEU CB C 31 41.829 42.167 -0.338 1
1 346 . 15 1 1 A 31 31 LEU N N 31 118.427 120.233 -1.806 1
1 347 . 15 1 1 A 32 32 VAL H H 32 7.627 7.577 0.050 1
1 348 . 15 1 1 A 32 32 VAL HA H 32 3.464 3.886 -0.422 1
1 356 . 15 1 1 A 32 32 VAL C C 32 174.956 177.796 -2.840 1
1 357 . 15 1 1 A 32 32 VAL CA C 32 66.373 65.726 0.647 1
1 358 . 15 1 1 A 32 32 VAL CB C 32 31.121 31.551 -0.430 1
1 361 . 15 1 1 A 32 32 VAL N N 32 119.497 113.990 5.507 1
1 362 . 15 1 1 A 33 33 TYR H H 33 8.366 8.844 -0.478 1
1 363 . 15 1 1 A 33 33 TYR HA H 33 3.485 4.075 -0.590 1
1 370 . 15 1 1 A 33 33 TYR C C 33 174.883 176.977 -2.094 1
1 371 . 15 1 1 A 33 33 TYR CA C 33 62.866 61.395 1.471 1
1 372 . 15 1 1 A 33 33 TYR CB C 33 37.778 38.343 -0.565 1
1 373 . 15 1 1 A 33 33 TYR N N 33 121.842 124.368 -2.526 1
1 374 . 15 1 1 A 34 34 LEU H H 34 8.000 8.396 -0.396 1
1 375 . 15 1 1 A 34 34 LEU HA H 34 3.495 3.646 -0.151 1
1 385 . 15 1 1 A 34 34 LEU C C 34 178.240 179.040 -0.800 1
1 386 . 15 1 1 A 34 34 LEU CA C 34 57.453 57.236 0.217 1
1 387 . 15 1 1 A 34 34 LEU CB C 34 41.828 41.184 0.644 1
1 390 . 15 1 1 A 34 34 LEU N N 34 116.692 119.412 -2.720 1
1 391 . 15 1 1 A 35 35 ASP H H 35 7.688 7.963 -0.275 1
1 392 . 15 1 1 A 35 35 ASP HA H 35 4.302 4.340 -0.038 1
1 395 . 15 1 1 A 35 35 ASP C C 35 177.507 178.570 -1.063 1
1 396 . 15 1 1 A 35 35 ASP CA C 35 58.196 57.724 0.472 1
1 397 . 15 1 1 A 35 35 ASP CB C 35 43.070 41.185 1.885 1
1 398 . 15 1 1 A 35 35 ASP N N 35 120.507 119.986 0.521 1
1 399 . 15 1 1 A 36 36 LEU H H 36 8.482 8.701 -0.219 1
1 400 . 15 1 1 A 36 36 LEU HA H 36 3.328 3.874 -0.546 1
1 410 . 15 1 1 A 36 36 LEU C C 36 176.774 179.040 -2.266 1
1 411 . 15 1 1 A 36 36 LEU CA C 36 57.461 57.835 -0.374 1
1 412 . 15 1 1 A 36 36 LEU CB C 36 41.344 41.674 -0.330 1
1 416 . 15 1 1 A 36 36 LEU N N 36 117.671 120.491 -2.820 1
1 417 . 15 1 1 A 37 37 MET H H 37 7.822 8.066 -0.244 1
1 418 . 15 1 1 A 37 37 MET HA H 37 4.401 4.089 0.312 1
1 425 . 15 1 1 A 37 37 MET C C 37 177.862 177.844 0.018 1
1 426 . 15 1 1 A 37 37 MET CA C 37 56.434 58.028 -1.594 1
1 427 . 15 1 1 A 37 37 MET CB C 37 31.573 31.724 -0.151 1
1 430 . 15 1 1 A 37 37 MET N N 37 112.952 118.521 -5.569 1
1 431 . 15 1 1 A 38 38 GLU H H 38 8.667 7.946 0.721 1
1 432 . 15 1 1 A 38 38 GLU HA H 38 4.457 4.080 0.377 1
1 436 . 15 1 1 A 38 38 GLU C C 38 176.582 177.049 -0.467 1
1 437 . 15 1 1 A 38 38 GLU CA C 38 57.659 57.625 0.034 1
1 438 . 15 1 1 A 38 38 GLU CB C 38 29.936 29.901 0.035 1
1 440 . 15 1 1 A 38 38 GLU N N 38 116.463 118.437 -1.974 1
1 441 . 15 1 1 A 39 39 SER H H 39 7.657 7.979 -0.322 1
1 442 . 15 1 1 A 39 39 SER HA H 39 4.658 4.646 0.012 1
1 445 . 15 1 1 A 39 39 SER C C 39 175.661 175.959 -0.298 1
1 446 . 15 1 1 A 39 39 SER CA C 39 60.449 59.549 0.900 1
1 447 . 15 1 1 A 39 39 SER CB C 39 63.341 64.589 -1.248 1
1 448 . 15 1 1 A 39 39 SER N N 39 113.870 115.489 -1.619 1
1 449 . 15 1 1 A 40 40 LYS H H 40 8.165 7.634 0.531 1
1 450 . 15 1 1 A 40 40 LYS HA H 40 4.454 4.105 0.349 1
1 458 . 15 1 1 A 40 40 LYS C C 40 174.970 174.997 -0.027 1
1 459 . 15 1 1 A 40 40 LYS CA C 40 55.753 55.486 0.267 1
1 460 . 15 1 1 A 40 40 LYS CB C 40 32.337 32.401 -0.064 1
1 464 . 15 1 1 A 40 40 LYS N N 40 116.671 118.323 -1.652 1
1 465 . 15 1 1 A 41 41 SER H H 41 7.017 7.477 -0.460 1
1 466 . 15 1 1 A 41 41 SER HA H 41 4.209 3.932 0.277 1
1 469 . 15 1 1 A 41 41 SER C C 41 173.770 173.566 0.204 1
1 470 . 15 1 1 A 41 41 SER CA C 41 58.435 58.831 -0.396 1
1 471 . 15 1 1 A 41 41 SER CB C 41 61.700 61.642 0.058 1
1 472 . 15 1 1 A 41 41 SER N N 41 109.989 112.790 -2.801 1
1 473 . 15 1 1 A 42 42 TRP H H 42 8.876 8.199 0.677 1
1 474 . 15 1 1 A 42 42 TRP HA H 42 4.698 4.979 -0.281 1
1 478 . 15 1 1 A 42 42 TRP C C 42 174.477 177.645 -3.168 1
1 479 . 15 1 1 A 42 42 TRP CA C 42 59.443 56.868 2.575 1
1 480 . 15 1 1 A 42 42 TRP CB C 42 28.203 30.808 -2.605 1
1 481 . 15 1 1 A 42 42 TRP N N 42 121.116 125.359 -4.243 1
1 483 . 15 1 1 A 43 43 HIS H H 43 8.132 8.768 -0.636 1
1 484 . 15 1 1 A 43 43 HIS HA H 43 4.445 4.291 0.154 1
1 488 . 15 1 1 A 43 43 HIS C C 43 174.405 174.435 -0.030 1
1 489 . 15 1 1 A 43 43 HIS CA C 43 58.556 59.619 -1.063 1
1 490 . 15 1 1 A 43 43 HIS CB C 43 29.430 30.265 -0.835 1
1 491 . 15 1 1 A 43 43 HIS N N 43 119.397 121.214 -1.817 1
1 492 . 15 1 1 A 44 44 GLU H H 44 8.140 7.459 0.681 1
1 493 . 15 1 1 A 44 44 GLU HA H 44 4.432 4.501 -0.069 1
1 497 . 15 1 1 A 44 44 GLU C C 44 173.010 174.189 -1.179 1
1 498 . 15 1 1 A 44 44 GLU CA C 44 56.421 56.054 0.367 1
1 499 . 15 1 1 A 44 44 GLU CB C 44 33.285 33.314 -0.029 1
1 501 . 15 1 1 A 44 44 GLU N N 44 116.181 117.899 -1.718 1
1 502 . 15 1 1 A 45 45 VAL H H 45 8.428 8.546 -0.118 1
1 503 . 15 1 1 A 45 45 VAL HA H 45 4.492 4.955 -0.463 1
1 511 . 15 1 1 A 45 45 VAL C C 45 172.339 174.655 -2.316 1
1 512 . 15 1 1 A 45 45 VAL CA C 45 63.071 61.068 2.003 1
1 513 . 15 1 1 A 45 45 VAL CB C 45 35.145 34.704 0.441 1
1 516 . 15 1 1 A 45 45 VAL N N 45 123.272 124.955 -1.683 1
1 517 . 15 1 1 A 46 46 ASN H H 46 9.050 8.994 0.056 1
1 518 . 15 1 1 A 46 46 ASN HA H 46 5.261 5.524 -0.263 1
1 523 . 15 1 1 A 46 46 ASN C C 46 172.845 173.747 -0.902 1
1 524 . 15 1 1 A 46 46 ASN CA C 46 51.895 51.926 -0.031 1
1 525 . 15 1 1 A 46 46 ASN CB C 46 42.322 42.271 0.051 1
1 526 . 15 1 1 A 46 46 ASN N N 46 123.901 124.522 -0.621 1
1 528 . 15 1 1 A 47 47 CYS H H 47 9.039 9.028 0.011 1
1 529 . 15 1 1 A 47 47 CYS HA H 47 5.160 5.363 -0.203 1
1 532 . 15 1 1 A 47 47 CYS C C 47 172.454 173.496 -1.042 1
1 533 . 15 1 1 A 47 47 CYS CA C 47 56.473 57.090 -0.617 1
1 534 . 15 1 1 A 47 47 CYS CB C 47 29.297 28.904 0.393 1
1 535 . 15 1 1 A 47 47 CYS N N 47 119.663 118.768 0.895 1
1 536 . 15 1 1 A 48 48 VAL H H 48 9.083 8.944 0.139 1
1 537 . 15 1 1 A 48 48 VAL HA H 48 4.344 4.727 -0.383 1
1 542 . 15 1 1 A 48 48 VAL C C 48 173.307 175.005 -1.698 1
1 543 . 15 1 1 A 48 48 VAL CA C 48 61.368 60.804 0.564 1
1 544 . 15 1 1 A 48 48 VAL CB C 48 35.345 34.755 0.590 1
1 546 . 15 1 1 A 48 48 VAL N N 48 124.672 125.010 -0.338 1
1 547 . 15 1 1 A 49 49 GLY H H 49 9.019 9.135 -0.116 1
1 548 . 15 1 1 A 49 49 GLY HA2 H 49 3.460 4.120 -0.660 1
1 549 . 15 1 1 A 49 49 GLY HA3 H 49 4.539 4.122 0.417 1
1 550 . 15 1 1 A 49 49 GLY C C 49 171.278 172.739 -1.461 1
1 551 . 15 1 1 A 49 49 GLY CA C 49 45.075 44.808 0.267 1
1 552 . 15 1 1 A 49 49 GLY N N 49 113.131 115.971 -2.840 1
1 553 . 15 1 1 A 50 50 LEU H H 50 8.747 8.884 -0.137 1
1 554 . 15 1 1 A 50 50 LEU HA H 50 5.102 4.899 0.203 1
1 564 . 15 1 1 A 50 50 LEU CA C 50 51.417 51.360 0.057 1
1 565 . 15 1 1 A 50 50 LEU CB C 50 41.754 42.235 -0.481 1
1 569 . 15 1 1 A 50 50 LEU N N 50 124.471 127.609 -3.138 1
1 570 . 15 1 1 A 51 51 PRO HA H 51 4.106 4.419 -0.313 1
1 577 . 15 1 1 A 51 51 PRO C C 51 178.422 177.868 0.554 1
1 578 . 15 1 1 A 51 51 PRO CA C 51 65.680 64.482 1.198 1
1 579 . 15 1 1 A 51 51 PRO CB C 51 31.939 31.959 -0.020 1
1 582 . 15 1 1 A 52 52 GLU H H 52 9.721 8.299 1.422 1
1 583 . 15 1 1 A 52 52 GLU HA H 52 4.176 4.097 0.079 1
1 588 . 15 1 1 A 52 52 GLU C C 52 176.146 178.073 -1.927 1
1 589 . 15 1 1 A 52 52 GLU CA C 52 59.158 59.509 -0.351 1
1 590 . 15 1 1 A 52 52 GLU CB C 52 28.442 29.522 -1.080 1
1 592 . 15 1 1 A 52 52 GLU N N 52 118.552 118.173 0.379 1
1 593 . 15 1 1 A 53 53 LEU H H 53 7.089 7.818 -0.729 1
1 594 . 15 1 1 A 53 53 LEU HA H 53 4.511 4.330 0.181 1
1 603 . 15 1 1 A 53 53 LEU C C 53 174.027 176.090 -2.063 1
1 604 . 15 1 1 A 53 53 LEU CA C 53 53.825 54.757 -0.932 1
1 605 . 15 1 1 A 53 53 LEU CB C 53 43.825 42.477 1.348 1
1 608 . 15 1 1 A 53 53 LEU N N 53 116.763 118.098 -1.335 1
1 609 . 15 1 1 A 54 54 GLN H H 54 7.964 7.771 0.193 1
1 610 . 15 1 1 A 54 54 GLN HA H 54 3.591 3.867 -0.276 1
1 616 . 15 1 1 A 54 54 GLN C C 54 172.604 174.172 -1.568 1
1 617 . 15 1 1 A 54 54 GLN CA C 54 56.961 57.096 -0.135 1
1 618 . 15 1 1 A 54 54 GLN CB C 54 26.545 26.388 0.157 1
1 620 . 15 1 1 A 54 54 GLN N N 54 115.489 116.185 -0.696 1
1 622 . 15 1 1 A 55 55 LEU H H 55 7.139 7.290 -0.151 1
1 623 . 15 1 1 A 55 55 LEU HA H 55 4.750 4.819 -0.069 1
1 629 . 15 1 1 A 55 55 LEU C C 55 173.475 175.667 -2.192 1
1 630 . 15 1 1 A 55 55 LEU CA C 55 53.698 53.424 0.274 1
1 631 . 15 1 1 A 55 55 LEU CB C 55 47.859 44.047 3.812 1
1 633 . 15 1 1 A 55 55 LEU N N 55 116.422 118.329 -1.907 1
1 634 . 15 1 1 A 56 56 ILE H H 56 8.223 8.749 -0.526 1
1 635 . 15 1 1 A 56 56 ILE HA H 56 4.540 5.024 -0.484 1
1 643 . 15 1 1 A 56 56 ILE C C 56 173.938 174.896 -0.958 1
1 644 . 15 1 1 A 56 56 ILE CA C 56 61.020 60.112 0.908 1
1 645 . 15 1 1 A 56 56 ILE CB C 56 39.403 40.001 -0.598 1
1 648 . 15 1 1 A 56 56 ILE N N 56 122.792 122.164 0.628 1
1 649 . 15 1 1 A 57 57 CYS H H 57 8.995 8.833 0.162 1
1 650 . 15 1 1 A 57 57 CYS HA H 57 5.036 5.216 -0.180 1
1 653 . 15 1 1 A 57 57 CYS C C 57 170.483 173.291 -2.808 1
1 654 . 15 1 1 A 57 57 CYS CA C 57 56.484 57.738 -1.254 1
1 655 . 15 1 1 A 57 57 CYS CB C 57 30.545 31.863 -1.318 1
1 656 . 15 1 1 A 57 57 CYS N N 57 121.575 124.887 -3.312 1
1 657 . 15 1 1 A 58 58 LEU H H 58 9.076 9.260 -0.184 1
1 658 . 15 1 1 A 58 58 LEU HA H 58 5.472 5.456 0.016 1
1 668 . 15 1 1 A 58 58 LEU C C 58 174.009 176.253 -2.244 1
1 669 . 15 1 1 A 58 58 LEU CA C 58 52.851 53.729 -0.878 1
1 670 . 15 1 1 A 58 58 LEU CB C 58 42.177 42.856 -0.679 1
1 674 . 15 1 1 A 58 58 LEU N N 58 121.895 124.737 -2.842 1
1 675 . 15 1 1 A 59 59 VAL H H 59 8.966 8.797 0.169 1
1 676 . 15 1 1 A 59 59 VAL HA H 59 5.488 4.924 0.564 1
1 681 . 15 1 1 A 59 59 VAL C C 59 176.034 175.439 0.595 1
1 682 . 15 1 1 A 59 59 VAL CA C 59 59.820 60.804 -0.984 1
1 683 . 15 1 1 A 59 59 VAL CB C 59 34.786 34.413 0.373 1
1 685 . 15 1 1 A 59 59 VAL N N 59 121.702 125.106 -3.404 1
1 686 . 15 1 1 A 60 60 GLY H H 60 9.258 9.081 0.177 1
1 687 . 15 1 1 A 60 60 GLY HA2 H 60 4.673 4.257 0.416 1
1 688 . 15 1 1 A 60 60 GLY HA3 H 60 4.804 4.257 0.547 1
1 689 . 15 1 1 A 60 60 GLY C C 60 169.831 171.928 -2.097 1
1 690 . 15 1 1 A 60 60 GLY CA C 60 46.399 43.673 2.726 1
1 691 . 15 1 1 A 60 60 GLY N N 60 114.126 115.920 -1.794 1
1 692 . 15 1 1 A 61 61 THR H H 61 8.834 9.078 -0.244 1
1 693 . 15 1 1 A 61 61 THR HA H 61 4.418 4.383 0.035 1
1 698 . 15 1 1 A 61 61 THR C C 61 171.985 175.194 -3.209 1
1 699 . 15 1 1 A 61 61 THR CA C 61 60.634 62.459 -1.825 1
1 700 . 15 1 1 A 61 61 THR CB C 61 70.983 68.306 2.677 1
1 702 . 15 1 1 A 61 61 THR N N 61 114.856 115.164 -0.308 1
1 703 . 15 1 1 A 62 62 GLU H H 62 8.502 8.261 0.241 1
1 704 . 15 1 1 A 62 62 GLU HA H 62 2.867 3.722 -0.855 1
1 709 . 15 1 1 A 62 62 GLU C C 62 174.650 176.033 -1.383 1
1 710 . 15 1 1 A 62 62 GLU CA C 62 58.785 58.993 -0.208 1
1 711 . 15 1 1 A 62 62 GLU CB C 62 28.981 29.403 -0.422 1
1 713 . 15 1 1 A 62 62 GLU N N 62 129.915 127.918 1.997 1
1 714 . 15 1 1 A 63 63 ILE H H 63 6.928 7.971 -1.043 1
1 715 . 15 1 1 A 63 63 ILE HA H 63 4.038 4.607 -0.569 1
1 725 . 15 1 1 A 63 63 ILE C C 63 173.482 174.698 -1.216 1
1 726 . 15 1 1 A 63 63 ILE CA C 63 58.664 60.586 -1.922 1
1 727 . 15 1 1 A 63 63 ILE CB C 63 40.009 40.971 -0.962 1
1 731 . 15 1 1 A 63 63 ILE N N 63 117.075 117.843 -0.768 1
1 732 . 15 1 1 A 64 64 GLU H H 64 8.585 8.506 0.079 1
1 733 . 15 1 1 A 64 64 GLU HA H 64 3.427 3.963 -0.536 1
1 738 . 15 1 1 A 64 64 GLU C C 64 175.186 176.992 -1.806 1
1 739 . 15 1 1 A 64 64 GLU CA C 64 58.703 58.303 0.400 1
1 740 . 15 1 1 A 64 64 GLU CB C 64 28.999 29.059 -0.060 1
1 742 . 15 1 1 A 64 64 GLU N N 64 126.422 127.363 -0.941 1
1 743 . 15 1 1 A 65 65 GLY H H 65 8.754 8.648 0.106 1
1 744 . 15 1 1 A 65 65 GLY HA2 H 65 3.631 3.980 -0.349 1
1 745 . 15 1 1 A 65 65 GLY HA3 H 65 4.287 3.988 0.299 1
1 746 . 15 1 1 A 65 65 GLY C C 65 174.005 173.961 0.044 1
1 747 . 15 1 1 A 65 65 GLY CA C 65 44.954 45.412 -0.458 1
1 748 . 15 1 1 A 65 65 GLY N N 65 114.614 114.354 0.260 1
1 749 . 15 1 1 A 66 66 GLU H H 66 7.760 7.597 0.163 1
1 750 . 15 1 1 A 66 66 GLU HA H 66 4.462 4.692 -0.230 1
1 754 . 15 1 1 A 66 66 GLU C C 66 175.255 175.624 -0.369 1
1 755 . 15 1 1 A 66 66 GLU CA C 66 55.582 54.179 1.403 1
1 756 . 15 1 1 A 66 66 GLU CB C 66 30.654 31.574 -0.920 1
1 758 . 15 1 1 A 66 66 GLU N N 66 119.292 121.350 -2.058 1
1 759 . 15 1 1 A 67 67 GLY H H 67 8.262 8.079 0.183 1
1 760 . 15 1 1 A 67 67 GLY HA2 H 67 3.875 4.020 -0.145 1
1 761 . 15 1 1 A 67 67 GLY HA3 H 67 4.088 4.026 0.062 1
1 762 . 15 1 1 A 67 67 GLY C C 67 172.197 174.436 -2.239 1
1 763 . 15 1 1 A 67 67 GLY CA C 67 44.845 46.111 -1.266 1
1 764 . 15 1 1 A 67 67 GLY N N 67 106.161 109.623 -3.462 1
1 765 . 15 1 1 A 68 68 LEU H H 68 8.142 7.673 0.469 1
1 766 . 15 1 1 A 68 68 LEU HA H 68 4.491 4.111 0.380 1
1 775 . 15 1 1 A 68 68 LEU C C 68 176.194 176.693 -0.499 1
1 776 . 15 1 1 A 68 68 LEU CA C 68 55.123 56.076 -0.953 1
1 777 . 15 1 1 A 68 68 LEU CB C 68 44.527 42.034 2.493 1
1 780 . 15 1 1 A 68 68 LEU N N 68 120.269 122.183 -1.914 1
1 781 . 15 1 1 A 69 69 GLN H H 69 9.253 8.205 1.048 1
1 782 . 15 1 1 A 69 69 GLN HA H 69 4.770 4.599 0.171 1
1 788 . 15 1 1 A 69 69 GLN C C 69 173.607 173.988 -0.381 1
1 789 . 15 1 1 A 69 69 GLN CA C 69 54.736 55.680 -0.944 1
1 790 . 15 1 1 A 69 69 GLN CB C 69 33.782 31.747 2.035 1
1 792 . 15 1 1 A 69 69 GLN N N 69 119.336 125.251 -5.915 1
1 794 . 15 1 1 A 70 70 THR H H 70 8.803 8.933 -0.130 1
1 795 . 15 1 1 A 70 70 THR HA H 70 5.033 5.102 -0.069 1
1 800 . 15 1 1 A 70 70 THR C C 70 172.596 173.531 -0.935 1
1 801 . 15 1 1 A 70 70 THR CA C 70 62.768 61.778 0.990 1
1 802 . 15 1 1 A 70 70 THR CB C 70 69.990 71.004 -1.014 1
1 804 . 15 1 1 A 70 70 THR N N 70 118.372 121.486 -3.114 1
1 805 . 15 1 1 A 71 71 VAL H H 71 9.882 9.148 0.734 1
1 806 . 15 1 1 A 71 71 VAL HA H 71 5.239 5.389 -0.150 1
1 811 . 15 1 1 A 71 71 VAL C C 71 174.015 174.552 -0.537 1
1 812 . 15 1 1 A 71 71 VAL CA C 71 60.577 60.742 -0.165 1
1 813 . 15 1 1 A 71 71 VAL CB C 71 34.149 34.600 -0.451 1
1 815 . 15 1 1 A 71 71 VAL N N 71 129.063 127.083 1.980 1
1 816 . 15 1 1 A 72 72 VAL H H 72 9.491 8.738 0.753 1
1 817 . 15 1 1 A 72 72 VAL HA H 72 4.672 4.850 -0.178 1
1 825 . 15 1 1 A 72 72 VAL CA C 72 59.568 57.808 1.760 1
1 826 . 15 1 1 A 72 72 VAL CB C 72 34.057 35.127 -1.070 1
1 829 . 15 1 1 A 72 72 VAL N N 72 128.521 125.199 3.322 1
1 830 . 15 1 1 A 73 73 PRO HA H 73 5.368 4.539 0.829 1
1 836 . 15 1 1 A 73 73 PRO C C 73 175.079 175.997 -0.918 1
1 837 . 15 1 1 A 73 73 PRO CA C 73 61.324 63.137 -1.813 1
1 838 . 15 1 1 A 73 73 PRO CB C 73 33.089 32.087 1.002 1
1 841 . 15 1 1 A 74 74 THR H H 74 9.103 9.000 0.103 1
1 842 . 15 1 1 A 74 74 THR HA H 74 5.191 4.781 0.410 1
1 847 . 15 1 1 A 74 74 THR CA C 74 57.986 59.095 -1.109 1
1 848 . 15 1 1 A 74 74 THR CB C 74 72.212 71.705 0.507 1
1 850 . 15 1 1 A 74 74 THR N N 74 118.075 118.681 -0.606 1
1 851 . 15 1 1 A 75 75 PRO HA H 75 5.015 4.841 0.174 1
1 858 . 15 1 1 A 75 75 PRO C C 75 178.704 176.902 1.802 1
1 859 . 15 1 1 A 75 75 PRO CA C 75 63.038 61.995 1.043 1
1 860 . 15 1 1 A 75 75 PRO CB C 75 32.529 32.818 -0.289 1
1 863 . 15 1 1 A 76 76 ILE H H 76 8.221 8.107 0.114 1
1 864 . 15 1 1 A 76 76 ILE HA H 76 4.218 3.917 0.301 1
1 873 . 15 1 1 A 76 76 ILE C C 76 172.375 177.069 -4.694 1
1 874 . 15 1 1 A 76 76 ILE CA C 76 63.509 63.287 0.222 1
1 875 . 15 1 1 A 76 76 ILE CB C 76 39.322 37.603 1.719 1
1 879 . 15 1 1 A 76 76 ILE N N 76 122.273 121.746 0.527 1
1 880 . 15 1 1 A 77 77 THR H H 77 6.984 7.651 -0.667 1
1 881 . 15 1 1 A 77 77 THR HA H 77 4.227 4.327 -0.100 1
1 886 . 15 1 1 A 77 77 THR C C 77 173.531 174.336 -0.805 1
1 887 . 15 1 1 A 77 77 THR CA C 77 61.435 63.467 -2.032 1
1 888 . 15 1 1 A 77 77 THR CB C 77 68.944 69.371 -0.427 1
1 890 . 15 1 1 A 77 77 THR N N 77 105.803 114.867 -9.064 1
1 891 . 15 1 1 A 78 78 ALA H H 78 7.647 7.350 0.297 1
1 892 . 15 1 1 A 78 78 ALA HA H 78 4.757 4.650 0.107 1
1 896 . 15 1 1 A 78 78 ALA C C 78 173.520 175.988 -2.468 1
1 897 . 15 1 1 A 78 78 ALA CA C 78 51.164 50.805 0.359 1
1 898 . 15 1 1 A 78 78 ALA CB C 78 20.011 21.380 -1.369 1
1 899 . 15 1 1 A 78 78 ALA N N 78 126.635 123.093 3.542 1
1 900 . 15 1 1 A 79 79 SER H H 79 7.884 8.895 -1.011 1
1 901 . 15 1 1 A 79 79 SER HA H 79 4.386 5.139 -0.753 1
1 903 . 15 1 1 A 79 79 SER C C 79 176.077 172.165 3.912 1
1 904 . 15 1 1 A 79 79 SER CA C 79 57.465 56.819 0.646 1
1 905 . 15 1 1 A 79 79 SER CB C 79 65.285 66.028 -0.743 1
1 906 . 15 1 1 A 79 79 SER N N 79 115.272 114.132 1.140 1
1 907 . 15 1 1 A 80 80 LEU H H 80 7.700 8.948 -1.248 1
1 908 . 15 1 1 A 80 80 LEU HA H 80 4.912 5.174 -0.262 1
1 915 . 15 1 1 A 80 80 LEU C C 80 173.927 174.079 -0.152 1
1 916 . 15 1 1 A 80 80 LEU CA C 80 53.829 53.574 0.255 1
1 917 . 15 1 1 A 80 80 LEU CB C 80 45.990 45.569 0.421 1
1 920 . 15 1 1 A 80 80 LEU N N 80 121.507 125.058 -3.551 1
1 921 . 15 1 1 A 81 81 SER H H 81 7.885 8.906 -1.021 1
1 922 . 15 1 1 A 81 81 SER HA H 81 5.269 4.943 0.326 1
1 925 . 15 1 1 A 81 81 SER C C 81 175.756 176.192 -0.436 1
1 926 . 15 1 1 A 81 81 SER CA C 81 55.507 55.760 -0.253 1
1 927 . 15 1 1 A 81 81 SER CB C 81 65.966 65.049 0.917 1
1 928 . 15 1 1 A 81 81 SER N N 81 118.323 121.968 -3.645 1
1 929 . 15 1 1 A 82 82 HIS H H 82 8.935 9.135 -0.200 1
1 930 . 15 1 1 A 82 82 HIS HA H 82 4.407 4.390 0.017 1
1 932 . 15 1 1 A 82 82 HIS C C 82 176.550 177.016 -0.466 1
1 933 . 15 1 1 A 82 82 HIS CA C 82 60.960 59.059 1.901 1
1 934 . 15 1 1 A 82 82 HIS CB C 82 30.755 29.600 1.155 1
1 935 . 15 1 1 A 82 82 HIS N N 82 124.042 124.546 -0.504 1
1 936 . 15 1 1 A 83 83 ASN H H 83 8.435 7.985 0.450 1
1 937 . 15 1 1 A 83 83 ASN HA H 83 4.439 4.246 0.193 1
1 941 . 15 1 1 A 83 83 ASN C C 83 174.769 177.851 -3.082 1
1 942 . 15 1 1 A 83 83 ASN CA C 83 56.575 56.668 -0.093 1
1 943 . 15 1 1 A 83 83 ASN CB C 83 38.731 38.658 0.073 1
1 944 . 15 1 1 A 83 83 ASN N N 83 118.543 119.907 -1.364 1
1 946 . 15 1 1 A 84 84 ARG H H 84 7.716 7.884 -0.168 1
1 947 . 15 1 1 A 84 84 ARG HA H 84 4.183 4.163 0.020 1
1 953 . 15 1 1 A 84 84 ARG C C 84 177.399 178.773 -1.374 1
1 954 . 15 1 1 A 84 84 ARG CA C 84 59.045 58.447 0.598 1
1 955 . 15 1 1 A 84 84 ARG CB C 84 29.992 29.941 0.051 1
1 957 . 15 1 1 A 84 84 ARG N N 84 121.312 119.821 1.491 1
1 958 . 15 1 1 A 85 85 ILE H H 85 8.354 8.110 0.244 1
1 959 . 15 1 1 A 85 85 ILE HA H 85 3.650 3.891 -0.241 1
1 967 . 15 1 1 A 85 85 ILE C C 85 176.098 178.110 -2.012 1
1 968 . 15 1 1 A 85 85 ILE CA C 85 66.704 65.494 1.210 1
1 969 . 15 1 1 A 85 85 ILE CB C 85 38.017 37.944 0.073 1
1 972 . 15 1 1 A 85 85 ILE N N 85 119.321 120.360 -1.039 1
1 973 . 15 1 1 A 86 86 ARG H H 86 7.690 8.007 -0.317 1
1 974 . 15 1 1 A 86 86 ARG HA H 86 3.704 3.938 -0.234 1
1 981 . 15 1 1 A 86 86 ARG C C 86 177.524 178.616 -1.092 1
1 982 . 15 1 1 A 86 86 ARG CA C 86 59.881 59.275 0.606 1
1 983 . 15 1 1 A 86 86 ARG CB C 86 29.248 29.968 -0.720 1
1 986 . 15 1 1 A 86 86 ARG N N 86 118.362 120.490 -2.128 1
1 987 . 15 1 1 A 87 87 GLU H H 87 7.884 7.750 0.134 1
1 988 . 15 1 1 A 87 87 GLU HA H 87 4.064 4.081 -0.017 1
1 993 . 15 1 1 A 87 87 GLU C C 87 178.785 179.515 -0.730 1
1 994 . 15 1 1 A 87 87 GLU CA C 87 58.999 58.723 0.276 1
1 995 . 15 1 1 A 87 87 GLU CB C 87 29.872 29.920 -0.048 1
1 997 . 15 1 1 A 87 87 GLU N N 87 118.124 119.173 -1.049 1
1 998 . 15 1 1 A 88 88 ILE H H 88 8.715 8.227 0.488 1
1 999 . 15 1 1 A 88 88 ILE HA H 88 3.305 3.523 -0.218 1
1 1009 . 15 1 1 A 88 88 ILE C C 88 177.261 178.008 -0.747 1
1 1010 . 15 1 1 A 88 88 ILE CA C 88 65.822 64.973 0.849 1
1 1011 . 15 1 1 A 88 88 ILE CB C 88 37.370 37.416 -0.046 1
1 1015 . 15 1 1 A 88 88 ILE N N 88 122.929 120.470 2.459 1
1 1016 . 15 1 1 A 89 89 LEU H H 89 8.486 8.522 -0.036 1
1 1017 . 15 1 1 A 89 89 LEU HA H 89 3.932 3.917 0.015 1
1 1023 . 15 1 1 A 89 89 LEU C C 89 177.919 179.118 -1.199 1
1 1024 . 15 1 1 A 89 89 LEU CA C 89 59.060 58.261 0.799 1
1 1025 . 15 1 1 A 89 89 LEU CB C 89 41.129 41.661 -0.532 1
1 1028 . 15 1 1 A 89 89 LEU N N 89 122.696 120.499 2.197 1
1 1029 . 15 1 1 A 90 90 LYS H H 90 7.790 7.931 -0.141 1
1 1030 . 15 1 1 A 90 90 LYS HA H 90 4.061 3.962 0.099 1
1 1035 . 15 1 1 A 90 90 LYS C C 90 178.432 178.637 -0.205 1
1 1036 . 15 1 1 A 90 90 LYS CA C 90 59.840 59.173 0.667 1
1 1037 . 15 1 1 A 90 90 LYS CB C 90 32.582 32.272 0.310 1
1 1039 . 15 1 1 A 90 90 LYS N N 90 118.640 119.910 -1.270 1
1 1040 . 15 1 1 A 91 91 ALA H H 91 8.113 8.333 -0.220 1
1 1041 . 15 1 1 A 91 91 ALA HA H 91 4.151 4.087 0.064 1
1 1045 . 15 1 1 A 91 91 ALA C C 91 179.147 180.038 -0.891 1
1 1046 . 15 1 1 A 91 91 ALA CA C 91 54.942 55.243 -0.301 1
1 1047 . 15 1 1 A 91 91 ALA CB C 91 18.242 18.469 -0.227 1
1 1048 . 15 1 1 A 91 91 ALA N N 91 122.939 121.828 1.111 1
1 1049 . 15 1 1 A 92 92 SER H H 92 8.858 8.382 0.476 1
1 1050 . 15 1 1 A 92 92 SER HA H 92 4.898 4.124 0.774 1
1 1052 . 15 1 1 A 92 92 SER C C 92 172.440 176.450 -4.010 1
1 1053 . 15 1 1 A 92 92 SER CA C 92 61.913 61.465 0.448 1
1 1054 . 15 1 1 A 92 92 SER CB C 92 63.081 63.031 0.050 1
1 1055 . 15 1 1 A 92 92 SER N N 92 114.526 113.098 1.428 1
1 1056 . 15 1 1 A 93 93 ARG H H 93 7.704 8.372 -0.668 1
1 1057 . 15 1 1 A 93 93 ARG HA H 93 4.162 4.164 -0.002 1
1 1059 . 15 1 1 A 93 93 ARG C C 93 177.757 178.758 -1.001 1
1 1060 . 15 1 1 A 93 93 ARG CA C 93 59.544 58.049 1.495 1
1 1061 . 15 1 1 A 93 93 ARG CB C 93 30.343 29.283 1.060 1
1 1062 . 15 1 1 A 93 93 ARG N N 93 121.505 119.521 1.984 1
1 1063 . 15 1 1 A 94 94 LYS H H 94 7.456 7.950 -0.494 1
1 1064 . 15 1 1 A 94 94 LYS HA H 94 4.174 4.181 -0.007 1
1 1071 . 15 1 1 A 94 94 LYS C C 94 178.861 178.597 0.264 1
1 1072 . 15 1 1 A 94 94 LYS CA C 94 59.030 59.174 -0.144 1
1 1073 . 15 1 1 A 94 94 LYS CB C 94 32.239 32.352 -0.113 1
1 1077 . 15 1 1 A 94 94 LYS N N 94 119.072 119.774 -0.702 1
1 1078 . 15 1 1 A 95 95 LEU H H 95 8.148 7.741 0.407 1
1 1079 . 15 1 1 A 95 95 LEU HA H 95 4.129 4.097 0.032 1
1 1088 . 15 1 1 A 95 95 LEU C C 95 177.274 178.634 -1.360 1
1 1089 . 15 1 1 A 95 95 LEU CA C 95 57.136 57.360 -0.224 1
1 1090 . 15 1 1 A 95 95 LEU CB C 95 41.908 41.731 0.177 1
1 1093 . 15 1 1 A 95 95 LEU N N 95 119.717 120.936 -1.219 1
1 1094 . 15 1 1 A 96 96 GLN H H 96 7.807 8.189 -0.382 1
1 1095 . 15 1 1 A 96 96 GLN HA H 96 4.242 4.307 -0.065 1
1 1102 . 15 1 1 A 96 96 GLN C C 96 175.371 176.357 -0.986 1
1 1103 . 15 1 1 A 96 96 GLN CA C 96 56.397 55.592 0.805 1
1 1104 . 15 1 1 A 96 96 GLN CB C 96 29.123 28.962 0.161 1
1 1106 . 15 1 1 A 96 96 GLN N N 96 114.581 115.580 -0.999 1
1 1108 . 15 1 1 A 97 97 GLY H H 97 7.802 8.707 -0.905 1
1 1109 . 15 1 1 A 97 97 GLY HA2 H 97 3.839 3.923 -0.084 1
1 1110 . 15 1 1 A 97 97 GLY HA3 H 97 4.096 3.923 0.173 1
1 1111 . 15 1 1 A 97 97 GLY C C 97 172.636 173.405 -0.769 1
1 1112 . 15 1 1 A 97 97 GLY CA C 97 46.372 46.112 0.260 1
1 1113 . 15 1 1 A 97 97 GLY N N 97 106.959 109.882 -2.923 1
1 1114 . 15 1 1 A 98 98 ASP H H 98 8.156 7.891 0.265 1
1 1115 . 15 1 1 A 98 98 ASP HA H 98 4.754 5.085 -0.331 1
1 1118 . 15 1 1 A 98 98 ASP CA C 98 52.882 50.654 2.228 1
1 1119 . 15 1 1 A 98 98 ASP CB C 98 41.603 42.352 -0.749 1
1 1120 . 15 1 1 A 98 98 ASP N N 98 118.447 120.583 -2.136 1
1 1121 . 15 1 1 A 99 99 PRO HA H 99 4.470 4.424 0.046 1
1 1126 . 15 1 1 A 99 99 PRO C C 99 175.500 176.468 -0.968 1
1 1127 . 15 1 1 A 99 99 PRO CA C 99 63.601 65.098 -1.497 1
1 1128 . 15 1 1 A 99 99 PRO CB C 99 32.423 31.843 0.580 1
1 1130 . 15 1 1 A 100 100 ASP H H 100 8.527 7.777 0.750 1
1 1131 . 15 1 1 A 100 100 ASP HA H 100 4.778 4.802 -0.024 1
1 1134 . 15 1 1 A 100 100 ASP C C 100 174.931 174.332 0.599 1
1 1135 . 15 1 1 A 100 100 ASP CA C 100 53.915 53.668 0.247 1
1 1136 . 15 1 1 A 100 100 ASP CB C 100 40.665 41.093 -0.428 1
1 1137 . 15 1 1 A 100 100 ASP N N 100 119.340 116.613 2.727 1
1 1138 . 15 1 1 A 101 101 LEU H H 101 7.379 8.712 -1.333 1
1 1139 . 15 1 1 A 101 101 LEU HA H 101 4.682 4.817 -0.135 1
1 1148 . 15 1 1 A 101 101 LEU CA C 101 52.956 51.280 1.676 1
1 1149 . 15 1 1 A 101 101 LEU CB C 101 43.393 42.399 0.994 1
1 1152 . 15 1 1 A 101 101 LEU N N 101 122.107 125.538 -3.431 1
1 1153 . 15 1 1 A 102 102 PRO HA H 102 4.487 4.414 0.073 1
1 1158 . 15 1 1 A 102 102 PRO C C 102 175.697 175.418 0.279 1
1 1159 . 15 1 1 A 102 102 PRO CA C 102 63.113 63.310 -0.197 1
1 1160 . 15 1 1 A 102 102 PRO CB C 102 32.138 31.931 0.207 1
1 1163 . 15 1 1 A 103 103 MET H H 103 9.011 8.761 0.250 1
1 1164 . 15 1 1 A 103 103 MET HA H 103 4.769 4.865 -0.096 1
1 1171 . 15 1 1 A 103 103 MET C C 103 174.080 174.207 -0.127 1
1 1172 . 15 1 1 A 103 103 MET CA C 103 54.737 53.274 1.463 1
1 1173 . 15 1 1 A 103 103 MET CB C 103 34.857 35.037 -0.180 1
1 1176 . 15 1 1 A 103 103 MET N N 103 123.334 123.382 -0.048 1
1 1177 . 15 1 1 A 104 104 SER H H 104 8.239 8.633 -0.394 1
1 1178 . 15 1 1 A 104 104 SER HA H 104 5.079 5.272 -0.193 1
1 1181 . 15 1 1 A 104 104 SER C C 104 171.795 172.922 -1.127 1
1 1182 . 15 1 1 A 104 104 SER CA C 104 57.641 57.296 0.345 1
1 1183 . 15 1 1 A 104 104 SER CB C 104 66.282 66.504 -0.222 1
1 1184 . 15 1 1 A 104 104 SER N N 104 114.434 114.452 -0.018 1
1 1185 . 15 1 1 A 105 105 PHE H H 105 9.003 8.729 0.274 1
1 1186 . 15 1 1 A 105 105 PHE HA H 105 5.209 5.236 -0.027 1
1 1193 . 15 1 1 A 105 105 PHE C C 105 170.688 172.198 -1.510 1
1 1194 . 15 1 1 A 105 105 PHE CA C 105 56.917 55.965 0.952 1
1 1195 . 15 1 1 A 105 105 PHE CB C 105 41.350 42.061 -0.711 1
1 1196 . 15 1 1 A 105 105 PHE N N 105 116.224 117.402 -1.178 1
1 1197 . 15 1 1 A 106 106 THR H H 106 9.074 9.326 -0.252 1
1 1198 . 15 1 1 A 106 106 THR HA H 106 4.664 4.942 -0.278 1
1 1203 . 15 1 1 A 106 106 THR C C 106 171.767 174.586 -2.819 1
1 1204 . 15 1 1 A 106 106 THR CA C 106 62.162 62.125 0.037 1
1 1205 . 15 1 1 A 106 106 THR CB C 106 70.072 69.842 0.230 1
1 1207 . 15 1 1 A 106 106 THR N N 106 117.469 116.586 0.883 1
1 1208 . 15 1 1 A 107 107 LEU H H 107 9.804 9.350 0.454 1
1 1209 . 15 1 1 A 107 107 LEU HA H 107 4.750 4.746 0.004 1
1 1219 . 15 1 1 A 107 107 LEU C C 107 172.742 175.979 -3.237 1
1 1220 . 15 1 1 A 107 107 LEU CA C 107 54.151 54.903 -0.752 1
1 1221 . 15 1 1 A 107 107 LEU CB C 107 44.486 42.307 2.179 1
1 1224 . 15 1 1 A 107 107 LEU N N 107 133.400 128.702 4.698 1
1 1225 . 15 1 1 A 108 108 ALA H H 108 8.435 8.904 -0.469 1
1 1226 . 15 1 1 A 108 108 ALA HA H 108 4.683 4.513 0.170 1
1 1230 . 15 1 1 A 108 108 ALA C C 108 173.052 175.823 -2.771 1
1 1231 . 15 1 1 A 108 108 ALA CA C 108 49.308 50.765 -1.457 1
1 1232 . 15 1 1 A 108 108 ALA CB C 108 22.120 19.838 2.282 1
1 1233 . 15 1 1 A 108 108 ALA N N 108 131.422 127.745 3.677 1
1 1234 . 15 1 1 A 109 109 ILE H H 109 8.909 8.883 0.026 1
1 1235 . 15 1 1 A 109 109 ILE HA H 109 4.063 5.059 -0.996 1
1 1245 . 15 1 1 A 109 109 ILE CA C 109 60.982 60.337 0.645 1
1 1246 . 15 1 1 A 109 109 ILE CB C 109 39.074 38.633 0.441 1
1 1250 . 15 1 1 A 109 109 ILE N N 109 124.415 123.891 0.524 1
1 1251 . 15 1 1 A 110 110 VAL H H 110 8.706 8.817 -0.111 1
1 1252 . 15 1 1 A 110 110 VAL HA H 110 4.324 5.495 -1.171 1
1 1260 . 15 1 1 A 110 110 VAL C C 110 175.700 173.107 2.593 1
1 1261 . 15 1 1 A 110 110 VAL CA C 110 62.316 59.824 2.492 1
1 1262 . 15 1 1 A 110 110 VAL CB C 110 31.876 34.642 -2.766 1
1 1264 . 15 1 1 A 110 110 VAL N N 110 127.457 126.773 0.684 1
1 1265 . 15 1 1 A 111 111 GLU H H 111 9.024 8.520 0.504 1
1 1266 . 15 1 1 A 111 111 GLU HA H 111 4.403 4.597 -0.194 1
1 1269 . 15 1 1 A 111 111 GLU C C 111 175.987 177.191 -1.204 1
1 1270 . 15 1 1 A 111 111 GLU CA C 111 56.842 54.844 1.998 1
1 1271 . 15 1 1 A 111 111 GLU CB C 111 31.044 32.077 -1.033 1
1 1272 . 15 1 1 A 111 111 GLU N N 111 129.768 130.119 -0.351 1
1 1273 . 15 1 1 A 112 112 SER H H 112 9.143 8.666 0.477 1
1 1274 . 15 1 1 A 112 112 SER HA H 112 4.394 4.184 0.210 1
1 1276 . 15 1 1 A 112 112 SER C C 112 173.187 175.057 -1.870 1
1 1277 . 15 1 1 A 112 112 SER CA C 112 60.180 61.285 -1.105 1
1 1278 . 15 1 1 A 112 112 SER CB C 112 63.415 62.861 0.554 1
1 1279 . 15 1 1 A 112 112 SER N N 112 115.956 118.679 -2.723 1
1 1280 . 15 1 1 A 113 113 ASP H H 113 8.133 7.917 0.216 1
1 1281 . 15 1 1 A 113 113 ASP HA H 113 4.573 4.757 -0.184 1
1 1284 . 15 1 1 A 113 113 ASP C C 113 175.430 175.149 0.281 1
1 1285 . 15 1 1 A 113 113 ASP CA C 113 54.115 53.863 0.252 1
1 1286 . 15 1 1 A 113 113 ASP CB C 113 40.011 40.967 -0.956 1
1 1287 . 15 1 1 A 113 113 ASP N N 113 118.343 119.093 -0.750 1
1 1288 . 15 1 1 A 114 114 SER H H 114 8.034 8.013 0.021 1
1 1289 . 15 1 1 A 114 114 SER HA H 114 4.057 4.174 -0.117 1
1 1291 . 15 1 1 A 114 114 SER C C 114 172.209 173.276 -1.067 1
1 1292 . 15 1 1 A 114 114 SER CA C 114 60.179 59.713 0.466 1
1 1293 . 15 1 1 A 114 114 SER CB C 114 62.702 61.198 1.504 1
1 1294 . 15 1 1 A 114 114 SER N N 114 109.836 112.149 -2.313 1
1 1295 . 15 1 1 A 115 115 THR H H 115 7.711 7.784 -0.073 1
1 1296 . 15 1 1 A 115 115 THR HA H 115 4.250 4.407 -0.157 1
1 1300 . 15 1 1 A 115 115 THR C C 115 171.500 174.039 -2.539 1
1 1301 . 15 1 1 A 115 115 THR CA C 115 63.547 61.260 2.287 1
1 1302 . 15 1 1 A 115 115 THR CB C 115 69.595 69.054 0.541 1
1 1303 . 15 1 1 A 115 115 THR N N 115 117.407 112.973 4.434 1
1 1304 . 15 1 1 A 116 116 ILE H H 116 8.219 9.280 -1.061 1
1 1305 . 15 1 1 A 116 116 ILE HA H 116 4.769 5.125 -0.356 1
1 1315 . 15 1 1 A 116 116 ILE C C 116 174.434 175.079 -0.645 1
1 1316 . 15 1 1 A 116 116 ILE CA C 116 60.306 59.856 0.450 1
1 1317 . 15 1 1 A 116 116 ILE CB C 116 40.686 38.243 2.443 1
1 1321 . 15 1 1 A 116 116 ILE N N 116 125.480 127.722 -2.242 1
1 1322 . 15 1 1 A 117 117 VAL H H 117 8.695 9.522 -0.827 1
1 1323 . 15 1 1 A 117 117 VAL HA H 117 4.315 4.699 -0.384 1
1 1328 . 15 1 1 A 117 117 VAL C C 117 172.243 174.481 -2.238 1
1 1329 . 15 1 1 A 117 117 VAL CA C 117 60.621 60.755 -0.134 1
1 1330 . 15 1 1 A 117 117 VAL CB C 117 34.558 33.779 0.779 1
1 1332 . 15 1 1 A 117 117 VAL N N 117 127.887 127.207 0.680 1
1 1333 . 15 1 1 A 118 118 TYR H H 118 8.270 8.837 -0.567 1
1 1334 . 15 1 1 A 118 118 TYR HA H 118 5.327 5.321 0.006 1
1 1342 . 15 1 1 A 118 118 TYR C C 118 174.250 174.775 -0.525 1
1 1343 . 15 1 1 A 118 118 TYR CA C 118 57.283 56.834 0.449 1
1 1344 . 15 1 1 A 118 118 TYR CB C 118 39.262 39.762 -0.500 1
1 1345 . 15 1 1 A 118 118 TYR N N 118 124.822 126.786 -1.964 1
1 1346 . 15 1 1 A 119 119 TYR H H 119 9.207 8.920 0.287 1
1 1347 . 15 1 1 A 119 119 TYR HA H 119 4.821 5.331 -0.510 1
1 1354 . 15 1 1 A 119 119 TYR C C 119 171.994 173.564 -1.570 1
1 1355 . 15 1 1 A 119 119 TYR CA C 119 58.116 56.648 1.468 1
1 1356 . 15 1 1 A 119 119 TYR CB C 119 43.544 42.243 1.301 1
1 1357 . 15 1 1 A 119 119 TYR N N 119 125.153 123.942 1.211 1
1 1358 . 15 1 1 A 120 120 LYS H H 120 7.700 8.251 -0.551 1
1 1359 . 15 1 1 A 120 120 LYS HA H 120 4.558 4.554 0.004 1
1 1366 . 15 1 1 A 120 120 LYS C C 120 172.017 174.676 -2.659 1
1 1367 . 15 1 1 A 120 120 LYS CA C 120 57.217 55.796 1.421 1
1 1368 . 15 1 1 A 120 120 LYS CB C 120 33.914 33.236 0.678 1
1 1372 . 15 1 1 A 120 120 LYS N N 120 129.442 127.706 1.736 1
1 1373 . 15 1 1 A 121 121 LEU H H 121 8.112 8.804 -0.692 1
1 1374 . 15 1 1 A 121 121 LEU HA H 121 5.323 4.943 0.380 1
1 1384 . 15 1 1 A 121 121 LEU C C 121 175.733 174.536 1.197 1
1 1385 . 15 1 1 A 121 121 LEU CA C 121 52.716 53.327 -0.611 1
1 1386 . 15 1 1 A 121 121 LEU CB C 121 44.098 44.357 -0.259 1
1 1389 . 15 1 1 A 121 121 LEU N N 121 123.403 129.340 -5.937 1
1 1390 . 15 1 1 A 122 122 THR H H 122 8.338 9.087 -0.749 1
1 1391 . 15 1 1 A 122 122 THR HA H 122 5.097 4.675 0.422 1
1 1396 . 15 1 1 A 122 122 THR C C 122 173.221 172.946 0.275 1
1 1397 . 15 1 1 A 122 122 THR CA C 122 60.306 60.771 -0.465 1
1 1398 . 15 1 1 A 122 122 THR CB C 122 72.473 71.890 0.583 1
1 1400 . 15 1 1 A 122 122 THR N N 122 109.081 122.927 -13.846 1
1 7 . 16 1 1 A 2 2 GLU H H 2 8.994 8.629 0.365 1
1 8 . 16 1 1 A 2 2 GLU HA H 2 4.278 5.145 -0.867 1
1 13 . 16 1 1 A 2 2 GLU C C 2 175.315 174.738 0.577 1
1 14 . 16 1 1 A 2 2 GLU CA C 2 57.318 55.094 2.224 1
1 15 . 16 1 1 A 2 2 GLU CB C 2 29.221 32.889 -3.668 1
1 17 . 16 1 1 A 2 2 GLU N N 2 122.259 120.616 1.643 1
1 18 . 16 1 1 A 3 3 ASP H H 3 8.048 9.222 -1.174 1
1 19 . 16 1 1 A 3 3 ASP HA H 3 4.580 4.475 0.105 1
1 21 . 16 1 1 A 3 3 ASP C C 3 175.636 176.211 -0.575 1
1 22 . 16 1 1 A 3 3 ASP CA C 3 54.579 56.153 -1.574 1
1 23 . 16 1 1 A 3 3 ASP CB C 3 40.984 39.118 1.866 1
1 24 . 16 1 1 A 3 3 ASP N N 3 119.830 118.591 1.239 1
1 25 . 16 1 1 A 4 4 ALA H H 4 8.090 7.924 0.166 1
1 26 . 16 1 1 A 4 4 ALA HA H 4 4.216 4.175 0.041 1
1 30 . 16 1 1 A 4 4 ALA C C 4 177.157 177.685 -0.528 1
1 31 . 16 1 1 A 4 4 ALA CA C 4 53.620 52.772 0.848 1
1 32 . 16 1 1 A 4 4 ALA CB C 4 18.728 18.188 0.540 1
1 33 . 16 1 1 A 4 4 ALA N N 4 123.957 120.432 3.525 1
1 34 . 16 1 1 A 5 5 TRP H H 5 7.941 7.674 0.267 1
1 35 . 16 1 1 A 5 5 TRP HA H 5 4.559 4.540 0.019 1
1 39 . 16 1 1 A 5 5 TRP C C 5 176.072 177.884 -1.812 1
1 40 . 16 1 1 A 5 5 TRP CA C 5 57.744 59.548 -1.804 1
1 41 . 16 1 1 A 5 5 TRP CB C 5 28.906 30.033 -1.127 1
1 42 . 16 1 1 A 5 5 TRP N N 5 118.408 118.919 -0.511 1
1 44 . 16 1 1 A 6 6 MET H H 6 7.679 7.808 -0.129 1
1 45 . 16 1 1 A 6 6 MET HA H 6 3.785 4.524 -0.739 1
1 52 . 16 1 1 A 6 6 MET C C 6 175.174 177.045 -1.871 1
1 53 . 16 1 1 A 6 6 MET CA C 6 57.724 57.286 0.438 1
1 54 . 16 1 1 A 6 6 MET CB C 6 31.640 34.156 -2.516 1
1 57 . 16 1 1 A 6 6 MET N N 6 121.538 118.607 2.931 1
1 58 . 16 1 1 A 7 7 GLY H H 7 7.247 7.703 -0.456 1
1 59 . 16 1 1 A 7 7 GLY HA2 H 7 3.455 4.145 -0.690 1
1 60 . 16 1 1 A 7 7 GLY HA3 H 7 3.578 4.183 -0.605 1
1 61 . 16 1 1 A 7 7 GLY C C 7 172.852 172.952 -0.100 1
1 62 . 16 1 1 A 7 7 GLY CA C 7 45.896 45.673 0.223 1
1 63 . 16 1 1 A 7 7 GLY N N 7 104.055 104.693 -0.638 1
1 64 . 16 1 1 A 8 8 THR H H 8 7.436 8.563 -1.127 1
1 65 . 16 1 1 A 8 8 THR HA H 8 4.428 4.547 -0.119 1
1 70 . 16 1 1 A 8 8 THR C C 8 172.973 173.639 -0.666 1
1 71 . 16 1 1 A 8 8 THR CA C 8 60.751 61.963 -1.212 1
1 72 . 16 1 1 A 8 8 THR CB C 8 69.637 69.379 0.258 1
1 74 . 16 1 1 A 8 8 THR N N 8 107.669 115.158 -7.489 1
1 75 . 16 1 1 A 9 9 HIS H H 9 8.048 8.170 -0.122 1
1 76 . 16 1 1 A 9 9 HIS HA H 9 4.654 4.846 -0.192 1
1 79 . 16 1 1 A 9 9 HIS CA C 9 56.163 54.925 1.238 1
1 80 . 16 1 1 A 9 9 HIS CB C 9 32.619 31.332 1.287 1
1 81 . 16 1 1 A 9 9 HIS N N 9 127.281 121.621 5.660 1
1 82 . 16 1 1 A 10 10 PRO HA H 10 4.257 4.255 0.002 1
1 88 . 16 1 1 A 10 10 PRO C C 10 178.779 179.090 -0.311 1
1 89 . 16 1 1 A 10 10 PRO CA C 10 65.565 66.053 -0.488 1
1 90 . 16 1 1 A 10 10 PRO CB C 10 32.422 31.860 0.562 1
1 93 . 16 1 1 A 11 11 LYS H H 11 10.994 8.598 2.396 1
1 94 . 16 1 1 A 11 11 LYS HA H 11 4.282 4.143 0.139 1
1 100 . 16 1 1 A 11 11 LYS C C 11 177.279 178.647 -1.368 1
1 101 . 16 1 1 A 11 11 LYS CA C 11 56.859 59.295 -2.436 1
1 102 . 16 1 1 A 11 11 LYS CB C 11 31.279 32.181 -0.902 1
1 104 . 16 1 1 A 11 11 LYS N N 11 121.398 118.313 3.085 1
1 105 . 16 1 1 A 12 12 TYR H H 12 7.146 8.315 -1.169 1
1 106 . 16 1 1 A 12 12 TYR HA H 12 3.722 4.278 -0.556 1
1 113 . 16 1 1 A 12 12 TYR C C 12 176.265 177.329 -1.064 1
1 114 . 16 1 1 A 12 12 TYR CA C 12 61.189 61.363 -0.174 1
1 115 . 16 1 1 A 12 12 TYR CB C 12 37.796 38.395 -0.599 1
1 116 . 16 1 1 A 12 12 TYR N N 12 121.579 122.821 -1.242 1
1 117 . 16 1 1 A 13 13 LEU H H 13 7.778 9.196 -1.418 1
1 118 . 16 1 1 A 13 13 LEU HA H 13 3.773 3.812 -0.039 1
1 127 . 16 1 1 A 13 13 LEU C C 13 178.462 179.077 -0.615 1
1 128 . 16 1 1 A 13 13 LEU CA C 13 57.942 57.918 0.024 1
1 129 . 16 1 1 A 13 13 LEU CB C 13 41.064 41.285 -0.221 1
1 132 . 16 1 1 A 13 13 LEU N N 13 117.518 119.797 -2.279 1
1 133 . 16 1 1 A 14 14 GLU H H 14 7.867 8.884 -1.017 1
1 134 . 16 1 1 A 14 14 GLU HA H 14 3.935 3.938 -0.003 1
1 139 . 16 1 1 A 14 14 GLU C C 14 178.326 178.966 -0.640 1
1 140 . 16 1 1 A 14 14 GLU CA C 14 59.368 60.005 -0.637 1
1 141 . 16 1 1 A 14 14 GLU CB C 14 30.147 29.312 0.835 1
1 143 . 16 1 1 A 14 14 GLU N N 14 119.135 118.428 0.707 1
1 144 . 16 1 1 A 15 15 MET H H 15 7.773 7.671 0.102 1
1 145 . 16 1 1 A 15 15 MET HA H 15 3.936 4.140 -0.204 1
1 152 . 16 1 1 A 15 15 MET C C 15 177.886 177.887 -0.001 1
1 153 . 16 1 1 A 15 15 MET CA C 15 59.465 58.114 1.351 1
1 154 . 16 1 1 A 15 15 MET CB C 15 33.987 32.337 1.650 1
1 157 . 16 1 1 A 15 15 MET N N 15 117.884 119.741 -1.857 1
1 158 . 16 1 1 A 16 16 MET H H 16 8.145 8.383 -0.238 1
1 159 . 16 1 1 A 16 16 MET HA H 16 4.159 3.933 0.226 1
1 166 . 16 1 1 A 16 16 MET C C 16 177.835 178.600 -0.765 1
1 167 . 16 1 1 A 16 16 MET CA C 16 57.397 58.376 -0.979 1
1 168 . 16 1 1 A 16 16 MET CB C 16 31.867 32.373 -0.506 1
1 171 . 16 1 1 A 16 16 MET N N 16 119.555 117.957 1.598 1
1 172 . 16 1 1 A 17 17 GLU H H 17 7.761 7.896 -0.135 1
1 173 . 16 1 1 A 17 17 GLU HA H 17 4.117 4.261 -0.144 1
1 176 . 16 1 1 A 17 17 GLU C C 17 175.994 176.479 -0.485 1
1 177 . 16 1 1 A 17 17 GLU CA C 17 57.392 58.135 -0.743 1
1 178 . 16 1 1 A 17 17 GLU CB C 17 29.432 29.512 -0.080 1
1 180 . 16 1 1 A 17 17 GLU N N 17 118.216 117.838 0.378 1
1 181 . 16 1 1 A 18 18 LEU H H 18 7.201 7.254 -0.053 1
1 182 . 16 1 1 A 18 18 LEU HA H 18 4.111 4.316 -0.205 1
1 191 . 16 1 1 A 18 18 LEU C C 18 175.781 177.659 -1.878 1
1 192 . 16 1 1 A 18 18 LEU CA C 18 56.366 53.724 2.642 1
1 193 . 16 1 1 A 18 18 LEU CB C 18 42.030 43.674 -1.644 1
1 196 . 16 1 1 A 18 18 LEU N N 18 117.448 118.615 -1.167 1
1 197 . 16 1 1 A 19 19 ASP H H 19 7.789 8.644 -0.855 1
1 198 . 16 1 1 A 19 19 ASP HA H 19 4.360 4.332 0.028 1
1 201 . 16 1 1 A 19 19 ASP C C 19 173.765 176.143 -2.378 1
1 202 . 16 1 1 A 19 19 ASP CA C 19 54.851 56.637 -1.786 1
1 203 . 16 1 1 A 19 19 ASP CB C 19 39.115 40.696 -1.581 1
1 204 . 16 1 1 A 19 19 ASP N N 19 115.844 117.750 -1.906 1
1 205 . 16 1 1 A 20 20 ILE H H 20 8.142 7.554 0.588 1
1 206 . 16 1 1 A 20 20 ILE HA H 20 4.128 4.552 -0.424 1
1 216 . 16 1 1 A 20 20 ILE C C 20 174.710 174.864 -0.154 1
1 217 . 16 1 1 A 20 20 ILE CA C 20 60.465 59.309 1.156 1
1 218 . 16 1 1 A 20 20 ILE CB C 20 40.407 41.397 -0.990 1
1 222 . 16 1 1 A 20 20 ILE N N 20 117.287 113.045 4.242 1
1 223 . 16 1 1 A 21 21 GLY H H 21 8.207 8.536 -0.329 1
1 224 . 16 1 1 A 21 21 GLY HA2 H 21 3.889 4.079 -0.190 1
1 225 . 16 1 1 A 21 21 GLY HA3 H 21 3.924 4.090 -0.166 1
1 226 . 16 1 1 A 21 21 GLY C C 21 172.162 171.909 0.253 1
1 227 . 16 1 1 A 21 21 GLY CA C 21 45.017 45.999 -0.982 1
1 228 . 16 1 1 A 21 21 GLY N N 21 110.656 109.736 0.920 1
1 229 . 16 1 1 A 22 22 ASP H H 22 7.727 8.489 -0.762 1
1 230 . 16 1 1 A 22 22 ASP HA H 22 4.794 5.010 -0.216 1
1 233 . 16 1 1 A 22 22 ASP C C 22 174.884 176.017 -1.133 1
1 234 . 16 1 1 A 22 22 ASP CA C 22 52.471 52.635 -0.164 1
1 235 . 16 1 1 A 22 22 ASP CB C 22 42.069 42.486 -0.417 1
1 236 . 16 1 1 A 22 22 ASP N N 22 119.305 124.657 -5.352 1
1 237 . 16 1 1 A 23 23 ALA H H 23 8.644 9.052 -0.408 1
1 238 . 16 1 1 A 23 23 ALA HA H 23 4.120 4.052 0.068 1
1 242 . 16 1 1 A 23 23 ALA C C 23 179.546 179.542 0.004 1
1 243 . 16 1 1 A 23 23 ALA CA C 23 55.609 55.028 0.581 1
1 244 . 16 1 1 A 23 23 ALA CB C 23 18.573 18.556 0.017 1
1 245 . 16 1 1 A 23 23 ALA N N 23 122.468 128.324 -5.856 1
1 246 . 16 1 1 A 24 24 THR H H 24 8.238 7.493 0.745 1
1 247 . 16 1 1 A 24 24 THR HA H 24 4.184 4.076 0.108 1
1 252 . 16 1 1 A 24 24 THR C C 24 174.841 176.336 -1.495 1
1 253 . 16 1 1 A 24 24 THR CA C 24 66.241 66.244 -0.003 1
1 254 . 16 1 1 A 24 24 THR CB C 24 68.376 68.979 -0.603 1
1 256 . 16 1 1 A 24 24 THR N N 24 114.824 113.970 0.854 1
1 257 . 16 1 1 A 25 25 GLN H H 25 8.037 9.003 -0.966 1
1 258 . 16 1 1 A 25 25 GLN HA H 25 4.095 3.996 0.099 1
1 265 . 16 1 1 A 25 25 GLN C C 25 177.603 178.230 -0.627 1
1 266 . 16 1 1 A 25 25 GLN CA C 25 59.261 58.961 0.300 1
1 267 . 16 1 1 A 25 25 GLN CB C 25 28.437 28.454 -0.017 1
1 269 . 16 1 1 A 25 25 GLN N N 25 122.518 121.962 0.556 1
1 271 . 16 1 1 A 26 26 VAL H H 26 7.994 7.907 0.087 1
1 272 . 16 1 1 A 26 26 VAL HA H 26 3.469 3.791 -0.322 1
1 280 . 16 1 1 A 26 26 VAL C C 26 175.552 177.817 -2.265 1
1 281 . 16 1 1 A 26 26 VAL CA C 26 66.909 65.772 1.137 1
1 282 . 16 1 1 A 26 26 VAL CB C 26 31.582 31.353 0.229 1
1 285 . 16 1 1 A 26 26 VAL N N 26 119.112 118.958 0.154 1
1 286 . 16 1 1 A 27 27 TYR H H 27 8.003 8.168 -0.165 1
1 287 . 16 1 1 A 27 27 TYR HA H 27 4.357 4.395 -0.038 1
1 294 . 16 1 1 A 27 27 TYR C C 27 175.856 177.140 -1.284 1
1 295 . 16 1 1 A 27 27 TYR CA C 27 62.197 61.611 0.586 1
1 296 . 16 1 1 A 27 27 TYR CB C 27 38.394 38.934 -0.540 1
1 297 . 16 1 1 A 27 27 TYR N N 27 119.170 124.621 -5.451 1
1 298 . 16 1 1 A 28 28 VAL H H 28 8.087 8.370 -0.283 1
1 299 . 16 1 1 A 28 28 VAL HA H 28 3.652 3.383 0.269 1
1 307 . 16 1 1 A 28 28 VAL C C 28 176.134 178.065 -1.931 1
1 308 . 16 1 1 A 28 28 VAL CA C 28 66.247 66.324 -0.077 1
1 309 . 16 1 1 A 28 28 VAL CB C 28 31.241 31.518 -0.277 1
1 312 . 16 1 1 A 28 28 VAL N N 28 113.112 119.274 -6.162 1
1 313 . 16 1 1 A 29 29 ALA H H 29 7.853 8.763 -0.910 1
1 314 . 16 1 1 A 29 29 ALA HA H 29 3.913 4.041 -0.128 1
1 318 . 16 1 1 A 29 29 ALA C C 29 177.850 179.377 -1.527 1
1 319 . 16 1 1 A 29 29 ALA CA C 29 55.274 54.864 0.410 1
1 320 . 16 1 1 A 29 29 ALA CB C 29 17.876 17.981 -0.105 1
1 321 . 16 1 1 A 29 29 ALA N N 29 121.350 122.993 -1.643 1
1 322 . 16 1 1 A 30 30 PHE H H 30 8.724 8.463 0.261 1
1 323 . 16 1 1 A 30 30 PHE HA H 30 4.098 4.268 -0.170 1
1 327 . 16 1 1 A 30 30 PHE C C 30 175.035 177.184 -2.149 1
1 328 . 16 1 1 A 30 30 PHE CA C 30 61.264 61.567 -0.303 1
1 329 . 16 1 1 A 30 30 PHE CB C 30 38.926 39.389 -0.463 1
1 330 . 16 1 1 A 30 30 PHE N N 30 120.478 120.001 0.477 1
1 331 . 16 1 1 A 31 31 LEU H H 31 8.146 8.118 0.028 1
1 332 . 16 1 1 A 31 31 LEU HA H 31 3.597 3.536 0.061 1
1 341 . 16 1 1 A 31 31 LEU C C 31 179.508 179.280 0.228 1
1 342 . 16 1 1 A 31 31 LEU CA C 31 57.884 58.067 -0.183 1
1 343 . 16 1 1 A 31 31 LEU CB C 31 41.829 42.069 -0.240 1
1 346 . 16 1 1 A 31 31 LEU N N 31 118.427 120.241 -1.814 1
1 347 . 16 1 1 A 32 32 VAL H H 32 7.627 7.691 -0.064 1
1 348 . 16 1 1 A 32 32 VAL HA H 32 3.464 3.827 -0.363 1
1 356 . 16 1 1 A 32 32 VAL C C 32 174.956 177.714 -2.758 1
1 357 . 16 1 1 A 32 32 VAL CA C 32 66.373 65.674 0.699 1
1 358 . 16 1 1 A 32 32 VAL CB C 32 31.121 31.479 -0.358 1
1 361 . 16 1 1 A 32 32 VAL N N 32 119.497 114.638 4.859 1
1 362 . 16 1 1 A 33 33 TYR H H 33 8.366 8.697 -0.331 1
1 363 . 16 1 1 A 33 33 TYR HA H 33 3.485 4.093 -0.608 1
1 370 . 16 1 1 A 33 33 TYR C C 33 174.883 176.921 -2.038 1
1 371 . 16 1 1 A 33 33 TYR CA C 33 62.866 61.518 1.348 1
1 372 . 16 1 1 A 33 33 TYR CB C 33 37.778 38.321 -0.543 1
1 373 . 16 1 1 A 33 33 TYR N N 33 121.842 124.306 -2.464 1
1 374 . 16 1 1 A 34 34 LEU H H 34 8.000 8.414 -0.414 1
1 375 . 16 1 1 A 34 34 LEU HA H 34 3.495 3.702 -0.207 1
1 385 . 16 1 1 A 34 34 LEU C C 34 178.240 179.131 -0.891 1
1 386 . 16 1 1 A 34 34 LEU CA C 34 57.453 57.296 0.157 1
1 387 . 16 1 1 A 34 34 LEU CB C 34 41.828 41.026 0.802 1
1 390 . 16 1 1 A 34 34 LEU N N 34 116.692 119.566 -2.874 1
1 391 . 16 1 1 A 35 35 ASP H H 35 7.688 7.911 -0.223 1
1 392 . 16 1 1 A 35 35 ASP HA H 35 4.302 4.312 -0.010 1
1 395 . 16 1 1 A 35 35 ASP C C 35 177.507 178.400 -0.893 1
1 396 . 16 1 1 A 35 35 ASP CA C 35 58.196 57.583 0.613 1
1 397 . 16 1 1 A 35 35 ASP CB C 35 43.070 41.158 1.912 1
1 398 . 16 1 1 A 35 35 ASP N N 35 120.507 120.021 0.486 1
1 399 . 16 1 1 A 36 36 LEU H H 36 8.482 8.647 -0.165 1
1 400 . 16 1 1 A 36 36 LEU HA H 36 3.328 3.883 -0.555 1
1 410 . 16 1 1 A 36 36 LEU C C 36 176.774 179.272 -2.498 1
1 411 . 16 1 1 A 36 36 LEU CA C 36 57.461 57.927 -0.466 1
1 412 . 16 1 1 A 36 36 LEU CB C 36 41.344 41.453 -0.109 1
1 416 . 16 1 1 A 36 36 LEU N N 36 117.671 119.976 -2.305 1
1 417 . 16 1 1 A 37 37 MET H H 37 7.822 7.885 -0.063 1
1 418 . 16 1 1 A 37 37 MET HA H 37 4.401 4.113 0.288 1
1 425 . 16 1 1 A 37 37 MET C C 37 177.862 177.742 0.120 1
1 426 . 16 1 1 A 37 37 MET CA C 37 56.434 57.793 -1.359 1
1 427 . 16 1 1 A 37 37 MET CB C 37 31.573 32.119 -0.546 1
1 430 . 16 1 1 A 37 37 MET N N 37 112.952 118.231 -5.279 1
1 431 . 16 1 1 A 38 38 GLU H H 38 8.667 8.001 0.666 1
1 432 . 16 1 1 A 38 38 GLU HA H 38 4.457 4.339 0.118 1
1 436 . 16 1 1 A 38 38 GLU C C 38 176.582 177.010 -0.428 1
1 437 . 16 1 1 A 38 38 GLU CA C 38 57.659 57.104 0.555 1
1 438 . 16 1 1 A 38 38 GLU CB C 38 29.936 30.377 -0.441 1
1 440 . 16 1 1 A 38 38 GLU N N 38 116.463 117.882 -1.419 1
1 441 . 16 1 1 A 39 39 SER H H 39 7.657 8.477 -0.820 1
1 442 . 16 1 1 A 39 39 SER HA H 39 4.658 4.626 0.032 1
1 445 . 16 1 1 A 39 39 SER C C 39 175.661 176.092 -0.431 1
1 446 . 16 1 1 A 39 39 SER CA C 39 60.449 59.556 0.893 1
1 447 . 16 1 1 A 39 39 SER CB C 39 63.341 64.483 -1.142 1
1 448 . 16 1 1 A 39 39 SER N N 39 113.870 115.199 -1.329 1
1 449 . 16 1 1 A 40 40 LYS H H 40 8.165 8.102 0.063 1
1 450 . 16 1 1 A 40 40 LYS HA H 40 4.454 3.850 0.604 1
1 458 . 16 1 1 A 40 40 LYS C C 40 174.970 175.748 -0.778 1
1 459 . 16 1 1 A 40 40 LYS CA C 40 55.753 58.280 -2.527 1
1 460 . 16 1 1 A 40 40 LYS CB C 40 32.337 32.574 -0.237 1
1 464 . 16 1 1 A 40 40 LYS N N 40 116.671 122.236 -5.565 1
1 465 . 16 1 1 A 41 41 SER H H 41 7.017 7.862 -0.845 1
1 466 . 16 1 1 A 41 41 SER HA H 41 4.209 4.336 -0.127 1
1 469 . 16 1 1 A 41 41 SER C C 41 173.770 173.105 0.665 1
1 470 . 16 1 1 A 41 41 SER CA C 41 58.435 58.883 -0.448 1
1 471 . 16 1 1 A 41 41 SER CB C 41 61.700 61.397 0.303 1
1 472 . 16 1 1 A 41 41 SER N N 41 109.989 113.790 -3.801 1
1 473 . 16 1 1 A 42 42 TRP H H 42 8.876 7.831 1.045 1
1 474 . 16 1 1 A 42 42 TRP HA H 42 4.698 4.896 -0.198 1
1 478 . 16 1 1 A 42 42 TRP C C 42 174.477 177.242 -2.765 1
1 479 . 16 1 1 A 42 42 TRP CA C 42 59.443 57.040 2.403 1
1 480 . 16 1 1 A 42 42 TRP CB C 42 28.203 31.646 -3.443 1
1 481 . 16 1 1 A 42 42 TRP N N 42 121.116 123.030 -1.914 1
1 483 . 16 1 1 A 43 43 HIS H H 43 8.132 9.054 -0.922 1
1 484 . 16 1 1 A 43 43 HIS HA H 43 4.445 4.411 0.034 1
1 488 . 16 1 1 A 43 43 HIS C C 43 174.405 174.478 -0.073 1
1 489 . 16 1 1 A 43 43 HIS CA C 43 58.556 59.451 -0.895 1
1 490 . 16 1 1 A 43 43 HIS CB C 43 29.430 30.370 -0.940 1
1 491 . 16 1 1 A 43 43 HIS N N 43 119.397 122.445 -3.048 1
1 492 . 16 1 1 A 44 44 GLU H H 44 8.140 7.534 0.606 1
1 493 . 16 1 1 A 44 44 GLU HA H 44 4.432 4.643 -0.211 1
1 497 . 16 1 1 A 44 44 GLU C C 44 173.010 174.367 -1.357 1
1 498 . 16 1 1 A 44 44 GLU CA C 44 56.421 55.787 0.634 1
1 499 . 16 1 1 A 44 44 GLU CB C 44 33.285 32.883 0.402 1
1 501 . 16 1 1 A 44 44 GLU N N 44 116.181 117.873 -1.692 1
1 502 . 16 1 1 A 45 45 VAL H H 45 8.428 8.792 -0.364 1
1 503 . 16 1 1 A 45 45 VAL HA H 45 4.492 4.949 -0.457 1
1 511 . 16 1 1 A 45 45 VAL C C 45 172.339 174.662 -2.323 1
1 512 . 16 1 1 A 45 45 VAL CA C 45 63.071 60.776 2.295 1
1 513 . 16 1 1 A 45 45 VAL CB C 45 35.145 35.018 0.127 1
1 516 . 16 1 1 A 45 45 VAL N N 45 123.272 126.301 -3.029 1
1 517 . 16 1 1 A 46 46 ASN H H 46 9.050 8.899 0.151 1
1 518 . 16 1 1 A 46 46 ASN HA H 46 5.261 5.472 -0.211 1
1 523 . 16 1 1 A 46 46 ASN C C 46 172.845 173.632 -0.787 1
1 524 . 16 1 1 A 46 46 ASN CA C 46 51.895 51.856 0.039 1
1 525 . 16 1 1 A 46 46 ASN CB C 46 42.322 42.300 0.022 1
1 526 . 16 1 1 A 46 46 ASN N N 46 123.901 124.313 -0.412 1
1 528 . 16 1 1 A 47 47 CYS H H 47 9.039 8.958 0.081 1
1 529 . 16 1 1 A 47 47 CYS HA H 47 5.160 5.382 -0.222 1
1 532 . 16 1 1 A 47 47 CYS C C 47 172.454 173.785 -1.331 1
1 533 . 16 1 1 A 47 47 CYS CA C 47 56.473 57.245 -0.772 1
1 534 . 16 1 1 A 47 47 CYS CB C 47 29.297 29.209 0.088 1
1 535 . 16 1 1 A 47 47 CYS N N 47 119.663 119.218 0.445 1
1 536 . 16 1 1 A 48 48 VAL H H 48 9.083 8.856 0.227 1
1 537 . 16 1 1 A 48 48 VAL HA H 48 4.344 4.690 -0.346 1
1 542 . 16 1 1 A 48 48 VAL C C 48 173.307 174.916 -1.609 1
1 543 . 16 1 1 A 48 48 VAL CA C 48 61.368 60.762 0.606 1
1 544 . 16 1 1 A 48 48 VAL CB C 48 35.345 34.910 0.435 1
1 546 . 16 1 1 A 48 48 VAL N N 48 124.672 124.982 -0.310 1
1 547 . 16 1 1 A 49 49 GLY H H 49 9.019 9.069 -0.050 1
1 548 . 16 1 1 A 49 49 GLY HA2 H 49 3.460 4.199 -0.739 1
1 549 . 16 1 1 A 49 49 GLY HA3 H 49 4.539 4.200 0.339 1
1 550 . 16 1 1 A 49 49 GLY C C 49 171.278 171.981 -0.703 1
1 551 . 16 1 1 A 49 49 GLY CA C 49 45.075 44.460 0.615 1
1 552 . 16 1 1 A 49 49 GLY N N 49 113.131 115.937 -2.806 1
1 553 . 16 1 1 A 50 50 LEU H H 50 8.747 9.395 -0.648 1
1 554 . 16 1 1 A 50 50 LEU HA H 50 5.102 4.954 0.148 1
1 564 . 16 1 1 A 50 50 LEU CA C 50 51.417 51.292 0.125 1
1 565 . 16 1 1 A 50 50 LEU CB C 50 41.754 42.670 -0.916 1
1 569 . 16 1 1 A 50 50 LEU N N 50 124.471 126.389 -1.918 1
1 570 . 16 1 1 A 51 51 PRO HA H 51 4.106 4.261 -0.155 1
1 577 . 16 1 1 A 51 51 PRO C C 51 178.422 177.894 0.528 1
1 578 . 16 1 1 A 51 51 PRO CA C 51 65.680 64.939 0.741 1
1 579 . 16 1 1 A 51 51 PRO CB C 51 31.939 32.109 -0.170 1
1 582 . 16 1 1 A 52 52 GLU H H 52 9.721 8.341 1.380 1
1 583 . 16 1 1 A 52 52 GLU HA H 52 4.176 4.112 0.064 1
1 588 . 16 1 1 A 52 52 GLU C C 52 176.146 177.980 -1.834 1
1 589 . 16 1 1 A 52 52 GLU CA C 52 59.158 59.526 -0.368 1
1 590 . 16 1 1 A 52 52 GLU CB C 52 28.442 29.587 -1.145 1
1 592 . 16 1 1 A 52 52 GLU N N 52 118.552 118.124 0.428 1
1 593 . 16 1 1 A 53 53 LEU H H 53 7.089 7.767 -0.678 1
1 594 . 16 1 1 A 53 53 LEU HA H 53 4.511 4.495 0.016 1
1 603 . 16 1 1 A 53 53 LEU C C 53 174.027 176.286 -2.259 1
1 604 . 16 1 1 A 53 53 LEU CA C 53 53.825 54.595 -0.770 1
1 605 . 16 1 1 A 53 53 LEU CB C 53 43.825 42.896 0.929 1
1 608 . 16 1 1 A 53 53 LEU N N 53 116.763 119.814 -3.051 1
1 609 . 16 1 1 A 54 54 GLN H H 54 7.964 7.703 0.261 1
1 610 . 16 1 1 A 54 54 GLN HA H 54 3.591 3.853 -0.262 1
1 616 . 16 1 1 A 54 54 GLN C C 54 172.604 174.287 -1.683 1
1 617 . 16 1 1 A 54 54 GLN CA C 54 56.961 56.983 -0.022 1
1 618 . 16 1 1 A 54 54 GLN CB C 54 26.545 26.078 0.467 1
1 620 . 16 1 1 A 54 54 GLN N N 54 115.489 116.902 -1.413 1
1 622 . 16 1 1 A 55 55 LEU H H 55 7.139 7.327 -0.188 1
1 623 . 16 1 1 A 55 55 LEU HA H 55 4.750 5.086 -0.336 1
1 629 . 16 1 1 A 55 55 LEU C C 55 173.475 175.674 -2.199 1
1 630 . 16 1 1 A 55 55 LEU CA C 55 53.698 52.699 0.999 1
1 631 . 16 1 1 A 55 55 LEU CB C 55 47.859 45.856 2.003 1
1 633 . 16 1 1 A 55 55 LEU N N 55 116.422 114.474 1.948 1
1 634 . 16 1 1 A 56 56 ILE H H 56 8.223 8.635 -0.412 1
1 635 . 16 1 1 A 56 56 ILE HA H 56 4.540 5.508 -0.968 1
1 643 . 16 1 1 A 56 56 ILE C C 56 173.938 174.759 -0.821 1
1 644 . 16 1 1 A 56 56 ILE CA C 56 61.020 59.618 1.402 1
1 645 . 16 1 1 A 56 56 ILE CB C 56 39.403 40.817 -1.414 1
1 648 . 16 1 1 A 56 56 ILE N N 56 122.792 120.852 1.940 1
1 649 . 16 1 1 A 57 57 CYS H H 57 8.995 8.957 0.038 1
1 650 . 16 1 1 A 57 57 CYS HA H 57 5.036 5.130 -0.094 1
1 653 . 16 1 1 A 57 57 CYS C C 57 170.483 173.255 -2.772 1
1 654 . 16 1 1 A 57 57 CYS CA C 57 56.484 57.873 -1.389 1
1 655 . 16 1 1 A 57 57 CYS CB C 57 30.545 32.029 -1.484 1
1 656 . 16 1 1 A 57 57 CYS N N 57 121.575 124.666 -3.091 1
1 657 . 16 1 1 A 58 58 LEU H H 58 9.076 9.087 -0.011 1
1 658 . 16 1 1 A 58 58 LEU HA H 58 5.472 5.774 -0.302 1
1 668 . 16 1 1 A 58 58 LEU C C 58 174.009 175.937 -1.928 1
1 669 . 16 1 1 A 58 58 LEU CA C 58 52.851 53.745 -0.894 1
1 670 . 16 1 1 A 58 58 LEU CB C 58 42.177 42.951 -0.774 1
1 674 . 16 1 1 A 58 58 LEU N N 58 121.895 124.186 -2.291 1
1 675 . 16 1 1 A 59 59 VAL H H 59 8.966 8.586 0.380 1
1 676 . 16 1 1 A 59 59 VAL HA H 59 5.488 5.098 0.390 1
1 681 . 16 1 1 A 59 59 VAL C C 59 176.034 175.701 0.333 1
1 682 . 16 1 1 A 59 59 VAL CA C 59 59.820 60.685 -0.865 1
1 683 . 16 1 1 A 59 59 VAL CB C 59 34.786 35.041 -0.255 1
1 685 . 16 1 1 A 59 59 VAL N N 59 121.702 124.311 -2.609 1
1 686 . 16 1 1 A 60 60 GLY H H 60 9.258 7.735 1.523 1
1 687 . 16 1 1 A 60 60 GLY HA2 H 60 4.673 4.333 0.340 1
1 688 . 16 1 1 A 60 60 GLY HA3 H 60 4.804 4.340 0.464 1
1 689 . 16 1 1 A 60 60 GLY C C 60 169.831 172.384 -2.553 1
1 690 . 16 1 1 A 60 60 GLY CA C 60 46.399 46.300 0.099 1
1 691 . 16 1 1 A 60 60 GLY N N 60 114.126 112.275 1.851 1
1 692 . 16 1 1 A 61 61 THR H H 61 8.834 8.220 0.614 1
1 693 . 16 1 1 A 61 61 THR HA H 61 4.418 5.490 -1.072 1
1 698 . 16 1 1 A 61 61 THR C C 61 171.985 174.975 -2.990 1
1 699 . 16 1 1 A 61 61 THR CA C 61 60.634 60.523 0.111 1
1 700 . 16 1 1 A 61 61 THR CB C 61 70.983 70.489 0.494 1
1 702 . 16 1 1 A 61 61 THR N N 61 114.856 113.255 1.601 1
1 703 . 16 1 1 A 62 62 GLU H H 62 8.502 8.626 -0.124 1
1 704 . 16 1 1 A 62 62 GLU HA H 62 2.867 3.813 -0.946 1
1 709 . 16 1 1 A 62 62 GLU C C 62 174.650 176.105 -1.455 1
1 710 . 16 1 1 A 62 62 GLU CA C 62 58.785 58.213 0.572 1
1 711 . 16 1 1 A 62 62 GLU CB C 62 28.981 28.126 0.855 1
1 713 . 16 1 1 A 62 62 GLU N N 62 129.915 122.735 7.180 1
1 714 . 16 1 1 A 63 63 ILE H H 63 6.928 7.880 -0.952 1
1 715 . 16 1 1 A 63 63 ILE HA H 63 4.038 4.469 -0.431 1
1 725 . 16 1 1 A 63 63 ILE C C 63 173.482 175.122 -1.640 1
1 726 . 16 1 1 A 63 63 ILE CA C 63 58.664 59.715 -1.051 1
1 727 . 16 1 1 A 63 63 ILE CB C 63 40.009 41.274 -1.265 1
1 731 . 16 1 1 A 63 63 ILE N N 63 117.075 118.855 -1.780 1
1 732 . 16 1 1 A 64 64 GLU H H 64 8.585 8.240 0.345 1
1 733 . 16 1 1 A 64 64 GLU HA H 64 3.427 3.486 -0.059 1
1 738 . 16 1 1 A 64 64 GLU C C 64 175.186 177.086 -1.900 1
1 739 . 16 1 1 A 64 64 GLU CA C 64 58.703 57.994 0.709 1
1 740 . 16 1 1 A 64 64 GLU CB C 64 28.999 28.885 0.114 1
1 742 . 16 1 1 A 64 64 GLU N N 64 126.422 126.328 0.094 1
1 743 . 16 1 1 A 65 65 GLY H H 65 8.754 8.756 -0.002 1
1 744 . 16 1 1 A 65 65 GLY HA2 H 65 3.631 3.942 -0.311 1
1 745 . 16 1 1 A 65 65 GLY HA3 H 65 4.287 3.956 0.331 1
1 746 . 16 1 1 A 65 65 GLY C C 65 174.005 174.883 -0.878 1
1 747 . 16 1 1 A 65 65 GLY CA C 65 44.954 45.011 -0.057 1
1 748 . 16 1 1 A 65 65 GLY N N 65 114.614 115.558 -0.944 1
1 749 . 16 1 1 A 66 66 GLU H H 66 7.760 7.885 -0.125 1
1 750 . 16 1 1 A 66 66 GLU HA H 66 4.462 4.501 -0.039 1
1 754 . 16 1 1 A 66 66 GLU C C 66 175.255 175.682 -0.427 1
1 755 . 16 1 1 A 66 66 GLU CA C 66 55.582 55.935 -0.353 1
1 756 . 16 1 1 A 66 66 GLU CB C 66 30.654 31.660 -1.006 1
1 758 . 16 1 1 A 66 66 GLU N N 66 119.292 120.393 -1.101 1
1 759 . 16 1 1 A 67 67 GLY H H 67 8.262 8.299 -0.037 1
1 760 . 16 1 1 A 67 67 GLY HA2 H 67 3.875 4.094 -0.219 1
1 761 . 16 1 1 A 67 67 GLY HA3 H 67 4.088 4.097 -0.009 1
1 762 . 16 1 1 A 67 67 GLY C C 67 172.197 173.499 -1.302 1
1 763 . 16 1 1 A 67 67 GLY CA C 67 44.845 45.488 -0.643 1
1 764 . 16 1 1 A 67 67 GLY N N 67 106.161 108.552 -2.391 1
1 765 . 16 1 1 A 68 68 LEU H H 68 8.142 7.633 0.509 1
1 766 . 16 1 1 A 68 68 LEU HA H 68 4.491 4.843 -0.352 1
1 775 . 16 1 1 A 68 68 LEU C C 68 176.194 174.970 1.224 1
1 776 . 16 1 1 A 68 68 LEU CA C 68 55.123 54.266 0.857 1
1 777 . 16 1 1 A 68 68 LEU CB C 68 44.527 43.445 1.082 1
1 780 . 16 1 1 A 68 68 LEU N N 68 120.269 121.693 -1.424 1
1 781 . 16 1 1 A 69 69 GLN H H 69 9.253 8.329 0.924 1
1 782 . 16 1 1 A 69 69 GLN HA H 69 4.770 5.159 -0.389 1
1 788 . 16 1 1 A 69 69 GLN C C 69 173.607 173.890 -0.283 1
1 789 . 16 1 1 A 69 69 GLN CA C 69 54.736 54.773 -0.037 1
1 790 . 16 1 1 A 69 69 GLN CB C 69 33.782 31.721 2.061 1
1 792 . 16 1 1 A 69 69 GLN N N 69 119.336 120.916 -1.580 1
1 794 . 16 1 1 A 70 70 THR H H 70 8.803 8.932 -0.129 1
1 795 . 16 1 1 A 70 70 THR HA H 70 5.033 5.151 -0.118 1
1 800 . 16 1 1 A 70 70 THR C C 70 172.596 173.919 -1.323 1
1 801 . 16 1 1 A 70 70 THR CA C 70 62.768 61.734 1.034 1
1 802 . 16 1 1 A 70 70 THR CB C 70 69.990 71.470 -1.480 1
1 804 . 16 1 1 A 70 70 THR N N 70 118.372 118.287 0.085 1
1 805 . 16 1 1 A 71 71 VAL H H 71 9.882 9.239 0.643 1
1 806 . 16 1 1 A 71 71 VAL HA H 71 5.239 5.576 -0.337 1
1 811 . 16 1 1 A 71 71 VAL C C 71 174.015 174.574 -0.559 1
1 812 . 16 1 1 A 71 71 VAL CA C 71 60.577 59.756 0.821 1
1 813 . 16 1 1 A 71 71 VAL CB C 71 34.149 34.352 -0.203 1
1 815 . 16 1 1 A 71 71 VAL N N 71 129.063 122.230 6.833 1
1 816 . 16 1 1 A 72 72 VAL H H 72 9.491 8.627 0.864 1
1 817 . 16 1 1 A 72 72 VAL HA H 72 4.672 4.740 -0.068 1
1 825 . 16 1 1 A 72 72 VAL CA C 72 59.568 58.088 1.480 1
1 826 . 16 1 1 A 72 72 VAL CB C 72 34.057 34.811 -0.754 1
1 829 . 16 1 1 A 72 72 VAL N N 72 128.521 124.793 3.728 1
1 830 . 16 1 1 A 73 73 PRO HA H 73 5.368 4.715 0.653 1
1 836 . 16 1 1 A 73 73 PRO C C 73 175.079 176.149 -1.070 1
1 837 . 16 1 1 A 73 73 PRO CA C 73 61.324 63.028 -1.704 1
1 838 . 16 1 1 A 73 73 PRO CB C 73 33.089 32.103 0.986 1
1 841 . 16 1 1 A 74 74 THR H H 74 9.103 8.923 0.180 1
1 842 . 16 1 1 A 74 74 THR HA H 74 5.191 4.811 0.380 1
1 847 . 16 1 1 A 74 74 THR CA C 74 57.986 59.400 -1.414 1
1 848 . 16 1 1 A 74 74 THR CB C 74 72.212 72.612 -0.400 1
1 850 . 16 1 1 A 74 74 THR N N 74 118.075 118.315 -0.240 1
1 851 . 16 1 1 A 75 75 PRO HA H 75 5.015 4.717 0.298 1
1 858 . 16 1 1 A 75 75 PRO C C 75 178.704 177.498 1.206 1
1 859 . 16 1 1 A 75 75 PRO CA C 75 63.038 62.158 0.880 1
1 860 . 16 1 1 A 75 75 PRO CB C 75 32.529 32.960 -0.431 1
1 863 . 16 1 1 A 76 76 ILE H H 76 8.221 8.117 0.104 1
1 864 . 16 1 1 A 76 76 ILE HA H 76 4.218 3.776 0.442 1
1 873 . 16 1 1 A 76 76 ILE C C 76 172.375 176.830 -4.455 1
1 874 . 16 1 1 A 76 76 ILE CA C 76 63.509 64.174 -0.665 1
1 875 . 16 1 1 A 76 76 ILE CB C 76 39.322 38.000 1.322 1
1 879 . 16 1 1 A 76 76 ILE N N 76 122.273 122.299 -0.026 1
1 880 . 16 1 1 A 77 77 THR H H 77 6.984 7.448 -0.464 1
1 881 . 16 1 1 A 77 77 THR HA H 77 4.227 4.624 -0.397 1
1 886 . 16 1 1 A 77 77 THR C C 77 173.531 173.982 -0.451 1
1 887 . 16 1 1 A 77 77 THR CA C 77 61.435 60.882 0.553 1
1 888 . 16 1 1 A 77 77 THR CB C 77 68.944 69.403 -0.459 1
1 890 . 16 1 1 A 77 77 THR N N 77 105.803 107.077 -1.274 1
1 891 . 16 1 1 A 78 78 ALA H H 78 7.647 7.267 0.380 1
1 892 . 16 1 1 A 78 78 ALA HA H 78 4.757 4.463 0.294 1
1 896 . 16 1 1 A 78 78 ALA C C 78 173.520 176.833 -3.313 1
1 897 . 16 1 1 A 78 78 ALA CA C 78 51.164 51.789 -0.625 1
1 898 . 16 1 1 A 78 78 ALA CB C 78 20.011 21.148 -1.137 1
1 899 . 16 1 1 A 78 78 ALA N N 78 126.635 125.401 1.234 1
1 900 . 16 1 1 A 79 79 SER H H 79 7.884 8.785 -0.901 1
1 901 . 16 1 1 A 79 79 SER HA H 79 4.386 5.423 -1.037 1
1 903 . 16 1 1 A 79 79 SER C C 79 176.077 172.785 3.292 1
1 904 . 16 1 1 A 79 79 SER CA C 79 57.465 56.574 0.891 1
1 905 . 16 1 1 A 79 79 SER CB C 79 65.285 64.993 0.292 1
1 906 . 16 1 1 A 79 79 SER N N 79 115.272 112.999 2.273 1
1 907 . 16 1 1 A 80 80 LEU H H 80 7.700 8.777 -1.077 1
1 908 . 16 1 1 A 80 80 LEU HA H 80 4.912 4.635 0.277 1
1 915 . 16 1 1 A 80 80 LEU C C 80 173.927 175.178 -1.251 1
1 916 . 16 1 1 A 80 80 LEU CA C 80 53.829 54.963 -1.134 1
1 917 . 16 1 1 A 80 80 LEU CB C 80 45.990 43.499 2.491 1
1 920 . 16 1 1 A 80 80 LEU N N 80 121.507 127.629 -6.122 1
1 921 . 16 1 1 A 81 81 SER H H 81 7.885 8.755 -0.870 1
1 922 . 16 1 1 A 81 81 SER HA H 81 5.269 4.810 0.459 1
1 925 . 16 1 1 A 81 81 SER C C 81 175.756 174.948 0.808 1
1 926 . 16 1 1 A 81 81 SER CA C 81 55.507 57.132 -1.625 1
1 927 . 16 1 1 A 81 81 SER CB C 81 65.966 65.876 0.090 1
1 928 . 16 1 1 A 81 81 SER N N 81 118.323 116.649 1.674 1
1 929 . 16 1 1 A 82 82 HIS H H 82 8.935 8.786 0.149 1
1 930 . 16 1 1 A 82 82 HIS HA H 82 4.407 4.401 0.006 1
1 932 . 16 1 1 A 82 82 HIS C C 82 176.550 176.729 -0.179 1
1 933 . 16 1 1 A 82 82 HIS CA C 82 60.960 58.568 2.392 1
1 934 . 16 1 1 A 82 82 HIS CB C 82 30.755 29.171 1.584 1
1 935 . 16 1 1 A 82 82 HIS N N 82 124.042 118.550 5.492 1
1 936 . 16 1 1 A 83 83 ASN H H 83 8.435 7.895 0.540 1
1 937 . 16 1 1 A 83 83 ASN HA H 83 4.439 4.452 -0.013 1
1 941 . 16 1 1 A 83 83 ASN C C 83 174.769 178.032 -3.263 1
1 942 . 16 1 1 A 83 83 ASN CA C 83 56.575 56.062 0.513 1
1 943 . 16 1 1 A 83 83 ASN CB C 83 38.731 38.200 0.531 1
1 944 . 16 1 1 A 83 83 ASN N N 83 118.543 119.411 -0.868 1
1 946 . 16 1 1 A 84 84 ARG H H 84 7.716 8.264 -0.548 1
1 947 . 16 1 1 A 84 84 ARG HA H 84 4.183 4.125 0.058 1
1 953 . 16 1 1 A 84 84 ARG C C 84 177.399 178.403 -1.004 1
1 954 . 16 1 1 A 84 84 ARG CA C 84 59.045 59.334 -0.289 1
1 955 . 16 1 1 A 84 84 ARG CB C 84 29.992 29.919 0.073 1
1 957 . 16 1 1 A 84 84 ARG N N 84 121.312 120.608 0.704 1
1 958 . 16 1 1 A 85 85 ILE H H 85 8.354 8.171 0.183 1
1 959 . 16 1 1 A 85 85 ILE HA H 85 3.650 4.412 -0.762 1
1 967 . 16 1 1 A 85 85 ILE C C 85 176.098 178.091 -1.993 1
1 968 . 16 1 1 A 85 85 ILE CA C 85 66.704 63.687 3.017 1
1 969 . 16 1 1 A 85 85 ILE CB C 85 38.017 37.597 0.420 1
1 972 . 16 1 1 A 85 85 ILE N N 85 119.321 120.215 -0.894 1
1 973 . 16 1 1 A 86 86 ARG H H 86 7.690 7.806 -0.116 1
1 974 . 16 1 1 A 86 86 ARG HA H 86 3.704 3.991 -0.287 1
1 981 . 16 1 1 A 86 86 ARG C C 86 177.524 178.283 -0.759 1
1 982 . 16 1 1 A 86 86 ARG CA C 86 59.881 59.555 0.326 1
1 983 . 16 1 1 A 86 86 ARG CB C 86 29.248 29.971 -0.723 1
1 986 . 16 1 1 A 86 86 ARG N N 86 118.362 122.257 -3.895 1
1 987 . 16 1 1 A 87 87 GLU H H 87 7.884 7.695 0.189 1
1 988 . 16 1 1 A 87 87 GLU HA H 87 4.064 4.162 -0.098 1
1 993 . 16 1 1 A 87 87 GLU C C 87 178.785 179.256 -0.471 1
1 994 . 16 1 1 A 87 87 GLU CA C 87 58.999 58.822 0.177 1
1 995 . 16 1 1 A 87 87 GLU CB C 87 29.872 30.097 -0.225 1
1 997 . 16 1 1 A 87 87 GLU N N 87 118.124 118.991 -0.867 1
1 998 . 16 1 1 A 88 88 ILE H H 88 8.715 7.900 0.815 1
1 999 . 16 1 1 A 88 88 ILE HA H 88 3.305 3.602 -0.297 1
1 1009 . 16 1 1 A 88 88 ILE C C 88 177.261 178.831 -1.570 1
1 1010 . 16 1 1 A 88 88 ILE CA C 88 65.822 64.808 1.014 1
1 1011 . 16 1 1 A 88 88 ILE CB C 88 37.370 36.882 0.488 1
1 1015 . 16 1 1 A 88 88 ILE N N 88 122.929 121.040 1.889 1
1 1016 . 16 1 1 A 89 89 LEU H H 89 8.486 8.913 -0.427 1
1 1017 . 16 1 1 A 89 89 LEU HA H 89 3.932 4.120 -0.188 1
1 1023 . 16 1 1 A 89 89 LEU C C 89 177.919 179.052 -1.133 1
1 1024 . 16 1 1 A 89 89 LEU CA C 89 59.060 58.360 0.700 1
1 1025 . 16 1 1 A 89 89 LEU CB C 89 41.129 41.827 -0.698 1
1 1028 . 16 1 1 A 89 89 LEU N N 89 122.696 121.462 1.234 1
1 1029 . 16 1 1 A 90 90 LYS H H 90 7.790 7.974 -0.184 1
1 1030 . 16 1 1 A 90 90 LYS HA H 90 4.061 3.911 0.150 1
1 1035 . 16 1 1 A 90 90 LYS C C 90 178.432 178.735 -0.303 1
1 1036 . 16 1 1 A 90 90 LYS CA C 90 59.840 59.311 0.529 1
1 1037 . 16 1 1 A 90 90 LYS CB C 90 32.582 32.164 0.418 1
1 1039 . 16 1 1 A 90 90 LYS N N 90 118.640 119.403 -0.763 1
1 1040 . 16 1 1 A 91 91 ALA H H 91 8.113 8.030 0.083 1
1 1041 . 16 1 1 A 91 91 ALA HA H 91 4.151 4.124 0.027 1
1 1045 . 16 1 1 A 91 91 ALA C C 91 179.147 179.932 -0.785 1
1 1046 . 16 1 1 A 91 91 ALA CA C 91 54.942 55.245 -0.303 1
1 1047 . 16 1 1 A 91 91 ALA CB C 91 18.242 18.538 -0.296 1
1 1048 . 16 1 1 A 91 91 ALA N N 91 122.939 122.029 0.910 1
1 1049 . 16 1 1 A 92 92 SER H H 92 8.858 8.861 -0.003 1
1 1050 . 16 1 1 A 92 92 SER HA H 92 4.898 4.196 0.702 1
1 1052 . 16 1 1 A 92 92 SER C C 92 172.440 176.629 -4.189 1
1 1053 . 16 1 1 A 92 92 SER CA C 92 61.913 61.618 0.295 1
1 1054 . 16 1 1 A 92 92 SER CB C 92 63.081 62.539 0.542 1
1 1055 . 16 1 1 A 92 92 SER N N 92 114.526 112.888 1.638 1
1 1056 . 16 1 1 A 93 93 ARG H H 93 7.704 8.750 -1.046 1
1 1057 . 16 1 1 A 93 93 ARG HA H 93 4.162 4.156 0.006 1
1 1059 . 16 1 1 A 93 93 ARG C C 93 177.757 178.708 -0.951 1
1 1060 . 16 1 1 A 93 93 ARG CA C 93 59.544 58.117 1.427 1
1 1061 . 16 1 1 A 93 93 ARG CB C 93 30.343 29.184 1.159 1
1 1062 . 16 1 1 A 93 93 ARG N N 93 121.505 120.266 1.239 1
1 1063 . 16 1 1 A 94 94 LYS H H 94 7.456 7.525 -0.069 1
1 1064 . 16 1 1 A 94 94 LYS HA H 94 4.174 4.154 0.020 1
1 1071 . 16 1 1 A 94 94 LYS C C 94 178.861 178.949 -0.088 1
1 1072 . 16 1 1 A 94 94 LYS CA C 94 59.030 59.288 -0.258 1
1 1073 . 16 1 1 A 94 94 LYS CB C 94 32.239 32.397 -0.158 1
1 1077 . 16 1 1 A 94 94 LYS N N 94 119.072 119.911 -0.839 1
1 1078 . 16 1 1 A 95 95 LEU H H 95 8.148 7.940 0.208 1
1 1079 . 16 1 1 A 95 95 LEU HA H 95 4.129 4.160 -0.031 1
1 1088 . 16 1 1 A 95 95 LEU C C 95 177.274 178.571 -1.297 1
1 1089 . 16 1 1 A 95 95 LEU CA C 95 57.136 56.861 0.275 1
1 1090 . 16 1 1 A 95 95 LEU CB C 95 41.908 41.782 0.126 1
1 1093 . 16 1 1 A 95 95 LEU N N 95 119.717 119.300 0.417 1
1 1094 . 16 1 1 A 96 96 GLN H H 96 7.807 7.834 -0.027 1
1 1095 . 16 1 1 A 96 96 GLN HA H 96 4.242 4.374 -0.132 1
1 1102 . 16 1 1 A 96 96 GLN C C 96 175.371 176.159 -0.788 1
1 1103 . 16 1 1 A 96 96 GLN CA C 96 56.397 55.656 0.741 1
1 1104 . 16 1 1 A 96 96 GLN CB C 96 29.123 29.231 -0.108 1
1 1106 . 16 1 1 A 96 96 GLN N N 96 114.581 116.401 -1.820 1
1 1108 . 16 1 1 A 97 97 GLY H H 97 7.802 8.851 -1.049 1
1 1109 . 16 1 1 A 97 97 GLY HA2 H 97 3.839 3.928 -0.089 1
1 1110 . 16 1 1 A 97 97 GLY HA3 H 97 4.096 3.929 0.167 1
1 1111 . 16 1 1 A 97 97 GLY C C 97 172.636 173.532 -0.896 1
1 1112 . 16 1 1 A 97 97 GLY CA C 97 46.372 45.444 0.928 1
1 1113 . 16 1 1 A 97 97 GLY N N 97 106.959 107.922 -0.963 1
1 1114 . 16 1 1 A 98 98 ASP H H 98 8.156 8.061 0.095 1
1 1115 . 16 1 1 A 98 98 ASP HA H 98 4.754 5.053 -0.299 1
1 1118 . 16 1 1 A 98 98 ASP CA C 98 52.882 51.239 1.643 1
1 1119 . 16 1 1 A 98 98 ASP CB C 98 41.603 41.843 -0.240 1
1 1120 . 16 1 1 A 98 98 ASP N N 98 118.447 120.973 -2.526 1
1 1121 . 16 1 1 A 99 99 PRO HA H 99 4.470 4.548 -0.078 1
1 1126 . 16 1 1 A 99 99 PRO C C 99 175.500 176.843 -1.343 1
1 1127 . 16 1 1 A 99 99 PRO CA C 99 63.601 64.046 -0.445 1
1 1128 . 16 1 1 A 99 99 PRO CB C 99 32.423 31.760 0.663 1
1 1130 . 16 1 1 A 100 100 ASP H H 100 8.527 8.527 0.000 1
1 1131 . 16 1 1 A 100 100 ASP HA H 100 4.778 4.737 0.041 1
1 1134 . 16 1 1 A 100 100 ASP C C 100 174.931 175.675 -0.744 1
1 1135 . 16 1 1 A 100 100 ASP CA C 100 53.915 53.592 0.323 1
1 1136 . 16 1 1 A 100 100 ASP CB C 100 40.665 41.199 -0.534 1
1 1137 . 16 1 1 A 100 100 ASP N N 100 119.340 116.440 2.900 1
1 1138 . 16 1 1 A 101 101 LEU H H 101 7.379 7.179 0.200 1
1 1139 . 16 1 1 A 101 101 LEU HA H 101 4.682 4.500 0.182 1
1 1148 . 16 1 1 A 101 101 LEU CA C 101 52.956 51.540 1.416 1
1 1149 . 16 1 1 A 101 101 LEU CB C 101 43.393 41.791 1.602 1
1 1152 . 16 1 1 A 101 101 LEU N N 101 122.107 123.836 -1.729 1
1 1153 . 16 1 1 A 102 102 PRO HA H 102 4.487 5.009 -0.522 1
1 1158 . 16 1 1 A 102 102 PRO C C 102 175.697 176.495 -0.798 1
1 1159 . 16 1 1 A 102 102 PRO CA C 102 63.113 62.216 0.897 1
1 1160 . 16 1 1 A 102 102 PRO CB C 102 32.138 32.228 -0.090 1
1 1163 . 16 1 1 A 103 103 MET H H 103 9.011 8.772 0.239 1
1 1164 . 16 1 1 A 103 103 MET HA H 103 4.769 4.632 0.137 1
1 1171 . 16 1 1 A 103 103 MET C C 103 174.080 175.983 -1.903 1
1 1172 . 16 1 1 A 103 103 MET CA C 103 54.737 55.919 -1.182 1
1 1173 . 16 1 1 A 103 103 MET CB C 103 34.857 33.005 1.852 1
1 1176 . 16 1 1 A 103 103 MET N N 103 123.334 117.791 5.543 1
1 1177 . 16 1 1 A 104 104 SER H H 104 8.239 7.614 0.625 1
1 1178 . 16 1 1 A 104 104 SER HA H 104 5.079 4.621 0.458 1
1 1181 . 16 1 1 A 104 104 SER C C 104 171.795 171.409 0.386 1
1 1182 . 16 1 1 A 104 104 SER CA C 104 57.641 57.851 -0.210 1
1 1183 . 16 1 1 A 104 104 SER CB C 104 66.282 66.625 -0.343 1
1 1184 . 16 1 1 A 104 104 SER N N 104 114.434 112.256 2.178 1
1 1185 . 16 1 1 A 105 105 PHE H H 105 9.003 8.581 0.422 1
1 1186 . 16 1 1 A 105 105 PHE HA H 105 5.209 5.257 -0.048 1
1 1193 . 16 1 1 A 105 105 PHE C C 105 170.688 172.072 -1.384 1
1 1194 . 16 1 1 A 105 105 PHE CA C 105 56.917 55.920 0.997 1
1 1195 . 16 1 1 A 105 105 PHE CB C 105 41.350 41.397 -0.047 1
1 1196 . 16 1 1 A 105 105 PHE N N 105 116.224 118.391 -2.167 1
1 1197 . 16 1 1 A 106 106 THR H H 106 9.074 8.818 0.256 1
1 1198 . 16 1 1 A 106 106 THR HA H 106 4.664 4.992 -0.328 1
1 1203 . 16 1 1 A 106 106 THR C C 106 171.767 174.444 -2.677 1
1 1204 . 16 1 1 A 106 106 THR CA C 106 62.162 61.644 0.518 1
1 1205 . 16 1 1 A 106 106 THR CB C 106 70.072 70.454 -0.382 1
1 1207 . 16 1 1 A 106 106 THR N N 106 117.469 115.904 1.565 1
1 1208 . 16 1 1 A 107 107 LEU H H 107 9.804 9.550 0.254 1
1 1209 . 16 1 1 A 107 107 LEU HA H 107 4.750 4.770 -0.020 1
1 1219 . 16 1 1 A 107 107 LEU C C 107 172.742 175.847 -3.105 1
1 1220 . 16 1 1 A 107 107 LEU CA C 107 54.151 54.837 -0.686 1
1 1221 . 16 1 1 A 107 107 LEU CB C 107 44.486 42.338 2.148 1
1 1224 . 16 1 1 A 107 107 LEU N N 107 133.400 128.388 5.012 1
1 1225 . 16 1 1 A 108 108 ALA H H 108 8.435 9.051 -0.616 1
1 1226 . 16 1 1 A 108 108 ALA HA H 108 4.683 4.384 0.299 1
1 1230 . 16 1 1 A 108 108 ALA C C 108 173.052 176.036 -2.984 1
1 1231 . 16 1 1 A 108 108 ALA CA C 108 49.308 50.637 -1.329 1
1 1232 . 16 1 1 A 108 108 ALA CB C 108 22.120 19.852 2.268 1
1 1233 . 16 1 1 A 108 108 ALA N N 108 131.422 127.738 3.684 1
1 1234 . 16 1 1 A 109 109 ILE H H 109 8.909 8.889 0.020 1
1 1235 . 16 1 1 A 109 109 ILE HA H 109 4.063 5.390 -1.327 1
1 1245 . 16 1 1 A 109 109 ILE CA C 109 60.982 60.182 0.800 1
1 1246 . 16 1 1 A 109 109 ILE CB C 109 39.074 39.104 -0.030 1
1 1250 . 16 1 1 A 109 109 ILE N N 109 124.415 123.887 0.528 1
1 1251 . 16 1 1 A 110 110 VAL H H 110 8.706 8.894 -0.188 1
1 1252 . 16 1 1 A 110 110 VAL HA H 110 4.324 5.278 -0.954 1
1 1260 . 16 1 1 A 110 110 VAL C C 110 175.700 174.322 1.378 1
1 1261 . 16 1 1 A 110 110 VAL CA C 110 62.316 59.508 2.808 1
1 1262 . 16 1 1 A 110 110 VAL CB C 110 31.876 34.910 -3.034 1
1 1264 . 16 1 1 A 110 110 VAL N N 110 127.457 121.795 5.662 1
1 1265 . 16 1 1 A 111 111 GLU H H 111 9.024 8.640 0.384 1
1 1266 . 16 1 1 A 111 111 GLU HA H 111 4.403 4.489 -0.086 1
1 1269 . 16 1 1 A 111 111 GLU C C 111 175.987 177.437 -1.450 1
1 1270 . 16 1 1 A 111 111 GLU CA C 111 56.842 56.172 0.670 1
1 1271 . 16 1 1 A 111 111 GLU CB C 111 31.044 31.527 -0.483 1
1 1272 . 16 1 1 A 111 111 GLU N N 111 129.768 126.427 3.341 1
1 1273 . 16 1 1 A 112 112 SER H H 112 9.143 9.052 0.091 1
1 1274 . 16 1 1 A 112 112 SER HA H 112 4.394 4.129 0.265 1
1 1276 . 16 1 1 A 112 112 SER C C 112 173.187 175.866 -2.679 1
1 1277 . 16 1 1 A 112 112 SER CA C 112 60.180 61.216 -1.036 1
1 1278 . 16 1 1 A 112 112 SER CB C 112 63.415 62.898 0.517 1
1 1279 . 16 1 1 A 112 112 SER N N 112 115.956 121.370 -5.414 1
1 1280 . 16 1 1 A 113 113 ASP H H 113 8.133 8.061 0.072 1
1 1281 . 16 1 1 A 113 113 ASP HA H 113 4.573 4.482 0.091 1
1 1284 . 16 1 1 A 113 113 ASP C C 113 175.430 176.824 -1.394 1
1 1285 . 16 1 1 A 113 113 ASP CA C 113 54.115 56.653 -2.538 1
1 1286 . 16 1 1 A 113 113 ASP CB C 113 40.011 41.667 -1.656 1
1 1287 . 16 1 1 A 113 113 ASP N N 113 118.343 122.489 -4.146 1
1 1288 . 16 1 1 A 114 114 SER H H 114 8.034 8.069 -0.035 1
1 1289 . 16 1 1 A 114 114 SER HA H 114 4.057 4.672 -0.615 1
1 1291 . 16 1 1 A 114 114 SER C C 114 172.209 173.837 -1.628 1
1 1292 . 16 1 1 A 114 114 SER CA C 114 60.179 58.167 2.012 1
1 1293 . 16 1 1 A 114 114 SER CB C 114 62.702 65.176 -2.474 1
1 1294 . 16 1 1 A 114 114 SER N N 114 109.836 111.881 -2.045 1
1 1295 . 16 1 1 A 115 115 THR H H 115 7.711 7.493 0.218 1
1 1296 . 16 1 1 A 115 115 THR HA H 115 4.250 4.554 -0.304 1
1 1300 . 16 1 1 A 115 115 THR C C 115 171.500 174.048 -2.548 1
1 1301 . 16 1 1 A 115 115 THR CA C 115 63.547 60.683 2.864 1
1 1302 . 16 1 1 A 115 115 THR CB C 115 69.595 69.798 -0.203 1
1 1303 . 16 1 1 A 115 115 THR N N 115 117.407 112.627 4.780 1
1 1304 . 16 1 1 A 116 116 ILE H H 116 8.219 9.306 -1.087 1
1 1305 . 16 1 1 A 116 116 ILE HA H 116 4.769 5.236 -0.467 1
1 1315 . 16 1 1 A 116 116 ILE C C 116 174.434 175.161 -0.727 1
1 1316 . 16 1 1 A 116 116 ILE CA C 116 60.306 59.765 0.541 1
1 1317 . 16 1 1 A 116 116 ILE CB C 116 40.686 38.327 2.359 1
1 1321 . 16 1 1 A 116 116 ILE N N 116 125.480 126.984 -1.504 1
1 1322 . 16 1 1 A 117 117 VAL H H 117 8.695 9.476 -0.781 1
1 1323 . 16 1 1 A 117 117 VAL HA H 117 4.315 4.670 -0.355 1
1 1328 . 16 1 1 A 117 117 VAL C C 117 172.243 174.654 -2.411 1
1 1329 . 16 1 1 A 117 117 VAL CA C 117 60.621 61.224 -0.603 1
1 1330 . 16 1 1 A 117 117 VAL CB C 117 34.558 33.655 0.903 1
1 1332 . 16 1 1 A 117 117 VAL N N 117 127.887 127.527 0.360 1
1 1333 . 16 1 1 A 118 118 TYR H H 118 8.270 8.950 -0.680 1
1 1334 . 16 1 1 A 118 118 TYR HA H 118 5.327 5.694 -0.367 1
1 1342 . 16 1 1 A 118 118 TYR C C 118 174.250 174.836 -0.586 1
1 1343 . 16 1 1 A 118 118 TYR CA C 118 57.283 57.094 0.189 1
1 1344 . 16 1 1 A 118 118 TYR CB C 118 39.262 39.303 -0.041 1
1 1345 . 16 1 1 A 118 118 TYR N N 118 124.822 126.808 -1.986 1
1 1346 . 16 1 1 A 119 119 TYR H H 119 9.207 9.020 0.187 1
1 1347 . 16 1 1 A 119 119 TYR HA H 119 4.821 5.397 -0.576 1
1 1354 . 16 1 1 A 119 119 TYR C C 119 171.994 173.267 -1.273 1
1 1355 . 16 1 1 A 119 119 TYR CA C 119 58.116 56.598 1.518 1
1 1356 . 16 1 1 A 119 119 TYR CB C 119 43.544 42.166 1.378 1
1 1357 . 16 1 1 A 119 119 TYR N N 119 125.153 124.383 0.770 1
1 1358 . 16 1 1 A 120 120 LYS H H 120 7.700 8.553 -0.853 1
1 1359 . 16 1 1 A 120 120 LYS HA H 120 4.558 4.886 -0.328 1
1 1366 . 16 1 1 A 120 120 LYS C C 120 172.017 175.575 -3.558 1
1 1367 . 16 1 1 A 120 120 LYS CA C 120 57.217 55.055 2.162 1
1 1368 . 16 1 1 A 120 120 LYS CB C 120 33.914 34.361 -0.447 1
1 1372 . 16 1 1 A 120 120 LYS N N 120 129.442 128.600 0.842 1
1 1373 . 16 1 1 A 121 121 LEU H H 121 8.112 8.463 -0.351 1
1 1374 . 16 1 1 A 121 121 LEU HA H 121 5.323 5.201 0.122 1
1 1384 . 16 1 1 A 121 121 LEU C C 121 175.733 174.771 0.962 1
1 1385 . 16 1 1 A 121 121 LEU CA C 121 52.716 52.675 0.041 1
1 1386 . 16 1 1 A 121 121 LEU CB C 121 44.098 45.973 -1.875 1
1 1389 . 16 1 1 A 121 121 LEU N N 121 123.403 123.260 0.143 1
1 1390 . 16 1 1 A 122 122 THR H H 122 8.338 8.852 -0.514 1
1 1391 . 16 1 1 A 122 122 THR HA H 122 5.097 5.620 -0.523 1
1 1396 . 16 1 1 A 122 122 THR C C 122 173.221 171.843 1.378 1
1 1397 . 16 1 1 A 122 122 THR CA C 122 60.306 59.846 0.460 1
1 1398 . 16 1 1 A 122 122 THR CB C 122 72.473 71.865 0.608 1
1 1400 . 16 1 1 A 122 122 THR N N 122 109.081 115.136 -6.055 1
1 7 . 17 1 1 A 2 2 GLU H H 2 8.994 7.829 1.165 1
1 8 . 17 1 1 A 2 2 GLU HA H 2 4.278 4.682 -0.404 1
1 13 . 17 1 1 A 2 2 GLU C C 2 175.315 176.323 -1.008 1
1 14 . 17 1 1 A 2 2 GLU CA C 2 57.318 56.085 1.233 1
1 15 . 17 1 1 A 2 2 GLU CB C 2 29.221 30.439 -1.218 1
1 17 . 17 1 1 A 2 2 GLU N N 2 122.259 119.621 2.638 1
1 18 . 17 1 1 A 3 3 ASP H H 3 8.048 7.556 0.492 1
1 19 . 17 1 1 A 3 3 ASP HA H 3 4.580 4.236 0.344 1
1 21 . 17 1 1 A 3 3 ASP C C 3 175.636 176.083 -0.447 1
1 22 . 17 1 1 A 3 3 ASP CA C 3 54.579 55.867 -1.288 1
1 23 . 17 1 1 A 3 3 ASP CB C 3 40.984 40.465 0.519 1
1 24 . 17 1 1 A 3 3 ASP N N 3 119.830 120.528 -0.698 1
1 25 . 17 1 1 A 4 4 ALA H H 4 8.090 7.757 0.333 1
1 26 . 17 1 1 A 4 4 ALA HA H 4 4.216 4.129 0.087 1
1 30 . 17 1 1 A 4 4 ALA C C 4 177.157 176.811 0.346 1
1 31 . 17 1 1 A 4 4 ALA CA C 4 53.620 54.275 -0.655 1
1 32 . 17 1 1 A 4 4 ALA CB C 4 18.728 17.416 1.312 1
1 33 . 17 1 1 A 4 4 ALA N N 4 123.957 119.407 4.550 1
1 34 . 17 1 1 A 5 5 TRP H H 5 7.941 8.040 -0.099 1
1 35 . 17 1 1 A 5 5 TRP HA H 5 4.559 4.288 0.271 1
1 39 . 17 1 1 A 5 5 TRP C C 5 176.072 175.825 0.247 1
1 40 . 17 1 1 A 5 5 TRP CA C 5 57.744 58.759 -1.015 1
1 41 . 17 1 1 A 5 5 TRP CB C 5 28.906 27.038 1.868 1
1 42 . 17 1 1 A 5 5 TRP N N 5 118.408 113.903 4.505 1
1 44 . 17 1 1 A 6 6 MET H H 6 7.679 7.942 -0.263 1
1 45 . 17 1 1 A 6 6 MET HA H 6 3.785 4.626 -0.841 1
1 52 . 17 1 1 A 6 6 MET C C 6 175.174 177.561 -2.387 1
1 53 . 17 1 1 A 6 6 MET CA C 6 57.724 56.224 1.500 1
1 54 . 17 1 1 A 6 6 MET CB C 6 31.640 34.580 -2.940 1
1 57 . 17 1 1 A 6 6 MET N N 6 121.538 117.623 3.915 1
1 58 . 17 1 1 A 7 7 GLY H H 7 7.247 8.019 -0.772 1
1 59 . 17 1 1 A 7 7 GLY HA2 H 7 3.455 3.147 0.308 1
1 60 . 17 1 1 A 7 7 GLY HA3 H 7 3.578 3.597 -0.019 1
1 61 . 17 1 1 A 7 7 GLY C C 7 172.852 175.051 -2.199 1
1 62 . 17 1 1 A 7 7 GLY CA C 7 45.896 47.114 -1.218 1
1 63 . 17 1 1 A 7 7 GLY N N 7 104.055 108.737 -4.682 1
1 64 . 17 1 1 A 8 8 THR H H 8 7.436 7.462 -0.026 1
1 65 . 17 1 1 A 8 8 THR HA H 8 4.428 3.864 0.564 1
1 70 . 17 1 1 A 8 8 THR C C 8 172.973 173.438 -0.465 1
1 71 . 17 1 1 A 8 8 THR CA C 8 60.751 63.055 -2.304 1
1 72 . 17 1 1 A 8 8 THR CB C 8 69.637 66.312 3.325 1
1 74 . 17 1 1 A 8 8 THR N N 8 107.669 112.398 -4.729 1
1 75 . 17 1 1 A 9 9 HIS H H 9 8.048 7.885 0.163 1
1 76 . 17 1 1 A 9 9 HIS HA H 9 4.654 4.953 -0.299 1
1 79 . 17 1 1 A 9 9 HIS CA C 9 56.163 53.602 2.561 1
1 80 . 17 1 1 A 9 9 HIS CB C 9 32.619 31.278 1.341 1
1 81 . 17 1 1 A 9 9 HIS N N 9 127.281 120.196 7.085 1
1 82 . 17 1 1 A 10 10 PRO HA H 10 4.257 4.209 0.048 1
1 88 . 17 1 1 A 10 10 PRO C C 10 178.779 178.987 -0.208 1
1 89 . 17 1 1 A 10 10 PRO CA C 10 65.565 66.043 -0.478 1
1 90 . 17 1 1 A 10 10 PRO CB C 10 32.422 31.935 0.487 1
1 93 . 17 1 1 A 11 11 LYS H H 11 10.994 8.479 2.515 1
1 94 . 17 1 1 A 11 11 LYS HA H 11 4.282 4.155 0.127 1
1 100 . 17 1 1 A 11 11 LYS C C 11 177.279 178.773 -1.494 1
1 101 . 17 1 1 A 11 11 LYS CA C 11 56.859 59.106 -2.247 1
1 102 . 17 1 1 A 11 11 LYS CB C 11 31.279 32.124 -0.845 1
1 104 . 17 1 1 A 11 11 LYS N N 11 121.398 118.204 3.194 1
1 105 . 17 1 1 A 12 12 TYR H H 12 7.146 8.254 -1.108 1
1 106 . 17 1 1 A 12 12 TYR HA H 12 3.722 4.232 -0.510 1
1 113 . 17 1 1 A 12 12 TYR C C 12 176.265 176.966 -0.701 1
1 114 . 17 1 1 A 12 12 TYR CA C 12 61.189 61.533 -0.344 1
1 115 . 17 1 1 A 12 12 TYR CB C 12 37.796 38.396 -0.600 1
1 116 . 17 1 1 A 12 12 TYR N N 12 121.579 122.743 -1.164 1
1 117 . 17 1 1 A 13 13 LEU H H 13 7.778 8.477 -0.699 1
1 118 . 17 1 1 A 13 13 LEU HA H 13 3.773 3.924 -0.151 1
1 127 . 17 1 1 A 13 13 LEU C C 13 178.462 179.044 -0.582 1
1 128 . 17 1 1 A 13 13 LEU CA C 13 57.942 57.802 0.140 1
1 129 . 17 1 1 A 13 13 LEU CB C 13 41.064 41.279 -0.215 1
1 132 . 17 1 1 A 13 13 LEU N N 13 117.518 119.729 -2.211 1
1 133 . 17 1 1 A 14 14 GLU H H 14 7.867 8.942 -1.075 1
1 134 . 17 1 1 A 14 14 GLU HA H 14 3.935 3.979 -0.044 1
1 139 . 17 1 1 A 14 14 GLU C C 14 178.326 178.785 -0.459 1
1 140 . 17 1 1 A 14 14 GLU CA C 14 59.368 59.744 -0.376 1
1 141 . 17 1 1 A 14 14 GLU CB C 14 30.147 29.298 0.849 1
1 143 . 17 1 1 A 14 14 GLU N N 14 119.135 120.160 -1.025 1
1 144 . 17 1 1 A 15 15 MET H H 15 7.773 7.753 0.020 1
1 145 . 17 1 1 A 15 15 MET HA H 15 3.936 4.091 -0.155 1
1 152 . 17 1 1 A 15 15 MET C C 15 177.886 178.080 -0.194 1
1 153 . 17 1 1 A 15 15 MET CA C 15 59.465 58.193 1.272 1
1 154 . 17 1 1 A 15 15 MET CB C 15 33.987 32.034 1.953 1
1 157 . 17 1 1 A 15 15 MET N N 15 117.884 119.286 -1.402 1
1 158 . 17 1 1 A 16 16 MET H H 16 8.145 8.018 0.127 1
1 159 . 17 1 1 A 16 16 MET HA H 16 4.159 4.154 0.005 1
1 166 . 17 1 1 A 16 16 MET C C 16 177.835 177.897 -0.062 1
1 167 . 17 1 1 A 16 16 MET CA C 16 57.397 57.939 -0.542 1
1 168 . 17 1 1 A 16 16 MET CB C 16 31.867 32.406 -0.539 1
1 171 . 17 1 1 A 16 16 MET N N 16 119.555 118.961 0.594 1
1 172 . 17 1 1 A 17 17 GLU H H 17 7.761 7.657 0.104 1
1 173 . 17 1 1 A 17 17 GLU HA H 17 4.117 4.339 -0.222 1
1 176 . 17 1 1 A 17 17 GLU C C 17 175.994 176.290 -0.296 1
1 177 . 17 1 1 A 17 17 GLU CA C 17 57.392 57.166 0.226 1
1 178 . 17 1 1 A 17 17 GLU CB C 17 29.432 29.802 -0.370 1
1 180 . 17 1 1 A 17 17 GLU N N 17 118.216 117.183 1.033 1
1 181 . 17 1 1 A 18 18 LEU H H 18 7.201 7.301 -0.100 1
1 182 . 17 1 1 A 18 18 LEU HA H 18 4.111 4.380 -0.269 1
1 191 . 17 1 1 A 18 18 LEU C C 18 175.781 177.185 -1.404 1
1 192 . 17 1 1 A 18 18 LEU CA C 18 56.366 53.422 2.944 1
1 193 . 17 1 1 A 18 18 LEU CB C 18 42.030 43.840 -1.810 1
1 196 . 17 1 1 A 18 18 LEU N N 18 117.448 117.734 -0.286 1
1 197 . 17 1 1 A 19 19 ASP H H 19 7.789 8.808 -1.019 1
1 198 . 17 1 1 A 19 19 ASP HA H 19 4.360 4.685 -0.325 1
1 201 . 17 1 1 A 19 19 ASP C C 19 173.765 176.442 -2.677 1
1 202 . 17 1 1 A 19 19 ASP CA C 19 54.851 54.953 -0.102 1
1 203 . 17 1 1 A 19 19 ASP CB C 19 39.115 40.554 -1.439 1
1 204 . 17 1 1 A 19 19 ASP N N 19 115.844 117.990 -2.146 1
1 205 . 17 1 1 A 20 20 ILE H H 20 8.142 7.332 0.810 1
1 206 . 17 1 1 A 20 20 ILE HA H 20 4.128 4.236 -0.108 1
1 216 . 17 1 1 A 20 20 ILE C C 20 174.710 177.010 -2.300 1
1 217 . 17 1 1 A 20 20 ILE CA C 20 60.465 61.970 -1.505 1
1 218 . 17 1 1 A 20 20 ILE CB C 20 40.407 39.447 0.960 1
1 222 . 17 1 1 A 20 20 ILE N N 20 117.287 114.772 2.515 1
1 223 . 17 1 1 A 21 21 GLY H H 21 8.207 8.050 0.157 1
1 224 . 17 1 1 A 21 21 GLY HA2 H 21 3.889 3.857 0.032 1
1 225 . 17 1 1 A 21 21 GLY HA3 H 21 3.924 3.866 0.058 1
1 226 . 17 1 1 A 21 21 GLY C C 21 172.162 174.007 -1.845 1
1 227 . 17 1 1 A 21 21 GLY CA C 21 45.017 46.883 -1.866 1
1 228 . 17 1 1 A 21 21 GLY N N 21 110.656 111.608 -0.952 1
1 229 . 17 1 1 A 22 22 ASP H H 22 7.727 8.222 -0.495 1
1 230 . 17 1 1 A 22 22 ASP HA H 22 4.794 4.904 -0.110 1
1 233 . 17 1 1 A 22 22 ASP C C 22 174.884 176.848 -1.964 1
1 234 . 17 1 1 A 22 22 ASP CA C 22 52.471 53.542 -1.071 1
1 235 . 17 1 1 A 22 22 ASP CB C 22 42.069 42.483 -0.414 1
1 236 . 17 1 1 A 22 22 ASP N N 22 119.305 120.600 -1.295 1
1 237 . 17 1 1 A 23 23 ALA H H 23 8.644 9.012 -0.368 1
1 238 . 17 1 1 A 23 23 ALA HA H 23 4.120 4.102 0.018 1
1 242 . 17 1 1 A 23 23 ALA C C 23 179.546 179.883 -0.337 1
1 243 . 17 1 1 A 23 23 ALA CA C 23 55.609 55.970 -0.361 1
1 244 . 17 1 1 A 23 23 ALA CB C 23 18.573 18.310 0.263 1
1 245 . 17 1 1 A 23 23 ALA N N 23 122.468 129.177 -6.709 1
1 246 . 17 1 1 A 24 24 THR H H 24 8.238 7.573 0.665 1
1 247 . 17 1 1 A 24 24 THR HA H 24 4.184 3.949 0.235 1
1 252 . 17 1 1 A 24 24 THR C C 24 174.841 176.471 -1.630 1
1 253 . 17 1 1 A 24 24 THR CA C 24 66.241 66.750 -0.509 1
1 254 . 17 1 1 A 24 24 THR CB C 24 68.376 68.399 -0.023 1
1 256 . 17 1 1 A 24 24 THR N N 24 114.824 114.593 0.231 1
1 257 . 17 1 1 A 25 25 GLN H H 25 8.037 7.652 0.385 1
1 258 . 17 1 1 A 25 25 GLN HA H 25 4.095 3.951 0.144 1
1 265 . 17 1 1 A 25 25 GLN C C 25 177.603 178.885 -1.282 1
1 266 . 17 1 1 A 25 25 GLN CA C 25 59.261 58.799 0.462 1
1 267 . 17 1 1 A 25 25 GLN CB C 25 28.437 28.231 0.206 1
1 269 . 17 1 1 A 25 25 GLN N N 25 122.518 119.520 2.998 1
1 271 . 17 1 1 A 26 26 VAL H H 26 7.994 8.592 -0.598 1
1 272 . 17 1 1 A 26 26 VAL HA H 26 3.469 3.501 -0.032 1
1 280 . 17 1 1 A 26 26 VAL C C 26 175.552 177.882 -2.330 1
1 281 . 17 1 1 A 26 26 VAL CA C 26 66.909 66.163 0.746 1
1 282 . 17 1 1 A 26 26 VAL CB C 26 31.582 31.125 0.457 1
1 285 . 17 1 1 A 26 26 VAL N N 26 119.112 120.476 -1.364 1
1 286 . 17 1 1 A 27 27 TYR H H 27 8.003 8.153 -0.150 1
1 287 . 17 1 1 A 27 27 TYR HA H 27 4.357 4.417 -0.060 1
1 294 . 17 1 1 A 27 27 TYR C C 27 175.856 177.067 -1.211 1
1 295 . 17 1 1 A 27 27 TYR CA C 27 62.197 61.835 0.362 1
1 296 . 17 1 1 A 27 27 TYR CB C 27 38.394 38.956 -0.562 1
1 297 . 17 1 1 A 27 27 TYR N N 27 119.170 121.189 -2.019 1
1 298 . 17 1 1 A 28 28 VAL H H 28 8.087 8.227 -0.140 1
1 299 . 17 1 1 A 28 28 VAL HA H 28 3.652 3.517 0.135 1
1 307 . 17 1 1 A 28 28 VAL C C 28 176.134 177.980 -1.846 1
1 308 . 17 1 1 A 28 28 VAL CA C 28 66.247 66.304 -0.057 1
1 309 . 17 1 1 A 28 28 VAL CB C 28 31.241 31.338 -0.097 1
1 312 . 17 1 1 A 28 28 VAL N N 28 113.112 119.315 -6.203 1
1 313 . 17 1 1 A 29 29 ALA H H 29 7.853 8.818 -0.965 1
1 314 . 17 1 1 A 29 29 ALA HA H 29 3.913 4.050 -0.137 1
1 318 . 17 1 1 A 29 29 ALA C C 29 177.850 178.993 -1.143 1
1 319 . 17 1 1 A 29 29 ALA CA C 29 55.274 54.933 0.341 1
1 320 . 17 1 1 A 29 29 ALA CB C 29 17.876 18.333 -0.457 1
1 321 . 17 1 1 A 29 29 ALA N N 29 121.350 122.868 -1.518 1
1 322 . 17 1 1 A 30 30 PHE H H 30 8.724 8.463 0.261 1
1 323 . 17 1 1 A 30 30 PHE HA H 30 4.098 4.228 -0.130 1
1 327 . 17 1 1 A 30 30 PHE C C 30 175.035 177.345 -2.310 1
1 328 . 17 1 1 A 30 30 PHE CA C 30 61.264 61.513 -0.249 1
1 329 . 17 1 1 A 30 30 PHE CB C 30 38.926 39.269 -0.343 1
1 330 . 17 1 1 A 30 30 PHE N N 30 120.478 120.104 0.374 1
1 331 . 17 1 1 A 31 31 LEU H H 31 8.146 8.170 -0.024 1
1 332 . 17 1 1 A 31 31 LEU HA H 31 3.597 3.629 -0.032 1
1 341 . 17 1 1 A 31 31 LEU C C 31 179.508 179.475 0.033 1
1 342 . 17 1 1 A 31 31 LEU CA C 31 57.884 58.177 -0.293 1
1 343 . 17 1 1 A 31 31 LEU CB C 31 41.829 42.239 -0.410 1
1 346 . 17 1 1 A 31 31 LEU N N 31 118.427 120.216 -1.789 1
1 347 . 17 1 1 A 32 32 VAL H H 32 7.627 7.662 -0.035 1
1 348 . 17 1 1 A 32 32 VAL HA H 32 3.464 3.927 -0.463 1
1 356 . 17 1 1 A 32 32 VAL C C 32 174.956 177.777 -2.821 1
1 357 . 17 1 1 A 32 32 VAL CA C 32 66.373 65.846 0.527 1
1 358 . 17 1 1 A 32 32 VAL CB C 32 31.121 31.431 -0.310 1
1 361 . 17 1 1 A 32 32 VAL N N 32 119.497 113.733 5.764 1
1 362 . 17 1 1 A 33 33 TYR H H 33 8.366 8.732 -0.366 1
1 363 . 17 1 1 A 33 33 TYR HA H 33 3.485 4.046 -0.561 1
1 370 . 17 1 1 A 33 33 TYR C C 33 174.883 176.981 -2.098 1
1 371 . 17 1 1 A 33 33 TYR CA C 33 62.866 61.416 1.450 1
1 372 . 17 1 1 A 33 33 TYR CB C 33 37.778 38.365 -0.587 1
1 373 . 17 1 1 A 33 33 TYR N N 33 121.842 124.203 -2.361 1
1 374 . 17 1 1 A 34 34 LEU H H 34 8.000 8.495 -0.495 1
1 375 . 17 1 1 A 34 34 LEU HA H 34 3.495 3.690 -0.195 1
1 385 . 17 1 1 A 34 34 LEU C C 34 178.240 179.170 -0.930 1
1 386 . 17 1 1 A 34 34 LEU CA C 34 57.453 57.213 0.240 1
1 387 . 17 1 1 A 34 34 LEU CB C 34 41.828 40.958 0.870 1
1 390 . 17 1 1 A 34 34 LEU N N 34 116.692 118.930 -2.238 1
1 391 . 17 1 1 A 35 35 ASP H H 35 7.688 7.973 -0.285 1
1 392 . 17 1 1 A 35 35 ASP HA H 35 4.302 4.344 -0.042 1
1 395 . 17 1 1 A 35 35 ASP C C 35 177.507 178.712 -1.205 1
1 396 . 17 1 1 A 35 35 ASP CA C 35 58.196 57.670 0.526 1
1 397 . 17 1 1 A 35 35 ASP CB C 35 43.070 41.219 1.851 1
1 398 . 17 1 1 A 35 35 ASP N N 35 120.507 120.002 0.505 1
1 399 . 17 1 1 A 36 36 LEU H H 36 8.482 8.392 0.090 1
1 400 . 17 1 1 A 36 36 LEU HA H 36 3.328 3.937 -0.609 1
1 410 . 17 1 1 A 36 36 LEU C C 36 176.774 179.416 -2.642 1
1 411 . 17 1 1 A 36 36 LEU CA C 36 57.461 57.806 -0.345 1
1 412 . 17 1 1 A 36 36 LEU CB C 36 41.344 41.334 0.010 1
1 416 . 17 1 1 A 36 36 LEU N N 36 117.671 120.732 -3.061 1
1 417 . 17 1 1 A 37 37 MET H H 37 7.822 7.934 -0.112 1
1 418 . 17 1 1 A 37 37 MET HA H 37 4.401 4.102 0.299 1
1 425 . 17 1 1 A 37 37 MET C C 37 177.862 177.850 0.012 1
1 426 . 17 1 1 A 37 37 MET CA C 37 56.434 57.819 -1.385 1
1 427 . 17 1 1 A 37 37 MET CB C 37 31.573 32.044 -0.471 1
1 430 . 17 1 1 A 37 37 MET N N 37 112.952 118.607 -5.655 1
1 431 . 17 1 1 A 38 38 GLU H H 38 8.667 8.034 0.633 1
1 432 . 17 1 1 A 38 38 GLU HA H 38 4.457 4.195 0.262 1
1 436 . 17 1 1 A 38 38 GLU C C 38 176.582 176.904 -0.322 1
1 437 . 17 1 1 A 38 38 GLU CA C 38 57.659 57.324 0.335 1
1 438 . 17 1 1 A 38 38 GLU CB C 38 29.936 30.306 -0.370 1
1 440 . 17 1 1 A 38 38 GLU N N 38 116.463 118.248 -1.785 1
1 441 . 17 1 1 A 39 39 SER H H 39 7.657 8.215 -0.558 1
1 442 . 17 1 1 A 39 39 SER HA H 39 4.658 4.628 0.030 1
1 445 . 17 1 1 A 39 39 SER C C 39 175.661 176.094 -0.433 1
1 446 . 17 1 1 A 39 39 SER CA C 39 60.449 59.768 0.681 1
1 447 . 17 1 1 A 39 39 SER CB C 39 63.341 64.560 -1.219 1
1 448 . 17 1 1 A 39 39 SER N N 39 113.870 115.518 -1.648 1
1 449 . 17 1 1 A 40 40 LYS H H 40 8.165 7.722 0.443 1
1 450 . 17 1 1 A 40 40 LYS HA H 40 4.454 4.025 0.429 1
1 458 . 17 1 1 A 40 40 LYS C C 40 174.970 175.299 -0.329 1
1 459 . 17 1 1 A 40 40 LYS CA C 40 55.753 55.746 0.007 1
1 460 . 17 1 1 A 40 40 LYS CB C 40 32.337 32.515 -0.178 1
1 464 . 17 1 1 A 40 40 LYS N N 40 116.671 118.770 -2.099 1
1 465 . 17 1 1 A 41 41 SER H H 41 7.017 7.823 -0.806 1
1 466 . 17 1 1 A 41 41 SER HA H 41 4.209 4.489 -0.280 1
1 469 . 17 1 1 A 41 41 SER C C 41 173.770 173.441 0.329 1
1 470 . 17 1 1 A 41 41 SER CA C 41 58.435 58.900 -0.465 1
1 471 . 17 1 1 A 41 41 SER CB C 41 61.700 61.652 0.048 1
1 472 . 17 1 1 A 41 41 SER N N 41 109.989 112.436 -2.447 1
1 473 . 17 1 1 A 42 42 TRP H H 42 8.876 7.794 1.082 1
1 474 . 17 1 1 A 42 42 TRP HA H 42 4.698 4.873 -0.175 1
1 478 . 17 1 1 A 42 42 TRP C C 42 174.477 177.591 -3.114 1
1 479 . 17 1 1 A 42 42 TRP CA C 42 59.443 56.856 2.587 1
1 480 . 17 1 1 A 42 42 TRP CB C 42 28.203 31.516 -3.313 1
1 481 . 17 1 1 A 42 42 TRP N N 42 121.116 122.952 -1.836 1
1 483 . 17 1 1 A 43 43 HIS H H 43 8.132 8.657 -0.525 1
1 484 . 17 1 1 A 43 43 HIS HA H 43 4.445 4.370 0.075 1
1 488 . 17 1 1 A 43 43 HIS C C 43 174.405 174.387 0.018 1
1 489 . 17 1 1 A 43 43 HIS CA C 43 58.556 59.553 -0.997 1
1 490 . 17 1 1 A 43 43 HIS CB C 43 29.430 30.411 -0.981 1
1 491 . 17 1 1 A 43 43 HIS N N 43 119.397 121.280 -1.883 1
1 492 . 17 1 1 A 44 44 GLU H H 44 8.140 7.533 0.607 1
1 493 . 17 1 1 A 44 44 GLU HA H 44 4.432 4.536 -0.104 1
1 497 . 17 1 1 A 44 44 GLU C C 44 173.010 174.223 -1.213 1
1 498 . 17 1 1 A 44 44 GLU CA C 44 56.421 56.116 0.305 1
1 499 . 17 1 1 A 44 44 GLU CB C 44 33.285 33.215 0.070 1
1 501 . 17 1 1 A 44 44 GLU N N 44 116.181 117.952 -1.771 1
1 502 . 17 1 1 A 45 45 VAL H H 45 8.428 8.610 -0.182 1
1 503 . 17 1 1 A 45 45 VAL HA H 45 4.492 4.869 -0.377 1
1 511 . 17 1 1 A 45 45 VAL C C 45 172.339 174.544 -2.205 1
1 512 . 17 1 1 A 45 45 VAL CA C 45 63.071 61.234 1.837 1
1 513 . 17 1 1 A 45 45 VAL CB C 45 35.145 34.870 0.275 1
1 516 . 17 1 1 A 45 45 VAL N N 45 123.272 125.774 -2.502 1
1 517 . 17 1 1 A 46 46 ASN H H 46 9.050 8.891 0.159 1
1 518 . 17 1 1 A 46 46 ASN HA H 46 5.261 5.515 -0.254 1
1 523 . 17 1 1 A 46 46 ASN C C 46 172.845 173.963 -1.118 1
1 524 . 17 1 1 A 46 46 ASN CA C 46 51.895 51.907 -0.012 1
1 525 . 17 1 1 A 46 46 ASN CB C 46 42.322 42.152 0.170 1
1 526 . 17 1 1 A 46 46 ASN N N 46 123.901 124.807 -0.906 1
1 528 . 17 1 1 A 47 47 CYS H H 47 9.039 9.085 -0.046 1
1 529 . 17 1 1 A 47 47 CYS HA H 47 5.160 5.385 -0.225 1
1 532 . 17 1 1 A 47 47 CYS C C 47 172.454 173.457 -1.003 1
1 533 . 17 1 1 A 47 47 CYS CA C 47 56.473 57.032 -0.559 1
1 534 . 17 1 1 A 47 47 CYS CB C 47 29.297 29.545 -0.248 1
1 535 . 17 1 1 A 47 47 CYS N N 47 119.663 118.478 1.185 1
1 536 . 17 1 1 A 48 48 VAL H H 48 9.083 9.084 -0.001 1
1 537 . 17 1 1 A 48 48 VAL HA H 48 4.344 4.700 -0.356 1
1 542 . 17 1 1 A 48 48 VAL C C 48 173.307 174.990 -1.683 1
1 543 . 17 1 1 A 48 48 VAL CA C 48 61.368 60.788 0.580 1
1 544 . 17 1 1 A 48 48 VAL CB C 48 35.345 34.877 0.468 1
1 546 . 17 1 1 A 48 48 VAL N N 48 124.672 124.616 0.056 1
1 547 . 17 1 1 A 49 49 GLY H H 49 9.019 9.131 -0.112 1
1 548 . 17 1 1 A 49 49 GLY HA2 H 49 3.460 4.113 -0.653 1
1 549 . 17 1 1 A 49 49 GLY HA3 H 49 4.539 4.114 0.425 1
1 550 . 17 1 1 A 49 49 GLY C C 49 171.278 172.024 -0.746 1
1 551 . 17 1 1 A 49 49 GLY CA C 49 45.075 44.758 0.317 1
1 552 . 17 1 1 A 49 49 GLY N N 49 113.131 115.791 -2.660 1
1 553 . 17 1 1 A 50 50 LEU H H 50 8.747 8.805 -0.058 1
1 554 . 17 1 1 A 50 50 LEU HA H 50 5.102 4.858 0.244 1
1 564 . 17 1 1 A 50 50 LEU CA C 50 51.417 51.118 0.299 1
1 565 . 17 1 1 A 50 50 LEU CB C 50 41.754 43.313 -1.559 1
1 569 . 17 1 1 A 50 50 LEU N N 50 124.471 126.066 -1.595 1
1 570 . 17 1 1 A 51 51 PRO HA H 51 4.106 4.214 -0.108 1
1 577 . 17 1 1 A 51 51 PRO C C 51 178.422 178.000 0.422 1
1 578 . 17 1 1 A 51 51 PRO CA C 51 65.680 65.183 0.497 1
1 579 . 17 1 1 A 51 51 PRO CB C 51 31.939 31.787 0.152 1
1 582 . 17 1 1 A 52 52 GLU H H 52 9.721 8.312 1.409 1
1 583 . 17 1 1 A 52 52 GLU HA H 52 4.176 4.094 0.082 1
1 588 . 17 1 1 A 52 52 GLU C C 52 176.146 178.134 -1.988 1
1 589 . 17 1 1 A 52 52 GLU CA C 52 59.158 59.487 -0.329 1
1 590 . 17 1 1 A 52 52 GLU CB C 52 28.442 29.415 -0.973 1
1 592 . 17 1 1 A 52 52 GLU N N 52 118.552 118.075 0.477 1
1 593 . 17 1 1 A 53 53 LEU H H 53 7.089 7.877 -0.788 1
1 594 . 17 1 1 A 53 53 LEU HA H 53 4.511 4.311 0.200 1
1 603 . 17 1 1 A 53 53 LEU C C 53 174.027 176.277 -2.250 1
1 604 . 17 1 1 A 53 53 LEU CA C 53 53.825 54.777 -0.952 1
1 605 . 17 1 1 A 53 53 LEU CB C 53 43.825 42.247 1.578 1
1 608 . 17 1 1 A 53 53 LEU N N 53 116.763 117.970 -1.207 1
1 609 . 17 1 1 A 54 54 GLN H H 54 7.964 7.813 0.151 1
1 610 . 17 1 1 A 54 54 GLN HA H 54 3.591 3.966 -0.375 1
1 616 . 17 1 1 A 54 54 GLN C C 54 172.604 174.403 -1.799 1
1 617 . 17 1 1 A 54 54 GLN CA C 54 56.961 56.681 0.280 1
1 618 . 17 1 1 A 54 54 GLN CB C 54 26.545 27.375 -0.830 1
1 620 . 17 1 1 A 54 54 GLN N N 54 115.489 119.112 -3.623 1
1 622 . 17 1 1 A 55 55 LEU H H 55 7.139 7.324 -0.185 1
1 623 . 17 1 1 A 55 55 LEU HA H 55 4.750 5.070 -0.320 1
1 629 . 17 1 1 A 55 55 LEU C C 55 173.475 175.070 -1.595 1
1 630 . 17 1 1 A 55 55 LEU CA C 55 53.698 52.789 0.909 1
1 631 . 17 1 1 A 55 55 LEU CB C 55 47.859 46.032 1.827 1
1 633 . 17 1 1 A 55 55 LEU N N 55 116.422 114.941 1.481 1
1 634 . 17 1 1 A 56 56 ILE H H 56 8.223 8.489 -0.266 1
1 635 . 17 1 1 A 56 56 ILE HA H 56 4.540 5.441 -0.901 1
1 643 . 17 1 1 A 56 56 ILE C C 56 173.938 175.020 -1.082 1
1 644 . 17 1 1 A 56 56 ILE CA C 56 61.020 59.904 1.116 1
1 645 . 17 1 1 A 56 56 ILE CB C 56 39.403 40.597 -1.194 1
1 648 . 17 1 1 A 56 56 ILE N N 56 122.792 119.473 3.319 1
1 649 . 17 1 1 A 57 57 CYS H H 57 8.995 9.309 -0.314 1
1 650 . 17 1 1 A 57 57 CYS HA H 57 5.036 5.352 -0.316 1
1 653 . 17 1 1 A 57 57 CYS C C 57 170.483 173.297 -2.814 1
1 654 . 17 1 1 A 57 57 CYS CA C 57 56.484 57.308 -0.824 1
1 655 . 17 1 1 A 57 57 CYS CB C 57 30.545 31.391 -0.846 1
1 656 . 17 1 1 A 57 57 CYS N N 57 121.575 124.435 -2.860 1
1 657 . 17 1 1 A 58 58 LEU H H 58 9.076 8.929 0.147 1
1 658 . 17 1 1 A 58 58 LEU HA H 58 5.472 5.667 -0.195 1
1 668 . 17 1 1 A 58 58 LEU C C 58 174.009 176.039 -2.030 1
1 669 . 17 1 1 A 58 58 LEU CA C 58 52.851 53.558 -0.707 1
1 670 . 17 1 1 A 58 58 LEU CB C 58 42.177 43.235 -1.058 1
1 674 . 17 1 1 A 58 58 LEU N N 58 121.895 125.503 -3.608 1
1 675 . 17 1 1 A 59 59 VAL H H 59 8.966 8.661 0.305 1
1 676 . 17 1 1 A 59 59 VAL HA H 59 5.488 4.993 0.495 1
1 681 . 17 1 1 A 59 59 VAL C C 59 176.034 175.053 0.981 1
1 682 . 17 1 1 A 59 59 VAL CA C 59 59.820 60.779 -0.959 1
1 683 . 17 1 1 A 59 59 VAL CB C 59 34.786 34.304 0.482 1
1 685 . 17 1 1 A 59 59 VAL N N 59 121.702 125.687 -3.985 1
1 686 . 17 1 1 A 60 60 GLY H H 60 9.258 8.824 0.434 1
1 687 . 17 1 1 A 60 60 GLY HA2 H 60 4.673 4.341 0.332 1
1 688 . 17 1 1 A 60 60 GLY HA3 H 60 4.804 4.345 0.459 1
1 689 . 17 1 1 A 60 60 GLY C C 60 169.831 171.605 -1.774 1
1 690 . 17 1 1 A 60 60 GLY CA C 60 46.399 43.919 2.480 1
1 691 . 17 1 1 A 60 60 GLY N N 60 114.126 115.243 -1.117 1
1 692 . 17 1 1 A 61 61 THR H H 61 8.834 9.084 -0.250 1
1 693 . 17 1 1 A 61 61 THR HA H 61 4.418 4.518 -0.100 1
1 698 . 17 1 1 A 61 61 THR C C 61 171.985 175.274 -3.289 1
1 699 . 17 1 1 A 61 61 THR CA C 61 60.634 61.708 -1.074 1
1 700 . 17 1 1 A 61 61 THR CB C 61 70.983 68.789 2.194 1
1 702 . 17 1 1 A 61 61 THR N N 61 114.856 115.232 -0.376 1
1 703 . 17 1 1 A 62 62 GLU H H 62 8.502 8.598 -0.096 1
1 704 . 17 1 1 A 62 62 GLU HA H 62 2.867 3.887 -1.020 1
1 709 . 17 1 1 A 62 62 GLU C C 62 174.650 175.888 -1.238 1
1 710 . 17 1 1 A 62 62 GLU CA C 62 58.785 58.186 0.599 1
1 711 . 17 1 1 A 62 62 GLU CB C 62 28.981 28.196 0.785 1
1 713 . 17 1 1 A 62 62 GLU N N 62 129.915 125.002 4.913 1
1 714 . 17 1 1 A 63 63 ILE H H 63 6.928 7.530 -0.602 1
1 715 . 17 1 1 A 63 63 ILE HA H 63 4.038 4.613 -0.575 1
1 725 . 17 1 1 A 63 63 ILE C C 63 173.482 174.113 -0.631 1
1 726 . 17 1 1 A 63 63 ILE CA C 63 58.664 59.953 -1.289 1
1 727 . 17 1 1 A 63 63 ILE CB C 63 40.009 40.889 -0.880 1
1 731 . 17 1 1 A 63 63 ILE N N 63 117.075 118.848 -1.773 1
1 732 . 17 1 1 A 64 64 GLU H H 64 8.585 8.629 -0.044 1
1 733 . 17 1 1 A 64 64 GLU HA H 64 3.427 4.071 -0.644 1
1 738 . 17 1 1 A 64 64 GLU C C 64 175.186 176.926 -1.740 1
1 739 . 17 1 1 A 64 64 GLU CA C 64 58.703 57.390 1.313 1
1 740 . 17 1 1 A 64 64 GLU CB C 64 28.999 28.729 0.270 1
1 742 . 17 1 1 A 64 64 GLU N N 64 126.422 127.513 -1.091 1
1 743 . 17 1 1 A 65 65 GLY H H 65 8.754 8.682 0.072 1
1 744 . 17 1 1 A 65 65 GLY HA2 H 65 3.631 3.941 -0.310 1
1 745 . 17 1 1 A 65 65 GLY HA3 H 65 4.287 3.952 0.335 1
1 746 . 17 1 1 A 65 65 GLY C C 65 174.005 174.716 -0.711 1
1 747 . 17 1 1 A 65 65 GLY CA C 65 44.954 45.230 -0.276 1
1 748 . 17 1 1 A 65 65 GLY N N 65 114.614 113.003 1.611 1
1 749 . 17 1 1 A 66 66 GLU H H 66 7.760 7.895 -0.135 1
1 750 . 17 1 1 A 66 66 GLU HA H 66 4.462 4.638 -0.176 1
1 754 . 17 1 1 A 66 66 GLU C C 66 175.255 176.025 -0.770 1
1 755 . 17 1 1 A 66 66 GLU CA C 66 55.582 55.967 -0.385 1
1 756 . 17 1 1 A 66 66 GLU CB C 66 30.654 30.353 0.301 1
1 758 . 17 1 1 A 66 66 GLU N N 66 119.292 120.684 -1.392 1
1 759 . 17 1 1 A 67 67 GLY H H 67 8.262 8.215 0.047 1
1 760 . 17 1 1 A 67 67 GLY HA2 H 67 3.875 4.005 -0.130 1
1 761 . 17 1 1 A 67 67 GLY HA3 H 67 4.088 4.051 0.037 1
1 762 . 17 1 1 A 67 67 GLY C C 67 172.197 174.701 -2.504 1
1 763 . 17 1 1 A 67 67 GLY CA C 67 44.845 45.900 -1.055 1
1 764 . 17 1 1 A 67 67 GLY N N 67 106.161 108.842 -2.681 1
1 765 . 17 1 1 A 68 68 LEU H H 68 8.142 8.525 -0.383 1
1 766 . 17 1 1 A 68 68 LEU HA H 68 4.491 4.680 -0.189 1
1 775 . 17 1 1 A 68 68 LEU C C 68 176.194 176.336 -0.142 1
1 776 . 17 1 1 A 68 68 LEU CA C 68 55.123 54.267 0.856 1
1 777 . 17 1 1 A 68 68 LEU CB C 68 44.527 43.167 1.360 1
1 780 . 17 1 1 A 68 68 LEU N N 68 120.269 119.266 1.003 1
1 781 . 17 1 1 A 69 69 GLN H H 69 9.253 7.573 1.680 1
1 782 . 17 1 1 A 69 69 GLN HA H 69 4.770 4.797 -0.027 1
1 788 . 17 1 1 A 69 69 GLN C C 69 173.607 174.820 -1.213 1
1 789 . 17 1 1 A 69 69 GLN CA C 69 54.736 55.081 -0.345 1
1 790 . 17 1 1 A 69 69 GLN CB C 69 33.782 30.193 3.589 1
1 792 . 17 1 1 A 69 69 GLN N N 69 119.336 119.481 -0.145 1
1 794 . 17 1 1 A 70 70 THR H H 70 8.803 8.829 -0.026 1
1 795 . 17 1 1 A 70 70 THR HA H 70 5.033 5.084 -0.051 1
1 800 . 17 1 1 A 70 70 THR C C 70 172.596 173.858 -1.262 1
1 801 . 17 1 1 A 70 70 THR CA C 70 62.768 62.093 0.675 1
1 802 . 17 1 1 A 70 70 THR CB C 70 69.990 70.210 -0.220 1
1 804 . 17 1 1 A 70 70 THR N N 70 118.372 119.199 -0.827 1
1 805 . 17 1 1 A 71 71 VAL H H 71 9.882 9.965 -0.083 1
1 806 . 17 1 1 A 71 71 VAL HA H 71 5.239 5.336 -0.097 1
1 811 . 17 1 1 A 71 71 VAL C C 71 174.015 174.967 -0.952 1
1 812 . 17 1 1 A 71 71 VAL CA C 71 60.577 60.946 -0.369 1
1 813 . 17 1 1 A 71 71 VAL CB C 71 34.149 34.556 -0.407 1
1 815 . 17 1 1 A 71 71 VAL N N 71 129.063 127.504 1.559 1
1 816 . 17 1 1 A 72 72 VAL H H 72 9.491 8.839 0.652 1
1 817 . 17 1 1 A 72 72 VAL HA H 72 4.672 4.565 0.107 1
1 825 . 17 1 1 A 72 72 VAL CA C 72 59.568 59.160 0.408 1
1 826 . 17 1 1 A 72 72 VAL CB C 72 34.057 33.615 0.442 1
1 829 . 17 1 1 A 72 72 VAL N N 72 128.521 127.182 1.339 1
1 830 . 17 1 1 A 73 73 PRO HA H 73 5.368 4.450 0.918 1
1 836 . 17 1 1 A 73 73 PRO C C 73 175.079 176.048 -0.969 1
1 837 . 17 1 1 A 73 73 PRO CA C 73 61.324 63.159 -1.835 1
1 838 . 17 1 1 A 73 73 PRO CB C 73 33.089 31.877 1.212 1
1 841 . 17 1 1 A 74 74 THR H H 74 9.103 8.717 0.386 1
1 842 . 17 1 1 A 74 74 THR HA H 74 5.191 4.822 0.369 1
1 847 . 17 1 1 A 74 74 THR CA C 74 57.986 59.410 -1.424 1
1 848 . 17 1 1 A 74 74 THR CB C 74 72.212 72.506 -0.294 1
1 850 . 17 1 1 A 74 74 THR N N 74 118.075 118.858 -0.783 1
1 851 . 17 1 1 A 75 75 PRO HA H 75 5.015 5.031 -0.016 1
1 858 . 17 1 1 A 75 75 PRO C C 75 178.704 176.934 1.770 1
1 859 . 17 1 1 A 75 75 PRO CA C 75 63.038 62.105 0.933 1
1 860 . 17 1 1 A 75 75 PRO CB C 75 32.529 33.045 -0.516 1
1 863 . 17 1 1 A 76 76 ILE H H 76 8.221 8.668 -0.447 1
1 864 . 17 1 1 A 76 76 ILE HA H 76 4.218 3.932 0.286 1
1 873 . 17 1 1 A 76 76 ILE C C 76 172.375 177.151 -4.776 1
1 874 . 17 1 1 A 76 76 ILE CA C 76 63.509 63.521 -0.012 1
1 875 . 17 1 1 A 76 76 ILE CB C 76 39.322 37.655 1.667 1
1 879 . 17 1 1 A 76 76 ILE N N 76 122.273 121.709 0.564 1
1 880 . 17 1 1 A 77 77 THR H H 77 6.984 7.818 -0.834 1
1 881 . 17 1 1 A 77 77 THR HA H 77 4.227 4.457 -0.230 1
1 886 . 17 1 1 A 77 77 THR C C 77 173.531 174.303 -0.772 1
1 887 . 17 1 1 A 77 77 THR CA C 77 61.435 61.820 -0.385 1
1 888 . 17 1 1 A 77 77 THR CB C 77 68.944 69.306 -0.362 1
1 890 . 17 1 1 A 77 77 THR N N 77 105.803 112.930 -7.127 1
1 891 . 17 1 1 A 78 78 ALA H H 78 7.647 7.349 0.298 1
1 892 . 17 1 1 A 78 78 ALA HA H 78 4.757 4.769 -0.012 1
1 896 . 17 1 1 A 78 78 ALA C C 78 173.520 175.834 -2.314 1
1 897 . 17 1 1 A 78 78 ALA CA C 78 51.164 50.472 0.692 1
1 898 . 17 1 1 A 78 78 ALA CB C 78 20.011 21.836 -1.825 1
1 899 . 17 1 1 A 78 78 ALA N N 78 126.635 123.825 2.810 1
1 900 . 17 1 1 A 79 79 SER H H 79 7.884 8.896 -1.012 1
1 901 . 17 1 1 A 79 79 SER HA H 79 4.386 5.374 -0.988 1
1 903 . 17 1 1 A 79 79 SER C C 79 176.077 172.386 3.691 1
1 904 . 17 1 1 A 79 79 SER CA C 79 57.465 56.214 1.251 1
1 905 . 17 1 1 A 79 79 SER CB C 79 65.285 66.065 -0.780 1
1 906 . 17 1 1 A 79 79 SER N N 79 115.272 112.930 2.342 1
1 907 . 17 1 1 A 80 80 LEU H H 80 7.700 8.628 -0.928 1
1 908 . 17 1 1 A 80 80 LEU HA H 80 4.912 4.708 0.204 1
1 915 . 17 1 1 A 80 80 LEU C C 80 173.927 175.612 -1.685 1
1 916 . 17 1 1 A 80 80 LEU CA C 80 53.829 54.037 -0.208 1
1 917 . 17 1 1 A 80 80 LEU CB C 80 45.990 44.092 1.898 1
1 920 . 17 1 1 A 80 80 LEU N N 80 121.507 126.682 -5.175 1
1 921 . 17 1 1 A 81 81 SER H H 81 7.885 8.765 -0.880 1
1 922 . 17 1 1 A 81 81 SER HA H 81 5.269 4.951 0.318 1
1 925 . 17 1 1 A 81 81 SER C C 81 175.756 174.441 1.315 1
1 926 . 17 1 1 A 81 81 SER CA C 81 55.507 57.622 -2.115 1
1 927 . 17 1 1 A 81 81 SER CB C 81 65.966 66.934 -0.968 1
1 928 . 17 1 1 A 81 81 SER N N 81 118.323 116.870 1.453 1
1 929 . 17 1 1 A 82 82 HIS H H 82 8.935 9.013 -0.078 1
1 930 . 17 1 1 A 82 82 HIS HA H 82 4.407 4.430 -0.023 1
1 932 . 17 1 1 A 82 82 HIS C C 82 176.550 176.981 -0.431 1
1 933 . 17 1 1 A 82 82 HIS CA C 82 60.960 58.913 2.047 1
1 934 . 17 1 1 A 82 82 HIS CB C 82 30.755 29.308 1.447 1
1 935 . 17 1 1 A 82 82 HIS N N 82 124.042 122.315 1.727 1
1 936 . 17 1 1 A 83 83 ASN H H 83 8.435 8.214 0.221 1
1 937 . 17 1 1 A 83 83 ASN HA H 83 4.439 4.202 0.237 1
1 941 . 17 1 1 A 83 83 ASN C C 83 174.769 177.933 -3.164 1
1 942 . 17 1 1 A 83 83 ASN CA C 83 56.575 56.604 -0.029 1
1 943 . 17 1 1 A 83 83 ASN CB C 83 38.731 38.556 0.175 1
1 944 . 17 1 1 A 83 83 ASN N N 83 118.543 120.655 -2.112 1
1 946 . 17 1 1 A 84 84 ARG H H 84 7.716 8.042 -0.326 1
1 947 . 17 1 1 A 84 84 ARG HA H 84 4.183 4.539 -0.356 1
1 953 . 17 1 1 A 84 84 ARG C C 84 177.399 178.838 -1.439 1
1 954 . 17 1 1 A 84 84 ARG CA C 84 59.045 58.347 0.698 1
1 955 . 17 1 1 A 84 84 ARG CB C 84 29.992 29.679 0.313 1
1 957 . 17 1 1 A 84 84 ARG N N 84 121.312 119.881 1.431 1
1 958 . 17 1 1 A 85 85 ILE H H 85 8.354 8.626 -0.272 1
1 959 . 17 1 1 A 85 85 ILE HA H 85 3.650 3.897 -0.247 1
1 967 . 17 1 1 A 85 85 ILE C C 85 176.098 177.969 -1.871 1
1 968 . 17 1 1 A 85 85 ILE CA C 85 66.704 65.658 1.046 1
1 969 . 17 1 1 A 85 85 ILE CB C 85 38.017 37.962 0.055 1
1 972 . 17 1 1 A 85 85 ILE N N 85 119.321 120.354 -1.033 1
1 973 . 17 1 1 A 86 86 ARG H H 86 7.690 8.161 -0.471 1
1 974 . 17 1 1 A 86 86 ARG HA H 86 3.704 3.919 -0.215 1
1 981 . 17 1 1 A 86 86 ARG C C 86 177.524 178.746 -1.222 1
1 982 . 17 1 1 A 86 86 ARG CA C 86 59.881 59.794 0.087 1
1 983 . 17 1 1 A 86 86 ARG CB C 86 29.248 29.877 -0.629 1
1 986 . 17 1 1 A 86 86 ARG N N 86 118.362 120.560 -2.198 1
1 987 . 17 1 1 A 87 87 GLU H H 87 7.884 7.552 0.332 1
1 988 . 17 1 1 A 87 87 GLU HA H 87 4.064 4.074 -0.010 1
1 993 . 17 1 1 A 87 87 GLU C C 87 178.785 179.403 -0.618 1
1 994 . 17 1 1 A 87 87 GLU CA C 87 58.999 58.745 0.254 1
1 995 . 17 1 1 A 87 87 GLU CB C 87 29.872 29.991 -0.119 1
1 997 . 17 1 1 A 87 87 GLU N N 87 118.124 118.969 -0.845 1
1 998 . 17 1 1 A 88 88 ILE H H 88 8.715 8.625 0.090 1
1 999 . 17 1 1 A 88 88 ILE HA H 88 3.305 3.491 -0.186 1
1 1009 . 17 1 1 A 88 88 ILE C C 88 177.261 178.069 -0.808 1
1 1010 . 17 1 1 A 88 88 ILE CA C 88 65.822 65.597 0.225 1
1 1011 . 17 1 1 A 88 88 ILE CB C 88 37.370 37.105 0.265 1
1 1015 . 17 1 1 A 88 88 ILE N N 88 122.929 120.862 2.067 1
1 1016 . 17 1 1 A 89 89 LEU H H 89 8.486 8.806 -0.320 1
1 1017 . 17 1 1 A 89 89 LEU HA H 89 3.932 3.936 -0.004 1
1 1023 . 17 1 1 A 89 89 LEU C C 89 177.919 179.291 -1.372 1
1 1024 . 17 1 1 A 89 89 LEU CA C 89 59.060 58.174 0.886 1
1 1025 . 17 1 1 A 89 89 LEU CB C 89 41.129 41.684 -0.555 1
1 1028 . 17 1 1 A 89 89 LEU N N 89 122.696 120.671 2.025 1
1 1029 . 17 1 1 A 90 90 LYS H H 90 7.790 7.892 -0.102 1
1 1030 . 17 1 1 A 90 90 LYS HA H 90 4.061 3.982 0.079 1
1 1035 . 17 1 1 A 90 90 LYS C C 90 178.432 178.724 -0.292 1
1 1036 . 17 1 1 A 90 90 LYS CA C 90 59.840 58.836 1.004 1
1 1037 . 17 1 1 A 90 90 LYS CB C 90 32.582 32.242 0.340 1
1 1039 . 17 1 1 A 90 90 LYS N N 90 118.640 119.601 -0.961 1
1 1040 . 17 1 1 A 91 91 ALA H H 91 8.113 8.145 -0.032 1
1 1041 . 17 1 1 A 91 91 ALA HA H 91 4.151 4.077 0.074 1
1 1045 . 17 1 1 A 91 91 ALA C C 91 179.147 180.047 -0.900 1
1 1046 . 17 1 1 A 91 91 ALA CA C 91 54.942 55.294 -0.352 1
1 1047 . 17 1 1 A 91 91 ALA CB C 91 18.242 18.473 -0.231 1
1 1048 . 17 1 1 A 91 91 ALA N N 91 122.939 121.940 0.999 1
1 1049 . 17 1 1 A 92 92 SER H H 92 8.858 8.689 0.169 1
1 1050 . 17 1 1 A 92 92 SER HA H 92 4.898 4.160 0.738 1
1 1052 . 17 1 1 A 92 92 SER C C 92 172.440 177.174 -4.734 1
1 1053 . 17 1 1 A 92 92 SER CA C 92 61.913 61.630 0.283 1
1 1054 . 17 1 1 A 92 92 SER CB C 92 63.081 62.551 0.530 1
1 1055 . 17 1 1 A 92 92 SER N N 92 114.526 112.806 1.720 1
1 1056 . 17 1 1 A 93 93 ARG H H 93 7.704 7.927 -0.223 1
1 1057 . 17 1 1 A 93 93 ARG HA H 93 4.162 4.108 0.054 1
1 1059 . 17 1 1 A 93 93 ARG C C 93 177.757 178.885 -1.128 1
1 1060 . 17 1 1 A 93 93 ARG CA C 93 59.544 58.856 0.688 1
1 1061 . 17 1 1 A 93 93 ARG CB C 93 30.343 29.731 0.612 1
1 1062 . 17 1 1 A 93 93 ARG N N 93 121.505 121.886 -0.381 1
1 1063 . 17 1 1 A 94 94 LYS H H 94 7.456 7.635 -0.179 1
1 1064 . 17 1 1 A 94 94 LYS HA H 94 4.174 4.115 0.059 1
1 1071 . 17 1 1 A 94 94 LYS C C 94 178.861 179.020 -0.159 1
1 1072 . 17 1 1 A 94 94 LYS CA C 94 59.030 59.300 -0.270 1
1 1073 . 17 1 1 A 94 94 LYS CB C 94 32.239 32.286 -0.047 1
1 1077 . 17 1 1 A 94 94 LYS N N 94 119.072 120.300 -1.228 1
1 1078 . 17 1 1 A 95 95 LEU H H 95 8.148 8.002 0.146 1
1 1079 . 17 1 1 A 95 95 LEU HA H 95 4.129 4.147 -0.018 1
1 1088 . 17 1 1 A 95 95 LEU C C 95 177.274 178.245 -0.971 1
1 1089 . 17 1 1 A 95 95 LEU CA C 95 57.136 55.878 1.258 1
1 1090 . 17 1 1 A 95 95 LEU CB C 95 41.908 41.735 0.173 1
1 1093 . 17 1 1 A 95 95 LEU N N 95 119.717 119.316 0.401 1
1 1094 . 17 1 1 A 96 96 GLN H H 96 7.807 7.573 0.234 1
1 1095 . 17 1 1 A 96 96 GLN HA H 96 4.242 4.403 -0.161 1
1 1102 . 17 1 1 A 96 96 GLN C C 96 175.371 176.166 -0.795 1
1 1103 . 17 1 1 A 96 96 GLN CA C 96 56.397 55.944 0.453 1
1 1104 . 17 1 1 A 96 96 GLN CB C 96 29.123 29.220 -0.097 1
1 1106 . 17 1 1 A 96 96 GLN N N 96 114.581 118.921 -4.340 1
1 1108 . 17 1 1 A 97 97 GLY H H 97 7.802 7.810 -0.008 1
1 1109 . 17 1 1 A 97 97 GLY HA2 H 97 3.839 3.992 -0.153 1
1 1110 . 17 1 1 A 97 97 GLY HA3 H 97 4.096 3.992 0.104 1
1 1111 . 17 1 1 A 97 97 GLY C C 97 172.636 173.754 -1.118 1
1 1112 . 17 1 1 A 97 97 GLY CA C 97 46.372 45.688 0.684 1
1 1113 . 17 1 1 A 97 97 GLY N N 97 106.959 108.374 -1.415 1
1 1114 . 17 1 1 A 98 98 ASP H H 98 8.156 7.466 0.690 1
1 1115 . 17 1 1 A 98 98 ASP HA H 98 4.754 4.869 -0.115 1
1 1118 . 17 1 1 A 98 98 ASP CA C 98 52.882 51.577 1.305 1
1 1119 . 17 1 1 A 98 98 ASP CB C 98 41.603 41.468 0.135 1
1 1120 . 17 1 1 A 98 98 ASP N N 98 118.447 122.305 -3.858 1
1 1121 . 17 1 1 A 99 99 PRO HA H 99 4.470 4.491 -0.021 1
1 1126 . 17 1 1 A 99 99 PRO C C 99 175.500 176.424 -0.924 1
1 1127 . 17 1 1 A 99 99 PRO CA C 99 63.601 63.974 -0.373 1
1 1128 . 17 1 1 A 99 99 PRO CB C 99 32.423 32.644 -0.221 1
1 1130 . 17 1 1 A 100 100 ASP H H 100 8.527 8.281 0.246 1
1 1131 . 17 1 1 A 100 100 ASP HA H 100 4.778 4.950 -0.172 1
1 1134 . 17 1 1 A 100 100 ASP C C 100 174.931 175.871 -0.940 1
1 1135 . 17 1 1 A 100 100 ASP CA C 100 53.915 53.783 0.132 1
1 1136 . 17 1 1 A 100 100 ASP CB C 100 40.665 43.155 -2.490 1
1 1137 . 17 1 1 A 100 100 ASP N N 100 119.340 119.493 -0.153 1
1 1138 . 17 1 1 A 101 101 LEU H H 101 7.379 7.666 -0.287 1
1 1139 . 17 1 1 A 101 101 LEU HA H 101 4.682 4.449 0.233 1
1 1148 . 17 1 1 A 101 101 LEU CA C 101 52.956 53.314 -0.358 1
1 1149 . 17 1 1 A 101 101 LEU CB C 101 43.393 42.951 0.442 1
1 1152 . 17 1 1 A 101 101 LEU N N 101 122.107 120.908 1.199 1
1 1153 . 17 1 1 A 102 102 PRO HA H 102 4.487 4.661 -0.174 1
1 1158 . 17 1 1 A 102 102 PRO C C 102 175.697 175.869 -0.172 1
1 1159 . 17 1 1 A 102 102 PRO CA C 102 63.113 62.805 0.308 1
1 1160 . 17 1 1 A 102 102 PRO CB C 102 32.138 31.796 0.342 1
1 1163 . 17 1 1 A 103 103 MET H H 103 9.011 8.731 0.280 1
1 1164 . 17 1 1 A 103 103 MET HA H 103 4.769 5.040 -0.271 1
1 1171 . 17 1 1 A 103 103 MET C C 103 174.080 175.084 -1.004 1
1 1172 . 17 1 1 A 103 103 MET CA C 103 54.737 54.108 0.629 1
1 1173 . 17 1 1 A 103 103 MET CB C 103 34.857 35.608 -0.751 1
1 1176 . 17 1 1 A 103 103 MET N N 103 123.334 122.987 0.347 1
1 1177 . 17 1 1 A 104 104 SER H H 104 8.239 8.949 -0.710 1
1 1178 . 17 1 1 A 104 104 SER HA H 104 5.079 5.390 -0.311 1
1 1181 . 17 1 1 A 104 104 SER C C 104 171.795 173.980 -2.185 1
1 1182 . 17 1 1 A 104 104 SER CA C 104 57.641 55.473 2.168 1
1 1183 . 17 1 1 A 104 104 SER CB C 104 66.282 66.375 -0.093 1
1 1184 . 17 1 1 A 104 104 SER N N 104 114.434 114.430 0.004 1
1 1185 . 17 1 1 A 105 105 PHE H H 105 9.003 8.670 0.333 1
1 1186 . 17 1 1 A 105 105 PHE HA H 105 5.209 5.559 -0.350 1
1 1193 . 17 1 1 A 105 105 PHE C C 105 170.688 172.443 -1.755 1
1 1194 . 17 1 1 A 105 105 PHE CA C 105 56.917 55.659 1.258 1
1 1195 . 17 1 1 A 105 105 PHE CB C 105 41.350 42.571 -1.221 1
1 1196 . 17 1 1 A 105 105 PHE N N 105 116.224 117.539 -1.315 1
1 1197 . 17 1 1 A 106 106 THR H H 106 9.074 8.704 0.370 1
1 1198 . 17 1 1 A 106 106 THR HA H 106 4.664 4.894 -0.230 1
1 1203 . 17 1 1 A 106 106 THR C C 106 171.767 174.279 -2.512 1
1 1204 . 17 1 1 A 106 106 THR CA C 106 62.162 62.356 -0.194 1
1 1205 . 17 1 1 A 106 106 THR CB C 106 70.072 69.669 0.403 1
1 1207 . 17 1 1 A 106 106 THR N N 106 117.469 116.680 0.789 1
1 1208 . 17 1 1 A 107 107 LEU H H 107 9.804 9.146 0.658 1
1 1209 . 17 1 1 A 107 107 LEU HA H 107 4.750 4.768 -0.018 1
1 1219 . 17 1 1 A 107 107 LEU C C 107 172.742 176.108 -3.366 1
1 1220 . 17 1 1 A 107 107 LEU CA C 107 54.151 54.744 -0.593 1
1 1221 . 17 1 1 A 107 107 LEU CB C 107 44.486 42.567 1.919 1
1 1224 . 17 1 1 A 107 107 LEU N N 107 133.400 128.874 4.526 1
1 1225 . 17 1 1 A 108 108 ALA H H 108 8.435 8.728 -0.293 1
1 1226 . 17 1 1 A 108 108 ALA HA H 108 4.683 4.560 0.123 1
1 1230 . 17 1 1 A 108 108 ALA C C 108 173.052 175.659 -2.607 1
1 1231 . 17 1 1 A 108 108 ALA CA C 108 49.308 50.629 -1.321 1
1 1232 . 17 1 1 A 108 108 ALA CB C 108 22.120 20.013 2.107 1
1 1233 . 17 1 1 A 108 108 ALA N N 108 131.422 127.152 4.270 1
1 1234 . 17 1 1 A 109 109 ILE H H 109 8.909 9.115 -0.206 1
1 1235 . 17 1 1 A 109 109 ILE HA H 109 4.063 5.209 -1.146 1
1 1245 . 17 1 1 A 109 109 ILE CA C 109 60.982 60.026 0.956 1
1 1246 . 17 1 1 A 109 109 ILE CB C 109 39.074 38.225 0.849 1
1 1250 . 17 1 1 A 109 109 ILE N N 109 124.415 124.032 0.383 1
1 1251 . 17 1 1 A 110 110 VAL H H 110 8.706 9.287 -0.581 1
1 1252 . 17 1 1 A 110 110 VAL HA H 110 4.324 5.098 -0.774 1
1 1260 . 17 1 1 A 110 110 VAL C C 110 175.700 176.102 -0.402 1
1 1261 . 17 1 1 A 110 110 VAL CA C 110 62.316 59.416 2.900 1
1 1262 . 17 1 1 A 110 110 VAL CB C 110 31.876 34.779 -2.903 1
1 1264 . 17 1 1 A 110 110 VAL N N 110 127.457 122.899 4.558 1
1 1265 . 17 1 1 A 111 111 GLU H H 111 9.024 9.394 -0.370 1
1 1266 . 17 1 1 A 111 111 GLU HA H 111 4.403 3.940 0.463 1
1 1269 . 17 1 1 A 111 111 GLU C C 111 175.987 176.165 -0.178 1
1 1270 . 17 1 1 A 111 111 GLU CA C 111 56.842 59.219 -2.377 1
1 1271 . 17 1 1 A 111 111 GLU CB C 111 31.044 30.527 0.517 1
1 1272 . 17 1 1 A 111 111 GLU N N 111 129.768 125.381 4.387 1
1 1273 . 17 1 1 A 112 112 SER H H 112 9.143 8.164 0.979 1
1 1274 . 17 1 1 A 112 112 SER HA H 112 4.394 4.274 0.120 1
1 1276 . 17 1 1 A 112 112 SER C C 112 173.187 173.431 -0.244 1
1 1277 . 17 1 1 A 112 112 SER CA C 112 60.180 59.500 0.680 1
1 1278 . 17 1 1 A 112 112 SER CB C 112 63.415 61.218 2.197 1
1 1279 . 17 1 1 A 112 112 SER N N 112 115.956 113.549 2.407 1
1 1280 . 17 1 1 A 113 113 ASP H H 113 8.133 8.139 -0.006 1
1 1281 . 17 1 1 A 113 113 ASP HA H 113 4.573 4.909 -0.336 1
1 1284 . 17 1 1 A 113 113 ASP C C 113 175.430 175.633 -0.203 1
1 1285 . 17 1 1 A 113 113 ASP CA C 113 54.115 55.567 -1.452 1
1 1286 . 17 1 1 A 113 113 ASP CB C 113 40.011 42.948 -2.937 1
1 1287 . 17 1 1 A 113 113 ASP N N 113 118.343 121.018 -2.675 1
1 1288 . 17 1 1 A 114 114 SER H H 114 8.034 7.987 0.047 1
1 1289 . 17 1 1 A 114 114 SER HA H 114 4.057 4.742 -0.685 1
1 1291 . 17 1 1 A 114 114 SER C C 114 172.209 173.886 -1.677 1
1 1292 . 17 1 1 A 114 114 SER CA C 114 60.179 58.838 1.341 1
1 1293 . 17 1 1 A 114 114 SER CB C 114 62.702 66.360 -3.658 1
1 1294 . 17 1 1 A 114 114 SER N N 114 109.836 113.786 -3.950 1
1 1295 . 17 1 1 A 115 115 THR H H 115 7.711 7.336 0.375 1
1 1296 . 17 1 1 A 115 115 THR HA H 115 4.250 4.153 0.097 1
1 1300 . 17 1 1 A 115 115 THR C C 115 171.500 173.892 -2.392 1
1 1301 . 17 1 1 A 115 115 THR CA C 115 63.547 63.922 -0.375 1
1 1302 . 17 1 1 A 115 115 THR CB C 115 69.595 69.079 0.516 1
1 1303 . 17 1 1 A 115 115 THR N N 115 117.407 116.473 0.934 1
1 1304 . 17 1 1 A 116 116 ILE H H 116 8.219 8.912 -0.693 1
1 1305 . 17 1 1 A 116 116 ILE HA H 116 4.769 4.778 -0.009 1
1 1315 . 17 1 1 A 116 116 ILE C C 116 174.434 174.820 -0.386 1
1 1316 . 17 1 1 A 116 116 ILE CA C 116 60.306 59.950 0.356 1
1 1317 . 17 1 1 A 116 116 ILE CB C 116 40.686 39.177 1.509 1
1 1321 . 17 1 1 A 116 116 ILE N N 116 125.480 128.439 -2.959 1
1 1322 . 17 1 1 A 117 117 VAL H H 117 8.695 9.649 -0.954 1
1 1323 . 17 1 1 A 117 117 VAL HA H 117 4.315 4.460 -0.145 1
1 1328 . 17 1 1 A 117 117 VAL C C 117 172.243 174.607 -2.364 1
1 1329 . 17 1 1 A 117 117 VAL CA C 117 60.621 61.185 -0.564 1
1 1330 . 17 1 1 A 117 117 VAL CB C 117 34.558 32.691 1.867 1
1 1332 . 17 1 1 A 117 117 VAL N N 117 127.887 128.288 -0.401 1
1 1333 . 17 1 1 A 118 118 TYR H H 118 8.270 9.000 -0.730 1
1 1334 . 17 1 1 A 118 118 TYR HA H 118 5.327 5.308 0.019 1
1 1342 . 17 1 1 A 118 118 TYR C C 118 174.250 174.616 -0.366 1
1 1343 . 17 1 1 A 118 118 TYR CA C 118 57.283 56.841 0.442 1
1 1344 . 17 1 1 A 118 118 TYR CB C 118 39.262 39.123 0.139 1
1 1345 . 17 1 1 A 118 118 TYR N N 118 124.822 126.960 -2.138 1
1 1346 . 17 1 1 A 119 119 TYR H H 119 9.207 9.058 0.149 1
1 1347 . 17 1 1 A 119 119 TYR HA H 119 4.821 5.319 -0.498 1
1 1354 . 17 1 1 A 119 119 TYR C C 119 171.994 174.241 -2.247 1
1 1355 . 17 1 1 A 119 119 TYR CA C 119 58.116 56.864 1.252 1
1 1356 . 17 1 1 A 119 119 TYR CB C 119 43.544 42.010 1.534 1
1 1357 . 17 1 1 A 119 119 TYR N N 119 125.153 124.756 0.397 1
1 1358 . 17 1 1 A 120 120 LYS H H 120 7.700 8.497 -0.797 1
1 1359 . 17 1 1 A 120 120 LYS HA H 120 4.558 4.564 -0.006 1
1 1366 . 17 1 1 A 120 120 LYS C C 120 172.017 175.435 -3.418 1
1 1367 . 17 1 1 A 120 120 LYS CA C 120 57.217 55.688 1.529 1
1 1368 . 17 1 1 A 120 120 LYS CB C 120 33.914 34.454 -0.540 1
1 1372 . 17 1 1 A 120 120 LYS N N 120 129.442 126.267 3.175 1
1 1373 . 17 1 1 A 121 121 LEU H H 121 8.112 8.175 -0.063 1
1 1374 . 17 1 1 A 121 121 LEU HA H 121 5.323 4.576 0.747 1
1 1384 . 17 1 1 A 121 121 LEU C C 121 175.733 174.176 1.557 1
1 1385 . 17 1 1 A 121 121 LEU CA C 121 52.716 54.167 -1.451 1
1 1386 . 17 1 1 A 121 121 LEU CB C 121 44.098 45.480 -1.382 1
1 1389 . 17 1 1 A 121 121 LEU N N 121 123.403 123.060 0.343 1
1 1390 . 17 1 1 A 122 122 THR H H 122 8.338 8.668 -0.330 1
1 1391 . 17 1 1 A 122 122 THR HA H 122 5.097 5.008 0.089 1
1 1396 . 17 1 1 A 122 122 THR C C 122 173.221 171.705 1.516 1
1 1397 . 17 1 1 A 122 122 THR CA C 122 60.306 59.621 0.685 1
1 1398 . 17 1 1 A 122 122 THR CB C 122 72.473 72.062 0.411 1
1 1400 . 17 1 1 A 122 122 THR N N 122 109.081 118.219 -9.138 1
1 7 . 18 1 1 A 2 2 GLU H H 2 8.994 8.509 0.485 1
1 8 . 18 1 1 A 2 2 GLU HA H 2 4.278 4.118 0.160 1
1 13 . 18 1 1 A 2 2 GLU C C 2 175.315 176.500 -1.185 1
1 14 . 18 1 1 A 2 2 GLU CA C 2 57.318 58.763 -1.445 1
1 15 . 18 1 1 A 2 2 GLU CB C 2 29.221 29.086 0.135 1
1 17 . 18 1 1 A 2 2 GLU N N 2 122.259 118.114 4.145 1
1 18 . 18 1 1 A 3 3 ASP H H 3 8.048 7.856 0.192 1
1 19 . 18 1 1 A 3 3 ASP HA H 3 4.580 4.618 -0.038 1
1 21 . 18 1 1 A 3 3 ASP C C 3 175.636 176.299 -0.663 1
1 22 . 18 1 1 A 3 3 ASP CA C 3 54.579 53.305 1.274 1
1 23 . 18 1 1 A 3 3 ASP CB C 3 40.984 42.024 -1.040 1
1 24 . 18 1 1 A 3 3 ASP N N 3 119.830 119.494 0.336 1
1 25 . 18 1 1 A 4 4 ALA H H 4 8.090 7.728 0.362 1
1 26 . 18 1 1 A 4 4 ALA HA H 4 4.216 4.386 -0.170 1
1 30 . 18 1 1 A 4 4 ALA C C 4 177.157 177.429 -0.272 1
1 31 . 18 1 1 A 4 4 ALA CA C 4 53.620 50.725 2.895 1
1 32 . 18 1 1 A 4 4 ALA CB C 4 18.728 19.312 -0.584 1
1 33 . 18 1 1 A 4 4 ALA N N 4 123.957 123.649 0.308 1
1 34 . 18 1 1 A 5 5 TRP H H 5 7.941 7.789 0.152 1
1 35 . 18 1 1 A 5 5 TRP HA H 5 4.559 4.791 -0.232 1
1 39 . 18 1 1 A 5 5 TRP C C 5 176.072 177.138 -1.066 1
1 40 . 18 1 1 A 5 5 TRP CA C 5 57.744 58.605 -0.861 1
1 41 . 18 1 1 A 5 5 TRP CB C 5 28.906 30.913 -2.007 1
1 42 . 18 1 1 A 5 5 TRP N N 5 118.408 119.562 -1.154 1
1 44 . 18 1 1 A 6 6 MET H H 6 7.679 8.284 -0.605 1
1 45 . 18 1 1 A 6 6 MET HA H 6 3.785 4.556 -0.771 1
1 52 . 18 1 1 A 6 6 MET C C 6 175.174 176.684 -1.510 1
1 53 . 18 1 1 A 6 6 MET CA C 6 57.724 56.057 1.667 1
1 54 . 18 1 1 A 6 6 MET CB C 6 31.640 33.344 -1.704 1
1 57 . 18 1 1 A 6 6 MET N N 6 121.538 117.270 4.268 1
1 58 . 18 1 1 A 7 7 GLY H H 7 7.247 7.446 -0.199 1
1 59 . 18 1 1 A 7 7 GLY HA2 H 7 3.455 4.018 -0.563 1
1 60 . 18 1 1 A 7 7 GLY HA3 H 7 3.578 4.229 -0.651 1
1 61 . 18 1 1 A 7 7 GLY C C 7 172.852 174.416 -1.564 1
1 62 . 18 1 1 A 7 7 GLY CA C 7 45.896 45.873 0.023 1
1 63 . 18 1 1 A 7 7 GLY N N 7 104.055 103.390 0.665 1
1 64 . 18 1 1 A 8 8 THR H H 8 7.436 8.319 -0.883 1
1 65 . 18 1 1 A 8 8 THR HA H 8 4.428 4.631 -0.203 1
1 70 . 18 1 1 A 8 8 THR C C 8 172.973 174.311 -1.338 1
1 71 . 18 1 1 A 8 8 THR CA C 8 60.751 63.901 -3.150 1
1 72 . 18 1 1 A 8 8 THR CB C 8 69.637 69.908 -0.271 1
1 74 . 18 1 1 A 8 8 THR N N 8 107.669 115.384 -7.715 1
1 75 . 18 1 1 A 9 9 HIS H H 9 8.048 7.558 0.490 1
1 76 . 18 1 1 A 9 9 HIS HA H 9 4.654 4.670 -0.016 1
1 79 . 18 1 1 A 9 9 HIS CA C 9 56.163 55.221 0.942 1
1 80 . 18 1 1 A 9 9 HIS CB C 9 32.619 29.587 3.032 1
1 81 . 18 1 1 A 9 9 HIS N N 9 127.281 119.796 7.485 1
1 82 . 18 1 1 A 10 10 PRO HA H 10 4.257 4.243 0.014 1
1 88 . 18 1 1 A 10 10 PRO C C 10 178.779 178.415 0.364 1
1 89 . 18 1 1 A 10 10 PRO CA C 10 65.565 65.983 -0.418 1
1 90 . 18 1 1 A 10 10 PRO CB C 10 32.422 32.035 0.387 1
1 93 . 18 1 1 A 11 11 LYS H H 11 10.994 9.013 1.981 1
1 94 . 18 1 1 A 11 11 LYS HA H 11 4.282 4.200 0.082 1
1 100 . 18 1 1 A 11 11 LYS C C 11 177.279 178.429 -1.150 1
1 101 . 18 1 1 A 11 11 LYS CA C 11 56.859 58.749 -1.890 1
1 102 . 18 1 1 A 11 11 LYS CB C 11 31.279 32.140 -0.861 1
1 104 . 18 1 1 A 11 11 LYS N N 11 121.398 115.755 5.643 1
1 105 . 18 1 1 A 12 12 TYR H H 12 7.146 8.427 -1.281 1
1 106 . 18 1 1 A 12 12 TYR HA H 12 3.722 4.208 -0.486 1
1 113 . 18 1 1 A 12 12 TYR C C 12 176.265 177.473 -1.208 1
1 114 . 18 1 1 A 12 12 TYR CA C 12 61.189 61.374 -0.185 1
1 115 . 18 1 1 A 12 12 TYR CB C 12 37.796 38.354 -0.558 1
1 116 . 18 1 1 A 12 12 TYR N N 12 121.579 121.232 0.347 1
1 117 . 18 1 1 A 13 13 LEU H H 13 7.778 8.805 -1.027 1
1 118 . 18 1 1 A 13 13 LEU HA H 13 3.773 3.974 -0.201 1
1 127 . 18 1 1 A 13 13 LEU C C 13 178.462 178.392 0.070 1
1 128 . 18 1 1 A 13 13 LEU CA C 13 57.942 58.114 -0.172 1
1 129 . 18 1 1 A 13 13 LEU CB C 13 41.064 41.509 -0.445 1
1 132 . 18 1 1 A 13 13 LEU N N 13 117.518 120.921 -3.403 1
1 133 . 18 1 1 A 14 14 GLU H H 14 7.867 8.583 -0.716 1
1 134 . 18 1 1 A 14 14 GLU HA H 14 3.935 3.951 -0.016 1
1 139 . 18 1 1 A 14 14 GLU C C 14 178.326 178.775 -0.449 1
1 140 . 18 1 1 A 14 14 GLU CA C 14 59.368 59.702 -0.334 1
1 141 . 18 1 1 A 14 14 GLU CB C 14 30.147 29.295 0.852 1
1 143 . 18 1 1 A 14 14 GLU N N 14 119.135 119.209 -0.074 1
1 144 . 18 1 1 A 15 15 MET H H 15 7.773 7.535 0.238 1
1 145 . 18 1 1 A 15 15 MET HA H 15 3.936 4.104 -0.168 1
1 152 . 18 1 1 A 15 15 MET C C 15 177.886 178.135 -0.249 1
1 153 . 18 1 1 A 15 15 MET CA C 15 59.465 58.027 1.438 1
1 154 . 18 1 1 A 15 15 MET CB C 15 33.987 32.119 1.868 1
1 157 . 18 1 1 A 15 15 MET N N 15 117.884 119.294 -1.410 1
1 158 . 18 1 1 A 16 16 MET H H 16 8.145 8.099 0.046 1
1 159 . 18 1 1 A 16 16 MET HA H 16 4.159 3.969 0.190 1
1 166 . 18 1 1 A 16 16 MET C C 16 177.835 178.272 -0.437 1
1 167 . 18 1 1 A 16 16 MET CA C 16 57.397 57.889 -0.492 1
1 168 . 18 1 1 A 16 16 MET CB C 16 31.867 31.706 0.161 1
1 171 . 18 1 1 A 16 16 MET N N 16 119.555 119.220 0.335 1
1 172 . 18 1 1 A 17 17 GLU H H 17 7.761 8.196 -0.435 1
1 173 . 18 1 1 A 17 17 GLU HA H 17 4.117 4.114 0.003 1
1 176 . 18 1 1 A 17 17 GLU C C 17 175.994 176.996 -1.002 1
1 177 . 18 1 1 A 17 17 GLU CA C 17 57.392 58.319 -0.927 1
1 178 . 18 1 1 A 17 17 GLU CB C 17 29.432 29.640 -0.208 1
1 180 . 18 1 1 A 17 17 GLU N N 17 118.216 119.017 -0.801 1
1 181 . 18 1 1 A 18 18 LEU H H 18 7.201 6.885 0.316 1
1 182 . 18 1 1 A 18 18 LEU HA H 18 4.111 4.048 0.063 1
1 191 . 18 1 1 A 18 18 LEU C C 18 175.781 177.889 -2.108 1
1 192 . 18 1 1 A 18 18 LEU CA C 18 56.366 55.606 0.760 1
1 193 . 18 1 1 A 18 18 LEU CB C 18 42.030 43.512 -1.482 1
1 196 . 18 1 1 A 18 18 LEU N N 18 117.448 121.926 -4.478 1
1 197 . 18 1 1 A 19 19 ASP H H 19 7.789 8.728 -0.939 1
1 198 . 18 1 1 A 19 19 ASP HA H 19 4.360 4.570 -0.210 1
1 201 . 18 1 1 A 19 19 ASP C C 19 173.765 176.279 -2.514 1
1 202 . 18 1 1 A 19 19 ASP CA C 19 54.851 55.382 -0.531 1
1 203 . 18 1 1 A 19 19 ASP CB C 19 39.115 40.441 -1.326 1
1 204 . 18 1 1 A 19 19 ASP N N 19 115.844 125.819 -9.975 1
1 205 . 18 1 1 A 20 20 ILE H H 20 8.142 8.001 0.141 1
1 206 . 18 1 1 A 20 20 ILE HA H 20 4.128 4.304 -0.176 1
1 216 . 18 1 1 A 20 20 ILE C C 20 174.710 176.324 -1.614 1
1 217 . 18 1 1 A 20 20 ILE CA C 20 60.465 62.450 -1.985 1
1 218 . 18 1 1 A 20 20 ILE CB C 20 40.407 39.866 0.541 1
1 222 . 18 1 1 A 20 20 ILE N N 20 117.287 117.756 -0.469 1
1 223 . 18 1 1 A 21 21 GLY H H 21 8.207 8.070 0.137 1
1 224 . 18 1 1 A 21 21 GLY HA2 H 21 3.889 3.831 0.058 1
1 225 . 18 1 1 A 21 21 GLY HA3 H 21 3.924 3.839 0.085 1
1 226 . 18 1 1 A 21 21 GLY C C 21 172.162 173.919 -1.757 1
1 227 . 18 1 1 A 21 21 GLY CA C 21 45.017 46.913 -1.896 1
1 228 . 18 1 1 A 21 21 GLY N N 21 110.656 109.699 0.957 1
1 229 . 18 1 1 A 22 22 ASP H H 22 7.727 8.216 -0.489 1
1 230 . 18 1 1 A 22 22 ASP HA H 22 4.794 4.929 -0.135 1
1 233 . 18 1 1 A 22 22 ASP C C 22 174.884 176.988 -2.104 1
1 234 . 18 1 1 A 22 22 ASP CA C 22 52.471 53.607 -1.136 1
1 235 . 18 1 1 A 22 22 ASP CB C 22 42.069 42.613 -0.544 1
1 236 . 18 1 1 A 22 22 ASP N N 22 119.305 121.111 -1.806 1
1 237 . 18 1 1 A 23 23 ALA H H 23 8.644 8.891 -0.247 1
1 238 . 18 1 1 A 23 23 ALA HA H 23 4.120 4.087 0.033 1
1 242 . 18 1 1 A 23 23 ALA C C 23 179.546 179.658 -0.112 1
1 243 . 18 1 1 A 23 23 ALA CA C 23 55.609 55.627 -0.018 1
1 244 . 18 1 1 A 23 23 ALA CB C 23 18.573 18.387 0.186 1
1 245 . 18 1 1 A 23 23 ALA N N 23 122.468 128.103 -5.635 1
1 246 . 18 1 1 A 24 24 THR H H 24 8.238 8.302 -0.064 1
1 247 . 18 1 1 A 24 24 THR HA H 24 4.184 4.074 0.110 1
1 252 . 18 1 1 A 24 24 THR C C 24 174.841 176.351 -1.510 1
1 253 . 18 1 1 A 24 24 THR CA C 24 66.241 66.222 0.019 1
1 254 . 18 1 1 A 24 24 THR CB C 24 68.376 68.936 -0.560 1
1 256 . 18 1 1 A 24 24 THR N N 24 114.824 113.409 1.415 1
1 257 . 18 1 1 A 25 25 GLN H H 25 8.037 8.382 -0.345 1
1 258 . 18 1 1 A 25 25 GLN HA H 25 4.095 4.037 0.058 1
1 265 . 18 1 1 A 25 25 GLN C C 25 177.603 178.748 -1.145 1
1 266 . 18 1 1 A 25 25 GLN CA C 25 59.261 59.035 0.226 1
1 267 . 18 1 1 A 25 25 GLN CB C 25 28.437 28.512 -0.075 1
1 269 . 18 1 1 A 25 25 GLN N N 25 122.518 121.732 0.786 1
1 271 . 18 1 1 A 26 26 VAL H H 26 7.994 8.718 -0.724 1
1 272 . 18 1 1 A 26 26 VAL HA H 26 3.469 3.526 -0.057 1
1 280 . 18 1 1 A 26 26 VAL C C 26 175.552 178.233 -2.681 1
1 281 . 18 1 1 A 26 26 VAL CA C 26 66.909 66.328 0.581 1
1 282 . 18 1 1 A 26 26 VAL CB C 26 31.582 31.260 0.322 1
1 285 . 18 1 1 A 26 26 VAL N N 26 119.112 119.934 -0.822 1
1 286 . 18 1 1 A 27 27 TYR H H 27 8.003 8.123 -0.120 1
1 287 . 18 1 1 A 27 27 TYR HA H 27 4.357 4.255 0.102 1
1 294 . 18 1 1 A 27 27 TYR C C 27 175.856 177.162 -1.306 1
1 295 . 18 1 1 A 27 27 TYR CA C 27 62.197 61.470 0.727 1
1 296 . 18 1 1 A 27 27 TYR CB C 27 38.394 38.622 -0.228 1
1 297 . 18 1 1 A 27 27 TYR N N 27 119.170 121.023 -1.853 1
1 298 . 18 1 1 A 28 28 VAL H H 28 8.087 8.081 0.006 1
1 299 . 18 1 1 A 28 28 VAL HA H 28 3.652 3.403 0.249 1
1 307 . 18 1 1 A 28 28 VAL C C 28 176.134 177.947 -1.813 1
1 308 . 18 1 1 A 28 28 VAL CA C 28 66.247 66.263 -0.016 1
1 309 . 18 1 1 A 28 28 VAL CB C 28 31.241 31.379 -0.138 1
1 312 . 18 1 1 A 28 28 VAL N N 28 113.112 119.237 -6.125 1
1 313 . 18 1 1 A 29 29 ALA H H 29 7.853 8.374 -0.521 1
1 314 . 18 1 1 A 29 29 ALA HA H 29 3.913 4.009 -0.096 1
1 318 . 18 1 1 A 29 29 ALA C C 29 177.850 179.073 -1.223 1
1 319 . 18 1 1 A 29 29 ALA CA C 29 55.274 54.911 0.363 1
1 320 . 18 1 1 A 29 29 ALA CB C 29 17.876 18.314 -0.438 1
1 321 . 18 1 1 A 29 29 ALA N N 29 121.350 122.118 -0.768 1
1 322 . 18 1 1 A 30 30 PHE H H 30 8.724 8.608 0.116 1
1 323 . 18 1 1 A 30 30 PHE HA H 30 4.098 4.209 -0.111 1
1 327 . 18 1 1 A 30 30 PHE C C 30 175.035 176.863 -1.828 1
1 328 . 18 1 1 A 30 30 PHE CA C 30 61.264 61.438 -0.174 1
1 329 . 18 1 1 A 30 30 PHE CB C 30 38.926 39.407 -0.481 1
1 330 . 18 1 1 A 30 30 PHE N N 30 120.478 120.194 0.284 1
1 331 . 18 1 1 A 31 31 LEU H H 31 8.146 7.872 0.274 1
1 332 . 18 1 1 A 31 31 LEU HA H 31 3.597 3.630 -0.033 1
1 341 . 18 1 1 A 31 31 LEU C C 31 179.508 179.275 0.233 1
1 342 . 18 1 1 A 31 31 LEU CA C 31 57.884 57.898 -0.014 1
1 343 . 18 1 1 A 31 31 LEU CB C 31 41.829 41.651 0.178 1
1 346 . 18 1 1 A 31 31 LEU N N 31 118.427 120.441 -2.014 1
1 347 . 18 1 1 A 32 32 VAL H H 32 7.627 7.623 0.004 1
1 348 . 18 1 1 A 32 32 VAL HA H 32 3.464 3.729 -0.265 1
1 356 . 18 1 1 A 32 32 VAL C C 32 174.956 177.592 -2.636 1
1 357 . 18 1 1 A 32 32 VAL CA C 32 66.373 65.583 0.790 1
1 358 . 18 1 1 A 32 32 VAL CB C 32 31.121 31.383 -0.262 1
1 361 . 18 1 1 A 32 32 VAL N N 32 119.497 114.751 4.746 1
1 362 . 18 1 1 A 33 33 TYR H H 33 8.366 8.565 -0.199 1
1 363 . 18 1 1 A 33 33 TYR HA H 33 3.485 3.923 -0.438 1
1 370 . 18 1 1 A 33 33 TYR C C 33 174.883 176.859 -1.976 1
1 371 . 18 1 1 A 33 33 TYR CA C 33 62.866 61.274 1.592 1
1 372 . 18 1 1 A 33 33 TYR CB C 33 37.778 38.291 -0.513 1
1 373 . 18 1 1 A 33 33 TYR N N 33 121.842 124.141 -2.299 1
1 374 . 18 1 1 A 34 34 LEU H H 34 8.000 8.517 -0.517 1
1 375 . 18 1 1 A 34 34 LEU HA H 34 3.495 3.744 -0.249 1
1 385 . 18 1 1 A 34 34 LEU C C 34 178.240 179.094 -0.854 1
1 386 . 18 1 1 A 34 34 LEU CA C 34 57.453 57.305 0.148 1
1 387 . 18 1 1 A 34 34 LEU CB C 34 41.828 40.871 0.957 1
1 390 . 18 1 1 A 34 34 LEU N N 34 116.692 119.521 -2.829 1
1 391 . 18 1 1 A 35 35 ASP H H 35 7.688 7.887 -0.199 1
1 392 . 18 1 1 A 35 35 ASP HA H 35 4.302 4.322 -0.020 1
1 395 . 18 1 1 A 35 35 ASP C C 35 177.507 178.400 -0.893 1
1 396 . 18 1 1 A 35 35 ASP CA C 35 58.196 57.700 0.496 1
1 397 . 18 1 1 A 35 35 ASP CB C 35 43.070 41.182 1.888 1
1 398 . 18 1 1 A 35 35 ASP N N 35 120.507 120.004 0.503 1
1 399 . 18 1 1 A 36 36 LEU H H 36 8.482 8.305 0.177 1
1 400 . 18 1 1 A 36 36 LEU HA H 36 3.328 3.736 -0.408 1
1 410 . 18 1 1 A 36 36 LEU C C 36 176.774 179.173 -2.399 1
1 411 . 18 1 1 A 36 36 LEU CA C 36 57.461 57.617 -0.156 1
1 412 . 18 1 1 A 36 36 LEU CB C 36 41.344 41.023 0.321 1
1 416 . 18 1 1 A 36 36 LEU N N 36 117.671 120.037 -2.366 1
1 417 . 18 1 1 A 37 37 MET H H 37 7.822 7.939 -0.117 1
1 418 . 18 1 1 A 37 37 MET HA H 37 4.401 4.162 0.239 1
1 425 . 18 1 1 A 37 37 MET C C 37 177.862 177.697 0.165 1
1 426 . 18 1 1 A 37 37 MET CA C 37 56.434 57.878 -1.444 1
1 427 . 18 1 1 A 37 37 MET CB C 37 31.573 32.177 -0.604 1
1 430 . 18 1 1 A 37 37 MET N N 37 112.952 118.275 -5.323 1
1 431 . 18 1 1 A 38 38 GLU H H 38 8.667 8.125 0.542 1
1 432 . 18 1 1 A 38 38 GLU HA H 38 4.457 4.393 0.064 1
1 436 . 18 1 1 A 38 38 GLU C C 38 176.582 177.090 -0.508 1
1 437 . 18 1 1 A 38 38 GLU CA C 38 57.659 57.140 0.519 1
1 438 . 18 1 1 A 38 38 GLU CB C 38 29.936 30.532 -0.596 1
1 440 . 18 1 1 A 38 38 GLU N N 38 116.463 117.957 -1.494 1
1 441 . 18 1 1 A 39 39 SER H H 39 7.657 8.429 -0.772 1
1 442 . 18 1 1 A 39 39 SER HA H 39 4.658 4.698 -0.040 1
1 445 . 18 1 1 A 39 39 SER C C 39 175.661 176.458 -0.797 1
1 446 . 18 1 1 A 39 39 SER CA C 39 60.449 59.639 0.810 1
1 447 . 18 1 1 A 39 39 SER CB C 39 63.341 64.534 -1.193 1
1 448 . 18 1 1 A 39 39 SER N N 39 113.870 115.398 -1.528 1
1 449 . 18 1 1 A 40 40 LYS H H 40 8.165 8.134 0.031 1
1 450 . 18 1 1 A 40 40 LYS HA H 40 4.454 4.295 0.159 1
1 458 . 18 1 1 A 40 40 LYS C C 40 174.970 175.715 -0.745 1
1 459 . 18 1 1 A 40 40 LYS CA C 40 55.753 56.217 -0.464 1
1 460 . 18 1 1 A 40 40 LYS CB C 40 32.337 32.844 -0.507 1
1 464 . 18 1 1 A 40 40 LYS N N 40 116.671 120.139 -3.468 1
1 465 . 18 1 1 A 41 41 SER H H 41 7.017 8.008 -0.991 1
1 466 . 18 1 1 A 41 41 SER HA H 41 4.209 4.438 -0.229 1
1 469 . 18 1 1 A 41 41 SER C C 41 173.770 173.845 -0.075 1
1 470 . 18 1 1 A 41 41 SER CA C 41 58.435 58.903 -0.468 1
1 471 . 18 1 1 A 41 41 SER CB C 41 61.700 61.630 0.070 1
1 472 . 18 1 1 A 41 41 SER N N 41 109.989 113.463 -3.474 1
1 473 . 18 1 1 A 42 42 TRP H H 42 8.876 8.165 0.711 1
1 474 . 18 1 1 A 42 42 TRP HA H 42 4.698 4.617 0.081 1
1 478 . 18 1 1 A 42 42 TRP C C 42 174.477 177.407 -2.930 1
1 479 . 18 1 1 A 42 42 TRP CA C 42 59.443 57.507 1.936 1
1 480 . 18 1 1 A 42 42 TRP CB C 42 28.203 29.866 -1.663 1
1 481 . 18 1 1 A 42 42 TRP N N 42 121.116 121.557 -0.441 1
1 483 . 18 1 1 A 43 43 HIS H H 43 8.132 8.343 -0.211 1
1 484 . 18 1 1 A 43 43 HIS HA H 43 4.445 4.408 0.037 1
1 488 . 18 1 1 A 43 43 HIS C C 43 174.405 174.474 -0.069 1
1 489 . 18 1 1 A 43 43 HIS CA C 43 58.556 59.348 -0.792 1
1 490 . 18 1 1 A 43 43 HIS CB C 43 29.430 30.538 -1.108 1
1 491 . 18 1 1 A 43 43 HIS N N 43 119.397 122.790 -3.393 1
1 492 . 18 1 1 A 44 44 GLU H H 44 8.140 7.594 0.546 1
1 493 . 18 1 1 A 44 44 GLU HA H 44 4.432 4.633 -0.201 1
1 497 . 18 1 1 A 44 44 GLU C C 44 173.010 174.374 -1.364 1
1 498 . 18 1 1 A 44 44 GLU CA C 44 56.421 56.229 0.192 1
1 499 . 18 1 1 A 44 44 GLU CB C 44 33.285 33.478 -0.193 1
1 501 . 18 1 1 A 44 44 GLU N N 44 116.181 118.067 -1.886 1
1 502 . 18 1 1 A 45 45 VAL H H 45 8.428 8.847 -0.419 1
1 503 . 18 1 1 A 45 45 VAL HA H 45 4.492 5.059 -0.567 1
1 511 . 18 1 1 A 45 45 VAL C C 45 172.339 175.115 -2.776 1
1 512 . 18 1 1 A 45 45 VAL CA C 45 63.071 61.369 1.702 1
1 513 . 18 1 1 A 45 45 VAL CB C 45 35.145 34.522 0.623 1
1 516 . 18 1 1 A 45 45 VAL N N 45 123.272 126.055 -2.783 1
1 517 . 18 1 1 A 46 46 ASN H H 46 9.050 9.099 -0.049 1
1 518 . 18 1 1 A 46 46 ASN HA H 46 5.261 5.712 -0.451 1
1 523 . 18 1 1 A 46 46 ASN C C 46 172.845 173.276 -0.431 1
1 524 . 18 1 1 A 46 46 ASN CA C 46 51.895 51.376 0.519 1
1 525 . 18 1 1 A 46 46 ASN CB C 46 42.322 42.236 0.086 1
1 526 . 18 1 1 A 46 46 ASN N N 46 123.901 124.121 -0.220 1
1 528 . 18 1 1 A 47 47 CYS H H 47 9.039 9.089 -0.050 1
1 529 . 18 1 1 A 47 47 CYS HA H 47 5.160 5.264 -0.104 1
1 532 . 18 1 1 A 47 47 CYS C C 47 172.454 173.096 -0.642 1
1 533 . 18 1 1 A 47 47 CYS CA C 47 56.473 57.115 -0.642 1
1 534 . 18 1 1 A 47 47 CYS CB C 47 29.297 30.456 -1.159 1
1 535 . 18 1 1 A 47 47 CYS N N 47 119.663 119.968 -0.305 1
1 536 . 18 1 1 A 48 48 VAL H H 48 9.083 8.648 0.435 1
1 537 . 18 1 1 A 48 48 VAL HA H 48 4.344 4.832 -0.488 1
1 542 . 18 1 1 A 48 48 VAL C C 48 173.307 174.940 -1.633 1
1 543 . 18 1 1 A 48 48 VAL CA C 48 61.368 60.614 0.754 1
1 544 . 18 1 1 A 48 48 VAL CB C 48 35.345 35.982 -0.637 1
1 546 . 18 1 1 A 48 48 VAL N N 48 124.672 126.107 -1.435 1
1 547 . 18 1 1 A 49 49 GLY H H 49 9.019 8.811 0.208 1
1 548 . 18 1 1 A 49 49 GLY HA2 H 49 3.460 4.233 -0.773 1
1 549 . 18 1 1 A 49 49 GLY HA3 H 49 4.539 4.234 0.305 1
1 550 . 18 1 1 A 49 49 GLY C C 49 171.278 171.869 -0.591 1
1 551 . 18 1 1 A 49 49 GLY CA C 49 45.075 44.248 0.827 1
1 552 . 18 1 1 A 49 49 GLY N N 49 113.131 114.390 -1.259 1
1 553 . 18 1 1 A 50 50 LEU H H 50 8.747 9.055 -0.308 1
1 554 . 18 1 1 A 50 50 LEU HA H 50 5.102 5.015 0.087 1
1 564 . 18 1 1 A 50 50 LEU CA C 50 51.417 51.334 0.083 1
1 565 . 18 1 1 A 50 50 LEU CB C 50 41.754 42.180 -0.426 1
1 569 . 18 1 1 A 50 50 LEU N N 50 124.471 125.799 -1.328 1
1 570 . 18 1 1 A 51 51 PRO HA H 51 4.106 4.282 -0.176 1
1 577 . 18 1 1 A 51 51 PRO C C 51 178.422 178.589 -0.167 1
1 578 . 18 1 1 A 51 51 PRO CA C 51 65.680 64.938 0.742 1
1 579 . 18 1 1 A 51 51 PRO CB C 51 31.939 32.057 -0.118 1
1 582 . 18 1 1 A 52 52 GLU H H 52 9.721 8.350 1.371 1
1 583 . 18 1 1 A 52 52 GLU HA H 52 4.176 4.079 0.097 1
1 588 . 18 1 1 A 52 52 GLU C C 52 176.146 178.319 -2.173 1
1 589 . 18 1 1 A 52 52 GLU CA C 52 59.158 59.208 -0.050 1
1 590 . 18 1 1 A 52 52 GLU CB C 52 28.442 29.537 -1.095 1
1 592 . 18 1 1 A 52 52 GLU N N 52 118.552 118.106 0.446 1
1 593 . 18 1 1 A 53 53 LEU H H 53 7.089 7.923 -0.834 1
1 594 . 18 1 1 A 53 53 LEU HA H 53 4.511 4.279 0.232 1
1 603 . 18 1 1 A 53 53 LEU C C 53 174.027 176.428 -2.401 1
1 604 . 18 1 1 A 53 53 LEU CA C 53 53.825 54.852 -1.027 1
1 605 . 18 1 1 A 53 53 LEU CB C 53 43.825 42.316 1.509 1
1 608 . 18 1 1 A 53 53 LEU N N 53 116.763 117.979 -1.216 1
1 609 . 18 1 1 A 54 54 GLN H H 54 7.964 7.953 0.011 1
1 610 . 18 1 1 A 54 54 GLN HA H 54 3.591 3.931 -0.340 1
1 616 . 18 1 1 A 54 54 GLN C C 54 172.604 174.364 -1.760 1
1 617 . 18 1 1 A 54 54 GLN CA C 54 56.961 57.085 -0.124 1
1 618 . 18 1 1 A 54 54 GLN CB C 54 26.545 27.769 -1.224 1
1 620 . 18 1 1 A 54 54 GLN N N 54 115.489 118.777 -3.288 1
1 622 . 18 1 1 A 55 55 LEU H H 55 7.139 7.490 -0.351 1
1 623 . 18 1 1 A 55 55 LEU HA H 55 4.750 4.593 0.157 1
1 629 . 18 1 1 A 55 55 LEU C C 55 173.475 175.700 -2.225 1
1 630 . 18 1 1 A 55 55 LEU CA C 55 53.698 53.633 0.065 1
1 631 . 18 1 1 A 55 55 LEU CB C 55 47.859 43.056 4.803 1
1 633 . 18 1 1 A 55 55 LEU N N 55 116.422 119.911 -3.489 1
1 634 . 18 1 1 A 56 56 ILE H H 56 8.223 8.970 -0.747 1
1 635 . 18 1 1 A 56 56 ILE HA H 56 4.540 4.904 -0.364 1
1 643 . 18 1 1 A 56 56 ILE C C 56 173.938 175.335 -1.397 1
1 644 . 18 1 1 A 56 56 ILE CA C 56 61.020 60.092 0.928 1
1 645 . 18 1 1 A 56 56 ILE CB C 56 39.403 40.348 -0.945 1
1 648 . 18 1 1 A 56 56 ILE N N 56 122.792 123.769 -0.977 1
1 649 . 18 1 1 A 57 57 CYS H H 57 8.995 8.990 0.005 1
1 650 . 18 1 1 A 57 57 CYS HA H 57 5.036 5.160 -0.124 1
1 653 . 18 1 1 A 57 57 CYS C C 57 170.483 172.376 -1.893 1
1 654 . 18 1 1 A 57 57 CYS CA C 57 56.484 57.548 -1.064 1
1 655 . 18 1 1 A 57 57 CYS CB C 57 30.545 30.822 -0.277 1
1 656 . 18 1 1 A 57 57 CYS N N 57 121.575 125.047 -3.472 1
1 657 . 18 1 1 A 58 58 LEU H H 58 9.076 8.514 0.562 1
1 658 . 18 1 1 A 58 58 LEU HA H 58 5.472 5.041 0.431 1
1 668 . 18 1 1 A 58 58 LEU C C 58 174.009 174.857 -0.848 1
1 669 . 18 1 1 A 58 58 LEU CA C 58 52.851 53.788 -0.937 1
1 670 . 18 1 1 A 58 58 LEU CB C 58 42.177 43.917 -1.740 1
1 674 . 18 1 1 A 58 58 LEU N N 58 121.895 129.297 -7.402 1
1 675 . 18 1 1 A 59 59 VAL H H 59 8.966 8.827 0.139 1
1 676 . 18 1 1 A 59 59 VAL HA H 59 5.488 5.177 0.311 1
1 681 . 18 1 1 A 59 59 VAL C C 59 176.034 176.038 -0.004 1
1 682 . 18 1 1 A 59 59 VAL CA C 59 59.820 60.763 -0.943 1
1 683 . 18 1 1 A 59 59 VAL CB C 59 34.786 35.371 -0.585 1
1 685 . 18 1 1 A 59 59 VAL N N 59 121.702 128.099 -6.397 1
1 686 . 18 1 1 A 60 60 GLY H H 60 9.258 8.714 0.544 1
1 687 . 18 1 1 A 60 60 GLY HA2 H 60 4.673 4.489 0.184 1
1 688 . 18 1 1 A 60 60 GLY HA3 H 60 4.804 4.660 0.144 1
1 689 . 18 1 1 A 60 60 GLY C C 60 169.831 172.837 -3.006 1
1 690 . 18 1 1 A 60 60 GLY CA C 60 46.399 46.347 0.052 1
1 691 . 18 1 1 A 60 60 GLY N N 60 114.126 113.125 1.001 1
1 692 . 18 1 1 A 61 61 THR H H 61 8.834 8.466 0.368 1
1 693 . 18 1 1 A 61 61 THR HA H 61 4.418 4.996 -0.578 1
1 698 . 18 1 1 A 61 61 THR C C 61 171.985 174.610 -2.625 1
1 699 . 18 1 1 A 61 61 THR CA C 61 60.634 60.485 0.149 1
1 700 . 18 1 1 A 61 61 THR CB C 61 70.983 70.407 0.576 1
1 702 . 18 1 1 A 61 61 THR N N 61 114.856 111.824 3.032 1
1 703 . 18 1 1 A 62 62 GLU H H 62 8.502 8.439 0.063 1
1 704 . 18 1 1 A 62 62 GLU HA H 62 2.867 2.966 -0.099 1
1 709 . 18 1 1 A 62 62 GLU C C 62 174.650 175.792 -1.142 1
1 710 . 18 1 1 A 62 62 GLU CA C 62 58.785 58.333 0.452 1
1 711 . 18 1 1 A 62 62 GLU CB C 62 28.981 29.224 -0.243 1
1 713 . 18 1 1 A 62 62 GLU N N 62 129.915 123.890 6.025 1
1 714 . 18 1 1 A 63 63 ILE H H 63 6.928 7.803 -0.875 1
1 715 . 18 1 1 A 63 63 ILE HA H 63 4.038 4.410 -0.372 1
1 725 . 18 1 1 A 63 63 ILE C C 63 173.482 175.062 -1.580 1
1 726 . 18 1 1 A 63 63 ILE CA C 63 58.664 59.837 -1.173 1
1 727 . 18 1 1 A 63 63 ILE CB C 63 40.009 41.211 -1.202 1
1 731 . 18 1 1 A 63 63 ILE N N 63 117.075 117.719 -0.644 1
1 732 . 18 1 1 A 64 64 GLU H H 64 8.585 8.291 0.294 1
1 733 . 18 1 1 A 64 64 GLU HA H 64 3.427 3.735 -0.308 1
1 738 . 18 1 1 A 64 64 GLU C C 64 175.186 177.035 -1.849 1
1 739 . 18 1 1 A 64 64 GLU CA C 64 58.703 58.077 0.626 1
1 740 . 18 1 1 A 64 64 GLU CB C 64 28.999 28.715 0.284 1
1 742 . 18 1 1 A 64 64 GLU N N 64 126.422 126.323 0.099 1
1 743 . 18 1 1 A 65 65 GLY H H 65 8.754 8.798 -0.044 1
1 744 . 18 1 1 A 65 65 GLY HA2 H 65 3.631 3.899 -0.268 1
1 745 . 18 1 1 A 65 65 GLY HA3 H 65 4.287 3.918 0.369 1
1 746 . 18 1 1 A 65 65 GLY C C 65 174.005 175.180 -1.175 1
1 747 . 18 1 1 A 65 65 GLY CA C 65 44.954 45.092 -0.138 1
1 748 . 18 1 1 A 65 65 GLY N N 65 114.614 115.351 -0.737 1
1 749 . 18 1 1 A 66 66 GLU H H 66 7.760 7.982 -0.222 1
1 750 . 18 1 1 A 66 66 GLU HA H 66 4.462 4.441 0.021 1
1 754 . 18 1 1 A 66 66 GLU C C 66 175.255 176.377 -1.122 1
1 755 . 18 1 1 A 66 66 GLU CA C 66 55.582 56.191 -0.609 1
1 756 . 18 1 1 A 66 66 GLU CB C 66 30.654 29.611 1.043 1
1 758 . 18 1 1 A 66 66 GLU N N 66 119.292 119.237 0.055 1
1 759 . 18 1 1 A 67 67 GLY H H 67 8.262 8.208 0.054 1
1 760 . 18 1 1 A 67 67 GLY HA2 H 67 3.875 3.855 0.020 1
1 761 . 18 1 1 A 67 67 GLY HA3 H 67 4.088 3.888 0.200 1
1 762 . 18 1 1 A 67 67 GLY C C 67 172.197 173.721 -1.524 1
1 763 . 18 1 1 A 67 67 GLY CA C 67 44.845 46.707 -1.862 1
1 764 . 18 1 1 A 67 67 GLY N N 67 106.161 109.005 -2.844 1
1 765 . 18 1 1 A 68 68 LEU H H 68 8.142 8.159 -0.017 1
1 766 . 18 1 1 A 68 68 LEU HA H 68 4.491 4.624 -0.133 1
1 775 . 18 1 1 A 68 68 LEU C C 68 176.194 175.955 0.239 1
1 776 . 18 1 1 A 68 68 LEU CA C 68 55.123 53.883 1.240 1
1 777 . 18 1 1 A 68 68 LEU CB C 68 44.527 43.769 0.758 1
1 780 . 18 1 1 A 68 68 LEU N N 68 120.269 125.671 -5.402 1
1 781 . 18 1 1 A 69 69 GLN H H 69 9.253 7.725 1.528 1
1 782 . 18 1 1 A 69 69 GLN HA H 69 4.770 4.864 -0.094 1
1 788 . 18 1 1 A 69 69 GLN C C 69 173.607 174.956 -1.349 1
1 789 . 18 1 1 A 69 69 GLN CA C 69 54.736 55.097 -0.361 1
1 790 . 18 1 1 A 69 69 GLN CB C 69 33.782 30.228 3.554 1
1 792 . 18 1 1 A 69 69 GLN N N 69 119.336 119.805 -0.469 1
1 794 . 18 1 1 A 70 70 THR H H 70 8.803 9.028 -0.225 1
1 795 . 18 1 1 A 70 70 THR HA H 70 5.033 5.198 -0.165 1
1 800 . 18 1 1 A 70 70 THR C C 70 172.596 174.405 -1.809 1
1 801 . 18 1 1 A 70 70 THR CA C 70 62.768 62.237 0.531 1
1 802 . 18 1 1 A 70 70 THR CB C 70 69.990 70.620 -0.630 1
1 804 . 18 1 1 A 70 70 THR N N 70 118.372 119.096 -0.724 1
1 805 . 18 1 1 A 71 71 VAL H H 71 9.882 9.256 0.626 1
1 806 . 18 1 1 A 71 71 VAL HA H 71 5.239 5.416 -0.177 1
1 811 . 18 1 1 A 71 71 VAL C C 71 174.015 174.626 -0.611 1
1 812 . 18 1 1 A 71 71 VAL CA C 71 60.577 59.819 0.758 1
1 813 . 18 1 1 A 71 71 VAL CB C 71 34.149 35.313 -1.164 1
1 815 . 18 1 1 A 71 71 VAL N N 71 129.063 120.753 8.310 1
1 816 . 18 1 1 A 72 72 VAL H H 72 9.491 8.881 0.610 1
1 817 . 18 1 1 A 72 72 VAL HA H 72 4.672 4.547 0.125 1
1 825 . 18 1 1 A 72 72 VAL CA C 72 59.568 58.655 0.913 1
1 826 . 18 1 1 A 72 72 VAL CB C 72 34.057 35.285 -1.228 1
1 829 . 18 1 1 A 72 72 VAL N N 72 128.521 125.056 3.465 1
1 830 . 18 1 1 A 73 73 PRO HA H 73 5.368 4.474 0.894 1
1 836 . 18 1 1 A 73 73 PRO C C 73 175.079 175.884 -0.805 1
1 837 . 18 1 1 A 73 73 PRO CA C 73 61.324 63.099 -1.775 1
1 838 . 18 1 1 A 73 73 PRO CB C 73 33.089 31.915 1.174 1
1 841 . 18 1 1 A 74 74 THR H H 74 9.103 8.877 0.226 1
1 842 . 18 1 1 A 74 74 THR HA H 74 5.191 4.781 0.410 1
1 847 . 18 1 1 A 74 74 THR CA C 74 57.986 59.138 -1.152 1
1 848 . 18 1 1 A 74 74 THR CB C 74 72.212 72.303 -0.091 1
1 850 . 18 1 1 A 74 74 THR N N 74 118.075 118.837 -0.762 1
1 851 . 18 1 1 A 75 75 PRO HA H 75 5.015 4.671 0.344 1
1 858 . 18 1 1 A 75 75 PRO C C 75 178.704 177.439 1.265 1
1 859 . 18 1 1 A 75 75 PRO CA C 75 63.038 62.454 0.584 1
1 860 . 18 1 1 A 75 75 PRO CB C 75 32.529 32.742 -0.213 1
1 863 . 18 1 1 A 76 76 ILE H H 76 8.221 8.097 0.124 1
1 864 . 18 1 1 A 76 76 ILE HA H 76 4.218 3.778 0.440 1
1 873 . 18 1 1 A 76 76 ILE C C 76 172.375 176.743 -4.368 1
1 874 . 18 1 1 A 76 76 ILE CA C 76 63.509 64.080 -0.571 1
1 875 . 18 1 1 A 76 76 ILE CB C 76 39.322 38.008 1.314 1
1 879 . 18 1 1 A 76 76 ILE N N 76 122.273 122.621 -0.348 1
1 880 . 18 1 1 A 77 77 THR H H 77 6.984 7.556 -0.572 1
1 881 . 18 1 1 A 77 77 THR HA H 77 4.227 4.421 -0.194 1
1 886 . 18 1 1 A 77 77 THR C C 77 173.531 174.230 -0.699 1
1 887 . 18 1 1 A 77 77 THR CA C 77 61.435 62.596 -1.161 1
1 888 . 18 1 1 A 77 77 THR CB C 77 68.944 69.399 -0.455 1
1 890 . 18 1 1 A 77 77 THR N N 77 105.803 114.152 -8.349 1
1 891 . 18 1 1 A 78 78 ALA H H 78 7.647 7.493 0.154 1
1 892 . 18 1 1 A 78 78 ALA HA H 78 4.757 4.384 0.373 1
1 896 . 18 1 1 A 78 78 ALA C C 78 173.520 176.786 -3.266 1
1 897 . 18 1 1 A 78 78 ALA CA C 78 51.164 51.795 -0.631 1
1 898 . 18 1 1 A 78 78 ALA CB C 78 20.011 20.924 -0.913 1
1 899 . 18 1 1 A 78 78 ALA N N 78 126.635 124.102 2.533 1
1 900 . 18 1 1 A 79 79 SER H H 79 7.884 8.754 -0.870 1
1 901 . 18 1 1 A 79 79 SER HA H 79 4.386 5.483 -1.097 1
1 903 . 18 1 1 A 79 79 SER C C 79 176.077 172.306 3.771 1
1 904 . 18 1 1 A 79 79 SER CA C 79 57.465 56.386 1.079 1
1 905 . 18 1 1 A 79 79 SER CB C 79 65.285 65.705 -0.420 1
1 906 . 18 1 1 A 79 79 SER N N 79 115.272 112.836 2.436 1
1 907 . 18 1 1 A 80 80 LEU H H 80 7.700 8.802 -1.102 1
1 908 . 18 1 1 A 80 80 LEU HA H 80 4.912 4.992 -0.080 1
1 915 . 18 1 1 A 80 80 LEU C C 80 173.927 175.165 -1.238 1
1 916 . 18 1 1 A 80 80 LEU CA C 80 53.829 53.864 -0.035 1
1 917 . 18 1 1 A 80 80 LEU CB C 80 45.990 44.302 1.688 1
1 920 . 18 1 1 A 80 80 LEU N N 80 121.507 127.147 -5.640 1
1 921 . 18 1 1 A 81 81 SER H H 81 7.885 8.577 -0.692 1
1 922 . 18 1 1 A 81 81 SER HA H 81 5.269 5.116 0.153 1
1 925 . 18 1 1 A 81 81 SER C C 81 175.756 174.094 1.662 1
1 926 . 18 1 1 A 81 81 SER CA C 81 55.507 57.470 -1.963 1
1 927 . 18 1 1 A 81 81 SER CB C 81 65.966 64.650 1.316 1
1 928 . 18 1 1 A 81 81 SER N N 81 118.323 119.142 -0.819 1
1 929 . 18 1 1 A 82 82 HIS H H 82 8.935 8.909 0.026 1
1 930 . 18 1 1 A 82 82 HIS HA H 82 4.407 4.208 0.199 1
1 932 . 18 1 1 A 82 82 HIS C C 82 176.550 176.784 -0.234 1
1 933 . 18 1 1 A 82 82 HIS CA C 82 60.960 59.435 1.525 1
1 934 . 18 1 1 A 82 82 HIS CB C 82 30.755 30.276 0.479 1
1 935 . 18 1 1 A 82 82 HIS N N 82 124.042 125.640 -1.598 1
1 936 . 18 1 1 A 83 83 ASN H H 83 8.435 8.413 0.022 1
1 937 . 18 1 1 A 83 83 ASN HA H 83 4.439 4.254 0.185 1
1 941 . 18 1 1 A 83 83 ASN C C 83 174.769 177.762 -2.993 1
1 942 . 18 1 1 A 83 83 ASN CA C 83 56.575 56.587 -0.012 1
1 943 . 18 1 1 A 83 83 ASN CB C 83 38.731 38.940 -0.209 1
1 944 . 18 1 1 A 83 83 ASN N N 83 118.543 117.652 0.891 1
1 946 . 18 1 1 A 84 84 ARG H H 84 7.716 8.076 -0.360 1
1 947 . 18 1 1 A 84 84 ARG HA H 84 4.183 4.215 -0.032 1
1 953 . 18 1 1 A 84 84 ARG C C 84 177.399 178.869 -1.470 1
1 954 . 18 1 1 A 84 84 ARG CA C 84 59.045 58.361 0.684 1
1 955 . 18 1 1 A 84 84 ARG CB C 84 29.992 29.763 0.229 1
1 957 . 18 1 1 A 84 84 ARG N N 84 121.312 119.728 1.584 1
1 958 . 18 1 1 A 85 85 ILE H H 85 8.354 8.889 -0.535 1
1 959 . 18 1 1 A 85 85 ILE HA H 85 3.650 3.944 -0.294 1
1 967 . 18 1 1 A 85 85 ILE C C 85 176.098 177.816 -1.718 1
1 968 . 18 1 1 A 85 85 ILE CA C 85 66.704 65.506 1.198 1
1 969 . 18 1 1 A 85 85 ILE CB C 85 38.017 37.754 0.263 1
1 972 . 18 1 1 A 85 85 ILE N N 85 119.321 120.107 -0.786 1
1 973 . 18 1 1 A 86 86 ARG H H 86 7.690 8.102 -0.412 1
1 974 . 18 1 1 A 86 86 ARG HA H 86 3.704 3.755 -0.051 1
1 981 . 18 1 1 A 86 86 ARG C C 86 177.524 178.576 -1.052 1
1 982 . 18 1 1 A 86 86 ARG CA C 86 59.881 59.593 0.288 1
1 983 . 18 1 1 A 86 86 ARG CB C 86 29.248 29.721 -0.473 1
1 986 . 18 1 1 A 86 86 ARG N N 86 118.362 120.446 -2.084 1
1 987 . 18 1 1 A 87 87 GLU H H 87 7.884 7.550 0.334 1
1 988 . 18 1 1 A 87 87 GLU HA H 87 4.064 4.034 0.030 1
1 993 . 18 1 1 A 87 87 GLU C C 87 178.785 179.536 -0.751 1
1 994 . 18 1 1 A 87 87 GLU CA C 87 58.999 58.750 0.249 1
1 995 . 18 1 1 A 87 87 GLU CB C 87 29.872 29.708 0.164 1
1 997 . 18 1 1 A 87 87 GLU N N 87 118.124 118.826 -0.702 1
1 998 . 18 1 1 A 88 88 ILE H H 88 8.715 7.676 1.039 1
1 999 . 18 1 1 A 88 88 ILE HA H 88 3.305 3.522 -0.217 1
1 1009 . 18 1 1 A 88 88 ILE C C 88 177.261 177.922 -0.661 1
1 1010 . 18 1 1 A 88 88 ILE CA C 88 65.822 65.333 0.489 1
1 1011 . 18 1 1 A 88 88 ILE CB C 88 37.370 37.637 -0.267 1
1 1015 . 18 1 1 A 88 88 ILE N N 88 122.929 120.671 2.258 1
1 1016 . 18 1 1 A 89 89 LEU H H 89 8.486 8.873 -0.387 1
1 1017 . 18 1 1 A 89 89 LEU HA H 89 3.932 3.941 -0.009 1
1 1023 . 18 1 1 A 89 89 LEU C C 89 177.919 179.264 -1.345 1
1 1024 . 18 1 1 A 89 89 LEU CA C 89 59.060 58.223 0.837 1
1 1025 . 18 1 1 A 89 89 LEU CB C 89 41.129 41.877 -0.748 1
1 1028 . 18 1 1 A 89 89 LEU N N 89 122.696 119.923 2.773 1
1 1029 . 18 1 1 A 90 90 LYS H H 90 7.790 8.004 -0.214 1
1 1030 . 18 1 1 A 90 90 LYS HA H 90 4.061 3.945 0.116 1
1 1035 . 18 1 1 A 90 90 LYS C C 90 178.432 178.778 -0.346 1
1 1036 . 18 1 1 A 90 90 LYS CA C 90 59.840 58.942 0.898 1
1 1037 . 18 1 1 A 90 90 LYS CB C 90 32.582 32.227 0.355 1
1 1039 . 18 1 1 A 90 90 LYS N N 90 118.640 119.244 -0.604 1
1 1040 . 18 1 1 A 91 91 ALA H H 91 8.113 7.944 0.169 1
1 1041 . 18 1 1 A 91 91 ALA HA H 91 4.151 4.107 0.044 1
1 1045 . 18 1 1 A 91 91 ALA C C 91 179.147 179.454 -0.307 1
1 1046 . 18 1 1 A 91 91 ALA CA C 91 54.942 55.290 -0.348 1
1 1047 . 18 1 1 A 91 91 ALA CB C 91 18.242 18.566 -0.324 1
1 1048 . 18 1 1 A 91 91 ALA N N 91 122.939 122.084 0.855 1
1 1049 . 18 1 1 A 92 92 SER H H 92 8.858 8.511 0.347 1
1 1050 . 18 1 1 A 92 92 SER HA H 92 4.898 4.164 0.734 1
1 1052 . 18 1 1 A 92 92 SER C C 92 172.440 177.347 -4.907 1
1 1053 . 18 1 1 A 92 92 SER CA C 92 61.913 61.285 0.628 1
1 1054 . 18 1 1 A 92 92 SER CB C 92 63.081 63.166 -0.085 1
1 1055 . 18 1 1 A 92 92 SER N N 92 114.526 112.786 1.740 1
1 1056 . 18 1 1 A 93 93 ARG H H 93 7.704 8.020 -0.316 1
1 1057 . 18 1 1 A 93 93 ARG HA H 93 4.162 4.121 0.041 1
1 1059 . 18 1 1 A 93 93 ARG C C 93 177.757 179.188 -1.431 1
1 1060 . 18 1 1 A 93 93 ARG CA C 93 59.544 58.762 0.782 1
1 1061 . 18 1 1 A 93 93 ARG CB C 93 30.343 29.636 0.707 1
1 1062 . 18 1 1 A 93 93 ARG N N 93 121.505 121.790 -0.285 1
1 1063 . 18 1 1 A 94 94 LYS H H 94 7.456 7.497 -0.041 1
1 1064 . 18 1 1 A 94 94 LYS HA H 94 4.174 4.181 -0.007 1
1 1071 . 18 1 1 A 94 94 LYS C C 94 178.861 178.446 0.415 1
1 1072 . 18 1 1 A 94 94 LYS CA C 94 59.030 58.906 0.124 1
1 1073 . 18 1 1 A 94 94 LYS CB C 94 32.239 31.730 0.509 1
1 1077 . 18 1 1 A 94 94 LYS N N 94 119.072 120.027 -0.955 1
1 1078 . 18 1 1 A 95 95 LEU H H 95 8.148 7.604 0.544 1
1 1079 . 18 1 1 A 95 95 LEU HA H 95 4.129 4.148 -0.019 1
1 1088 . 18 1 1 A 95 95 LEU C C 95 177.274 178.692 -1.418 1
1 1089 . 18 1 1 A 95 95 LEU CA C 95 57.136 56.840 0.296 1
1 1090 . 18 1 1 A 95 95 LEU CB C 95 41.908 42.532 -0.624 1
1 1093 . 18 1 1 A 95 95 LEU N N 95 119.717 120.606 -0.889 1
1 1094 . 18 1 1 A 96 96 GLN H H 96 7.807 8.177 -0.370 1
1 1095 . 18 1 1 A 96 96 GLN HA H 96 4.242 4.191 0.051 1
1 1102 . 18 1 1 A 96 96 GLN C C 96 175.371 176.228 -0.857 1
1 1103 . 18 1 1 A 96 96 GLN CA C 96 56.397 56.302 0.095 1
1 1104 . 18 1 1 A 96 96 GLN CB C 96 29.123 28.789 0.334 1
1 1106 . 18 1 1 A 96 96 GLN N N 96 114.581 116.006 -1.425 1
1 1108 . 18 1 1 A 97 97 GLY H H 97 7.802 7.843 -0.041 1
1 1109 . 18 1 1 A 97 97 GLY HA2 H 97 3.839 3.963 -0.124 1
1 1110 . 18 1 1 A 97 97 GLY HA3 H 97 4.096 3.964 0.132 1
1 1111 . 18 1 1 A 97 97 GLY C C 97 172.636 173.555 -0.919 1
1 1112 . 18 1 1 A 97 97 GLY CA C 97 46.372 45.015 1.357 1
1 1113 . 18 1 1 A 97 97 GLY N N 97 106.959 107.716 -0.757 1
1 1114 . 18 1 1 A 98 98 ASP H H 98 8.156 7.875 0.281 1
1 1115 . 18 1 1 A 98 98 ASP HA H 98 4.754 4.908 -0.154 1
1 1118 . 18 1 1 A 98 98 ASP CA C 98 52.882 50.624 2.258 1
1 1119 . 18 1 1 A 98 98 ASP CB C 98 41.603 42.068 -0.465 1
1 1120 . 18 1 1 A 98 98 ASP N N 98 118.447 121.030 -2.583 1
1 1121 . 18 1 1 A 99 99 PRO HA H 99 4.470 4.291 0.179 1
1 1126 . 18 1 1 A 99 99 PRO C C 99 175.500 177.424 -1.924 1
1 1127 . 18 1 1 A 99 99 PRO CA C 99 63.601 65.822 -2.221 1
1 1128 . 18 1 1 A 99 99 PRO CB C 99 32.423 31.454 0.969 1
1 1130 . 18 1 1 A 100 100 ASP H H 100 8.527 7.972 0.555 1
1 1131 . 18 1 1 A 100 100 ASP HA H 100 4.778 4.962 -0.184 1
1 1134 . 18 1 1 A 100 100 ASP C C 100 174.931 175.365 -0.434 1
1 1135 . 18 1 1 A 100 100 ASP CA C 100 53.915 53.015 0.900 1
1 1136 . 18 1 1 A 100 100 ASP CB C 100 40.665 41.659 -0.994 1
1 1137 . 18 1 1 A 100 100 ASP N N 100 119.340 115.423 3.917 1
1 1138 . 18 1 1 A 101 101 LEU H H 101 7.379 7.227 0.152 1
1 1139 . 18 1 1 A 101 101 LEU HA H 101 4.682 4.333 0.349 1
1 1148 . 18 1 1 A 101 101 LEU CA C 101 52.956 53.446 -0.490 1
1 1149 . 18 1 1 A 101 101 LEU CB C 101 43.393 42.878 0.515 1
1 1152 . 18 1 1 A 101 101 LEU N N 101 122.107 122.874 -0.767 1
1 1153 . 18 1 1 A 102 102 PRO HA H 102 4.487 4.759 -0.272 1
1 1158 . 18 1 1 A 102 102 PRO C C 102 175.697 175.113 0.584 1
1 1159 . 18 1 1 A 102 102 PRO CA C 102 63.113 62.968 0.145 1
1 1160 . 18 1 1 A 102 102 PRO CB C 102 32.138 31.748 0.390 1
1 1163 . 18 1 1 A 103 103 MET H H 103 9.011 8.775 0.236 1
1 1164 . 18 1 1 A 103 103 MET HA H 103 4.769 4.915 -0.146 1
1 1171 . 18 1 1 A 103 103 MET C C 103 174.080 174.464 -0.384 1
1 1172 . 18 1 1 A 103 103 MET CA C 103 54.737 53.940 0.797 1
1 1173 . 18 1 1 A 103 103 MET CB C 103 34.857 34.869 -0.012 1
1 1176 . 18 1 1 A 103 103 MET N N 103 123.334 122.288 1.046 1
1 1177 . 18 1 1 A 104 104 SER H H 104 8.239 8.598 -0.359 1
1 1178 . 18 1 1 A 104 104 SER HA H 104 5.079 4.937 0.142 1
1 1181 . 18 1 1 A 104 104 SER C C 104 171.795 172.989 -1.194 1
1 1182 . 18 1 1 A 104 104 SER CA C 104 57.641 57.338 0.303 1
1 1183 . 18 1 1 A 104 104 SER CB C 104 66.282 66.121 0.161 1
1 1184 . 18 1 1 A 104 104 SER N N 104 114.434 114.362 0.072 1
1 1185 . 18 1 1 A 105 105 PHE H H 105 9.003 8.560 0.443 1
1 1186 . 18 1 1 A 105 105 PHE HA H 105 5.209 5.655 -0.446 1
1 1193 . 18 1 1 A 105 105 PHE C C 105 170.688 172.206 -1.518 1
1 1194 . 18 1 1 A 105 105 PHE CA C 105 56.917 55.928 0.989 1
1 1195 . 18 1 1 A 105 105 PHE CB C 105 41.350 42.116 -0.766 1
1 1196 . 18 1 1 A 105 105 PHE N N 105 116.224 117.436 -1.212 1
1 1197 . 18 1 1 A 106 106 THR H H 106 9.074 9.445 -0.371 1
1 1198 . 18 1 1 A 106 106 THR HA H 106 4.664 4.840 -0.176 1
1 1203 . 18 1 1 A 106 106 THR C C 106 171.767 174.536 -2.769 1
1 1204 . 18 1 1 A 106 106 THR CA C 106 62.162 62.157 0.005 1
1 1205 . 18 1 1 A 106 106 THR CB C 106 70.072 69.909 0.163 1
1 1207 . 18 1 1 A 106 106 THR N N 106 117.469 116.633 0.836 1
1 1208 . 18 1 1 A 107 107 LEU H H 107 9.804 9.464 0.340 1
1 1209 . 18 1 1 A 107 107 LEU HA H 107 4.750 4.758 -0.008 1
1 1219 . 18 1 1 A 107 107 LEU C C 107 172.742 175.653 -2.911 1
1 1220 . 18 1 1 A 107 107 LEU CA C 107 54.151 54.534 -0.383 1
1 1221 . 18 1 1 A 107 107 LEU CB C 107 44.486 41.534 2.952 1
1 1224 . 18 1 1 A 107 107 LEU N N 107 133.400 128.342 5.058 1
1 1225 . 18 1 1 A 108 108 ALA H H 108 8.435 8.698 -0.263 1
1 1226 . 18 1 1 A 108 108 ALA HA H 108 4.683 4.417 0.266 1
1 1230 . 18 1 1 A 108 108 ALA C C 108 173.052 175.937 -2.885 1
1 1231 . 18 1 1 A 108 108 ALA CA C 108 49.308 50.859 -1.551 1
1 1232 . 18 1 1 A 108 108 ALA CB C 108 22.120 19.514 2.606 1
1 1233 . 18 1 1 A 108 108 ALA N N 108 131.422 128.224 3.198 1
1 1234 . 18 1 1 A 109 109 ILE H H 109 8.909 8.755 0.154 1
1 1235 . 18 1 1 A 109 109 ILE HA H 109 4.063 5.143 -1.080 1
1 1245 . 18 1 1 A 109 109 ILE CA C 109 60.982 60.178 0.804 1
1 1246 . 18 1 1 A 109 109 ILE CB C 109 39.074 38.512 0.562 1
1 1250 . 18 1 1 A 109 109 ILE N N 109 124.415 123.914 0.501 1
1 1251 . 18 1 1 A 110 110 VAL H H 110 8.706 8.762 -0.056 1
1 1252 . 18 1 1 A 110 110 VAL HA H 110 4.324 5.344 -1.020 1
1 1260 . 18 1 1 A 110 110 VAL C C 110 175.700 173.084 2.616 1
1 1261 . 18 1 1 A 110 110 VAL CA C 110 62.316 59.541 2.775 1
1 1262 . 18 1 1 A 110 110 VAL CB C 110 31.876 34.347 -2.471 1
1 1264 . 18 1 1 A 110 110 VAL N N 110 127.457 127.952 -0.495 1
1 1265 . 18 1 1 A 111 111 GLU H H 111 9.024 8.723 0.301 1
1 1266 . 18 1 1 A 111 111 GLU HA H 111 4.403 4.708 -0.305 1
1 1269 . 18 1 1 A 111 111 GLU C C 111 175.987 178.026 -2.039 1
1 1270 . 18 1 1 A 111 111 GLU CA C 111 56.842 54.730 2.112 1
1 1271 . 18 1 1 A 111 111 GLU CB C 111 31.044 32.462 -1.418 1
1 1272 . 18 1 1 A 111 111 GLU N N 111 129.768 129.707 0.061 1
1 1273 . 18 1 1 A 112 112 SER H H 112 9.143 8.840 0.303 1
1 1274 . 18 1 1 A 112 112 SER HA H 112 4.394 4.324 0.070 1
1 1276 . 18 1 1 A 112 112 SER C C 112 173.187 174.757 -1.570 1
1 1277 . 18 1 1 A 112 112 SER CA C 112 60.180 60.959 -0.779 1
1 1278 . 18 1 1 A 112 112 SER CB C 112 63.415 62.894 0.521 1
1 1279 . 18 1 1 A 112 112 SER N N 112 115.956 119.412 -3.456 1
1 1280 . 18 1 1 A 113 113 ASP H H 113 8.133 7.860 0.273 1
1 1281 . 18 1 1 A 113 113 ASP HA H 113 4.573 4.807 -0.234 1
1 1284 . 18 1 1 A 113 113 ASP C C 113 175.430 175.004 0.426 1
1 1285 . 18 1 1 A 113 113 ASP CA C 113 54.115 53.676 0.439 1
1 1286 . 18 1 1 A 113 113 ASP CB C 113 40.011 41.003 -0.992 1
1 1287 . 18 1 1 A 113 113 ASP N N 113 118.343 120.507 -2.164 1
1 1288 . 18 1 1 A 114 114 SER H H 114 8.034 7.789 0.245 1
1 1289 . 18 1 1 A 114 114 SER HA H 114 4.057 4.084 -0.027 1
1 1291 . 18 1 1 A 114 114 SER C C 114 172.209 172.820 -0.611 1
1 1292 . 18 1 1 A 114 114 SER CA C 114 60.179 59.482 0.697 1
1 1293 . 18 1 1 A 114 114 SER CB C 114 62.702 61.348 1.354 1
1 1294 . 18 1 1 A 114 114 SER N N 114 109.836 111.457 -1.621 1
1 1295 . 18 1 1 A 115 115 THR H H 115 7.711 7.703 0.008 1
1 1296 . 18 1 1 A 115 115 THR HA H 115 4.250 4.592 -0.342 1
1 1300 . 18 1 1 A 115 115 THR C C 115 171.500 173.762 -2.262 1
1 1301 . 18 1 1 A 115 115 THR CA C 115 63.547 60.430 3.117 1
1 1302 . 18 1 1 A 115 115 THR CB C 115 69.595 69.939 -0.344 1
1 1303 . 18 1 1 A 115 115 THR N N 115 117.407 111.548 5.859 1
1 1304 . 18 1 1 A 116 116 ILE H H 116 8.219 9.182 -0.963 1
1 1305 . 18 1 1 A 116 116 ILE HA H 116 4.769 5.037 -0.268 1
1 1315 . 18 1 1 A 116 116 ILE C C 116 174.434 174.674 -0.240 1
1 1316 . 18 1 1 A 116 116 ILE CA C 116 60.306 59.367 0.939 1
1 1317 . 18 1 1 A 116 116 ILE CB C 116 40.686 39.145 1.541 1
1 1321 . 18 1 1 A 116 116 ILE N N 116 125.480 126.933 -1.453 1
1 1322 . 18 1 1 A 117 117 VAL H H 117 8.695 9.347 -0.652 1
1 1323 . 18 1 1 A 117 117 VAL HA H 117 4.315 4.467 -0.152 1
1 1328 . 18 1 1 A 117 117 VAL C C 117 172.243 174.599 -2.356 1
1 1329 . 18 1 1 A 117 117 VAL CA C 117 60.621 61.209 -0.588 1
1 1330 . 18 1 1 A 117 117 VAL CB C 117 34.558 32.668 1.890 1
1 1332 . 18 1 1 A 117 117 VAL N N 117 127.887 127.229 0.658 1
1 1333 . 18 1 1 A 118 118 TYR H H 118 8.270 8.955 -0.685 1
1 1334 . 18 1 1 A 118 118 TYR HA H 118 5.327 5.151 0.176 1
1 1342 . 18 1 1 A 118 118 TYR C C 118 174.250 174.890 -0.640 1
1 1343 . 18 1 1 A 118 118 TYR CA C 118 57.283 57.634 -0.351 1
1 1344 . 18 1 1 A 118 118 TYR CB C 118 39.262 39.328 -0.066 1
1 1345 . 18 1 1 A 118 118 TYR N N 118 124.822 127.152 -2.330 1
1 1346 . 18 1 1 A 119 119 TYR H H 119 9.207 8.983 0.224 1
1 1347 . 18 1 1 A 119 119 TYR HA H 119 4.821 5.334 -0.513 1
1 1354 . 18 1 1 A 119 119 TYR C C 119 171.994 173.523 -1.529 1
1 1355 . 18 1 1 A 119 119 TYR CA C 119 58.116 56.754 1.362 1
1 1356 . 18 1 1 A 119 119 TYR CB C 119 43.544 42.068 1.476 1
1 1357 . 18 1 1 A 119 119 TYR N N 119 125.153 124.417 0.736 1
1 1358 . 18 1 1 A 120 120 LYS H H 120 7.700 8.713 -1.013 1
1 1359 . 18 1 1 A 120 120 LYS HA H 120 4.558 4.665 -0.107 1
1 1366 . 18 1 1 A 120 120 LYS C C 120 172.017 174.851 -2.834 1
1 1367 . 18 1 1 A 120 120 LYS CA C 120 57.217 55.717 1.500 1
1 1368 . 18 1 1 A 120 120 LYS CB C 120 33.914 33.587 0.327 1
1 1372 . 18 1 1 A 120 120 LYS N N 120 129.442 129.517 -0.075 1
1 1373 . 18 1 1 A 121 121 LEU H H 121 8.112 8.521 -0.409 1
1 1374 . 18 1 1 A 121 121 LEU HA H 121 5.323 5.132 0.191 1
1 1384 . 18 1 1 A 121 121 LEU C C 121 175.733 174.071 1.662 1
1 1385 . 18 1 1 A 121 121 LEU CA C 121 52.716 52.973 -0.257 1
1 1386 . 18 1 1 A 121 121 LEU CB C 121 44.098 46.347 -2.249 1
1 1389 . 18 1 1 A 121 121 LEU N N 121 123.403 127.579 -4.176 1
1 1390 . 18 1 1 A 122 122 THR H H 122 8.338 8.802 -0.464 1
1 1391 . 18 1 1 A 122 122 THR HA H 122 5.097 4.951 0.146 1
1 1396 . 18 1 1 A 122 122 THR C C 122 173.221 171.460 1.761 1
1 1397 . 18 1 1 A 122 122 THR CA C 122 60.306 59.456 0.850 1
1 1398 . 18 1 1 A 122 122 THR CB C 122 72.473 71.932 0.541 1
1 1400 . 18 1 1 A 122 122 THR N N 122 109.081 118.523 -9.442 1
1 7 . 19 1 1 A 2 2 GLU H H 2 8.994 7.773 1.221 1
1 8 . 19 1 1 A 2 2 GLU HA H 2 4.278 4.581 -0.303 1
1 13 . 19 1 1 A 2 2 GLU C C 2 175.315 176.656 -1.341 1
1 14 . 19 1 1 A 2 2 GLU CA C 2 57.318 55.934 1.384 1
1 15 . 19 1 1 A 2 2 GLU CB C 2 29.221 30.100 -0.879 1
1 17 . 19 1 1 A 2 2 GLU N N 2 122.259 116.958 5.301 1
1 18 . 19 1 1 A 3 3 ASP H H 3 8.048 7.880 0.168 1
1 19 . 19 1 1 A 3 3 ASP HA H 3 4.580 4.403 0.177 1
1 21 . 19 1 1 A 3 3 ASP C C 3 175.636 176.228 -0.592 1
1 22 . 19 1 1 A 3 3 ASP CA C 3 54.579 53.266 1.313 1
1 23 . 19 1 1 A 3 3 ASP CB C 3 40.984 39.703 1.281 1
1 24 . 19 1 1 A 3 3 ASP N N 3 119.830 119.870 -0.040 1
1 25 . 19 1 1 A 4 4 ALA H H 4 8.090 7.979 0.111 1
1 26 . 19 1 1 A 4 4 ALA HA H 4 4.216 3.920 0.296 1
1 30 . 19 1 1 A 4 4 ALA C C 4 177.157 179.599 -2.442 1
1 31 . 19 1 1 A 4 4 ALA CA C 4 53.620 54.444 -0.824 1
1 32 . 19 1 1 A 4 4 ALA CB C 4 18.728 18.360 0.368 1
1 33 . 19 1 1 A 4 4 ALA N N 4 123.957 122.371 1.586 1
1 34 . 19 1 1 A 5 5 TRP H H 5 7.941 8.023 -0.082 1
1 35 . 19 1 1 A 5 5 TRP HA H 5 4.559 4.488 0.071 1
1 39 . 19 1 1 A 5 5 TRP C C 5 176.072 176.853 -0.781 1
1 40 . 19 1 1 A 5 5 TRP CA C 5 57.744 59.181 -1.437 1
1 41 . 19 1 1 A 5 5 TRP CB C 5 28.906 28.154 0.752 1
1 42 . 19 1 1 A 5 5 TRP N N 5 118.408 118.075 0.333 1
1 44 . 19 1 1 A 6 6 MET H H 6 7.679 7.631 0.048 1
1 45 . 19 1 1 A 6 6 MET HA H 6 3.785 4.661 -0.876 1
1 52 . 19 1 1 A 6 6 MET C C 6 175.174 176.597 -1.423 1
1 53 . 19 1 1 A 6 6 MET CA C 6 57.724 54.940 2.784 1
1 54 . 19 1 1 A 6 6 MET CB C 6 31.640 34.153 -2.513 1
1 57 . 19 1 1 A 6 6 MET N N 6 121.538 116.682 4.856 1
1 58 . 19 1 1 A 7 7 GLY H H 7 7.247 7.997 -0.750 1
1 59 . 19 1 1 A 7 7 GLY HA2 H 7 3.455 3.999 -0.544 1
1 60 . 19 1 1 A 7 7 GLY HA3 H 7 3.578 4.024 -0.446 1
1 61 . 19 1 1 A 7 7 GLY C C 7 172.852 174.278 -1.426 1
1 62 . 19 1 1 A 7 7 GLY CA C 7 45.896 45.885 0.011 1
1 63 . 19 1 1 A 7 7 GLY N N 7 104.055 106.802 -2.747 1
1 64 . 19 1 1 A 8 8 THR H H 8 7.436 7.699 -0.263 1
1 65 . 19 1 1 A 8 8 THR HA H 8 4.428 3.529 0.899 1
1 70 . 19 1 1 A 8 8 THR C C 8 172.973 172.896 0.077 1
1 71 . 19 1 1 A 8 8 THR CA C 8 60.751 61.922 -1.171 1
1 72 . 19 1 1 A 8 8 THR CB C 8 69.637 66.596 3.041 1
1 74 . 19 1 1 A 8 8 THR N N 8 107.669 110.208 -2.539 1
1 75 . 19 1 1 A 9 9 HIS H H 9 8.048 7.746 0.302 1
1 76 . 19 1 1 A 9 9 HIS HA H 9 4.654 4.961 -0.307 1
1 79 . 19 1 1 A 9 9 HIS CA C 9 56.163 53.644 2.519 1
1 80 . 19 1 1 A 9 9 HIS CB C 9 32.619 32.114 0.505 1
1 81 . 19 1 1 A 9 9 HIS N N 9 127.281 118.760 8.521 1
1 82 . 19 1 1 A 10 10 PRO HA H 10 4.257 4.237 0.020 1
1 88 . 19 1 1 A 10 10 PRO C C 10 178.779 179.110 -0.331 1
1 89 . 19 1 1 A 10 10 PRO CA C 10 65.565 66.053 -0.488 1
1 90 . 19 1 1 A 10 10 PRO CB C 10 32.422 31.878 0.544 1
1 93 . 19 1 1 A 11 11 LYS H H 11 10.994 8.529 2.465 1
1 94 . 19 1 1 A 11 11 LYS HA H 11 4.282 4.184 0.098 1
1 100 . 19 1 1 A 11 11 LYS C C 11 177.279 178.450 -1.171 1
1 101 . 19 1 1 A 11 11 LYS CA C 11 56.859 59.253 -2.394 1
1 102 . 19 1 1 A 11 11 LYS CB C 11 31.279 32.604 -1.325 1
1 104 . 19 1 1 A 11 11 LYS N N 11 121.398 118.336 3.062 1
1 105 . 19 1 1 A 12 12 TYR H H 12 7.146 8.224 -1.078 1
1 106 . 19 1 1 A 12 12 TYR HA H 12 3.722 4.147 -0.425 1
1 113 . 19 1 1 A 12 12 TYR C C 12 176.265 177.313 -1.048 1
1 114 . 19 1 1 A 12 12 TYR CA C 12 61.189 61.207 -0.018 1
1 115 . 19 1 1 A 12 12 TYR CB C 12 37.796 38.046 -0.250 1
1 116 . 19 1 1 A 12 12 TYR N N 12 121.579 122.394 -0.815 1
1 117 . 19 1 1 A 13 13 LEU H H 13 7.778 8.949 -1.171 1
1 118 . 19 1 1 A 13 13 LEU HA H 13 3.773 3.872 -0.099 1
1 127 . 19 1 1 A 13 13 LEU C C 13 178.462 179.095 -0.633 1
1 128 . 19 1 1 A 13 13 LEU CA C 13 57.942 57.968 -0.026 1
1 129 . 19 1 1 A 13 13 LEU CB C 13 41.064 41.241 -0.177 1
1 132 . 19 1 1 A 13 13 LEU N N 13 117.518 119.903 -2.385 1
1 133 . 19 1 1 A 14 14 GLU H H 14 7.867 8.550 -0.683 1
1 134 . 19 1 1 A 14 14 GLU HA H 14 3.935 3.944 -0.009 1
1 139 . 19 1 1 A 14 14 GLU C C 14 178.326 178.801 -0.475 1
1 140 . 19 1 1 A 14 14 GLU CA C 14 59.368 59.712 -0.344 1
1 141 . 19 1 1 A 14 14 GLU CB C 14 30.147 29.233 0.914 1
1 143 . 19 1 1 A 14 14 GLU N N 14 119.135 120.267 -1.132 1
1 144 . 19 1 1 A 15 15 MET H H 15 7.773 7.797 -0.024 1
1 145 . 19 1 1 A 15 15 MET HA H 15 3.936 4.238 -0.302 1
1 152 . 19 1 1 A 15 15 MET C C 15 177.886 178.335 -0.449 1
1 153 . 19 1 1 A 15 15 MET CA C 15 59.465 58.172 1.293 1
1 154 . 19 1 1 A 15 15 MET CB C 15 33.987 32.470 1.517 1
1 157 . 19 1 1 A 15 15 MET N N 15 117.884 119.493 -1.609 1
1 158 . 19 1 1 A 16 16 MET H H 16 8.145 8.391 -0.246 1
1 159 . 19 1 1 A 16 16 MET HA H 16 4.159 4.208 -0.049 1
1 166 . 19 1 1 A 16 16 MET C C 16 177.835 178.573 -0.738 1
1 167 . 19 1 1 A 16 16 MET CA C 16 57.397 58.155 -0.758 1
1 168 . 19 1 1 A 16 16 MET CB C 16 31.867 32.074 -0.207 1
1 171 . 19 1 1 A 16 16 MET N N 16 119.555 119.479 0.076 1
1 172 . 19 1 1 A 17 17 GLU H H 17 7.761 8.872 -1.111 1
1 173 . 19 1 1 A 17 17 GLU HA H 17 4.117 4.127 -0.010 1
1 176 . 19 1 1 A 17 17 GLU C C 17 175.994 177.017 -1.023 1
1 177 . 19 1 1 A 17 17 GLU CA C 17 57.392 58.109 -0.717 1
1 178 . 19 1 1 A 17 17 GLU CB C 17 29.432 29.857 -0.425 1
1 180 . 19 1 1 A 17 17 GLU N N 17 118.216 118.797 -0.581 1
1 181 . 19 1 1 A 18 18 LEU H H 18 7.201 7.373 -0.172 1
1 182 . 19 1 1 A 18 18 LEU HA H 18 4.111 4.305 -0.194 1
1 191 . 19 1 1 A 18 18 LEU C C 18 175.781 177.184 -1.403 1
1 192 . 19 1 1 A 18 18 LEU CA C 18 56.366 54.867 1.499 1
1 193 . 19 1 1 A 18 18 LEU CB C 18 42.030 42.422 -0.392 1
1 196 . 19 1 1 A 18 18 LEU N N 18 117.448 122.900 -5.452 1
1 197 . 19 1 1 A 19 19 ASP H H 19 7.789 8.954 -1.165 1
1 198 . 19 1 1 A 19 19 ASP HA H 19 4.360 4.768 -0.408 1
1 201 . 19 1 1 A 19 19 ASP C C 19 173.765 176.263 -2.498 1
1 202 . 19 1 1 A 19 19 ASP CA C 19 54.851 54.523 0.328 1
1 203 . 19 1 1 A 19 19 ASP CB C 19 39.115 41.148 -2.033 1
1 204 . 19 1 1 A 19 19 ASP N N 19 115.844 120.566 -4.722 1
1 205 . 19 1 1 A 20 20 ILE H H 20 8.142 7.617 0.525 1
1 206 . 19 1 1 A 20 20 ILE HA H 20 4.128 4.167 -0.039 1
1 216 . 19 1 1 A 20 20 ILE C C 20 174.710 176.995 -2.285 1
1 217 . 19 1 1 A 20 20 ILE CA C 20 60.465 62.981 -2.516 1
1 218 . 19 1 1 A 20 20 ILE CB C 20 40.407 38.510 1.897 1
1 222 . 19 1 1 A 20 20 ILE N N 20 117.287 116.649 0.638 1
1 223 . 19 1 1 A 21 21 GLY H H 21 8.207 8.450 -0.243 1
1 224 . 19 1 1 A 21 21 GLY HA2 H 21 3.889 3.982 -0.093 1
1 225 . 19 1 1 A 21 21 GLY HA3 H 21 3.924 3.986 -0.062 1
1 226 . 19 1 1 A 21 21 GLY C C 21 172.162 173.654 -1.492 1
1 227 . 19 1 1 A 21 21 GLY CA C 21 45.017 46.311 -1.294 1
1 228 . 19 1 1 A 21 21 GLY N N 21 110.656 109.478 1.178 1
1 229 . 19 1 1 A 22 22 ASP H H 22 7.727 7.988 -0.261 1
1 230 . 19 1 1 A 22 22 ASP HA H 22 4.794 5.030 -0.236 1
1 233 . 19 1 1 A 22 22 ASP C C 22 174.884 175.968 -1.084 1
1 234 . 19 1 1 A 22 22 ASP CA C 22 52.471 52.947 -0.476 1
1 235 . 19 1 1 A 22 22 ASP CB C 22 42.069 42.785 -0.716 1
1 236 . 19 1 1 A 22 22 ASP N N 22 119.305 119.863 -0.558 1
1 237 . 19 1 1 A 23 23 ALA H H 23 8.644 9.126 -0.482 1
1 238 . 19 1 1 A 23 23 ALA HA H 23 4.120 4.082 0.038 1
1 242 . 19 1 1 A 23 23 ALA C C 23 179.546 179.819 -0.273 1
1 243 . 19 1 1 A 23 23 ALA CA C 23 55.609 55.123 0.486 1
1 244 . 19 1 1 A 23 23 ALA CB C 23 18.573 18.530 0.043 1
1 245 . 19 1 1 A 23 23 ALA N N 23 122.468 128.759 -6.291 1
1 246 . 19 1 1 A 24 24 THR H H 24 8.238 7.943 0.295 1
1 247 . 19 1 1 A 24 24 THR HA H 24 4.184 4.052 0.132 1
1 252 . 19 1 1 A 24 24 THR C C 24 174.841 176.867 -2.026 1
1 253 . 19 1 1 A 24 24 THR CA C 24 66.241 66.500 -0.259 1
1 254 . 19 1 1 A 24 24 THR CB C 24 68.376 68.228 0.148 1
1 256 . 19 1 1 A 24 24 THR N N 24 114.824 114.282 0.542 1
1 257 . 19 1 1 A 25 25 GLN H H 25 8.037 8.624 -0.587 1
1 258 . 19 1 1 A 25 25 GLN HA H 25 4.095 4.030 0.065 1
1 265 . 19 1 1 A 25 25 GLN C C 25 177.603 178.686 -1.083 1
1 266 . 19 1 1 A 25 25 GLN CA C 25 59.261 58.774 0.487 1
1 267 . 19 1 1 A 25 25 GLN CB C 25 28.437 28.351 0.086 1
1 269 . 19 1 1 A 25 25 GLN N N 25 122.518 120.124 2.394 1
1 271 . 19 1 1 A 26 26 VAL H H 26 7.994 8.189 -0.195 1
1 272 . 19 1 1 A 26 26 VAL HA H 26 3.469 3.781 -0.312 1
1 280 . 19 1 1 A 26 26 VAL C C 26 175.552 178.006 -2.454 1
1 281 . 19 1 1 A 26 26 VAL CA C 26 66.909 66.383 0.526 1
1 282 . 19 1 1 A 26 26 VAL CB C 26 31.582 31.550 0.032 1
1 285 . 19 1 1 A 26 26 VAL N N 26 119.112 120.616 -1.504 1
1 286 . 19 1 1 A 27 27 TYR H H 27 8.003 8.654 -0.651 1
1 287 . 19 1 1 A 27 27 TYR HA H 27 4.357 4.048 0.309 1
1 294 . 19 1 1 A 27 27 TYR C C 27 175.856 176.787 -0.931 1
1 295 . 19 1 1 A 27 27 TYR CA C 27 62.197 61.544 0.653 1
1 296 . 19 1 1 A 27 27 TYR CB C 27 38.394 38.734 -0.340 1
1 297 . 19 1 1 A 27 27 TYR N N 27 119.170 120.908 -1.738 1
1 298 . 19 1 1 A 28 28 VAL H H 28 8.087 8.536 -0.449 1
1 299 . 19 1 1 A 28 28 VAL HA H 28 3.652 3.322 0.330 1
1 307 . 19 1 1 A 28 28 VAL C C 28 176.134 177.886 -1.752 1
1 308 . 19 1 1 A 28 28 VAL CA C 28 66.247 66.218 0.029 1
1 309 . 19 1 1 A 28 28 VAL CB C 28 31.241 31.440 -0.199 1
1 312 . 19 1 1 A 28 28 VAL N N 28 113.112 119.256 -6.144 1
1 313 . 19 1 1 A 29 29 ALA H H 29 7.853 8.781 -0.928 1
1 314 . 19 1 1 A 29 29 ALA HA H 29 3.913 4.015 -0.102 1
1 318 . 19 1 1 A 29 29 ALA C C 29 177.850 178.997 -1.147 1
1 319 . 19 1 1 A 29 29 ALA CA C 29 55.274 54.971 0.303 1
1 320 . 19 1 1 A 29 29 ALA CB C 29 17.876 18.377 -0.501 1
1 321 . 19 1 1 A 29 29 ALA N N 29 121.350 122.501 -1.151 1
1 322 . 19 1 1 A 30 30 PHE H H 30 8.724 8.305 0.419 1
1 323 . 19 1 1 A 30 30 PHE HA H 30 4.098 4.161 -0.063 1
1 327 . 19 1 1 A 30 30 PHE C C 30 175.035 177.084 -2.049 1
1 328 . 19 1 1 A 30 30 PHE CA C 30 61.264 61.436 -0.172 1
1 329 . 19 1 1 A 30 30 PHE CB C 30 38.926 39.063 -0.137 1
1 330 . 19 1 1 A 30 30 PHE N N 30 120.478 119.777 0.701 1
1 331 . 19 1 1 A 31 31 LEU H H 31 8.146 7.788 0.358 1
1 332 . 19 1 1 A 31 31 LEU HA H 31 3.597 3.599 -0.002 1
1 341 . 19 1 1 A 31 31 LEU C C 31 179.508 179.185 0.323 1
1 342 . 19 1 1 A 31 31 LEU CA C 31 57.884 57.985 -0.101 1
1 343 . 19 1 1 A 31 31 LEU CB C 31 41.829 42.028 -0.199 1
1 346 . 19 1 1 A 31 31 LEU N N 31 118.427 120.261 -1.834 1
1 347 . 19 1 1 A 32 32 VAL H H 32 7.627 7.668 -0.041 1
1 348 . 19 1 1 A 32 32 VAL HA H 32 3.464 3.799 -0.335 1
1 356 . 19 1 1 A 32 32 VAL C C 32 174.956 177.546 -2.590 1
1 357 . 19 1 1 A 32 32 VAL CA C 32 66.373 65.744 0.629 1
1 358 . 19 1 1 A 32 32 VAL CB C 32 31.121 31.445 -0.324 1
1 361 . 19 1 1 A 32 32 VAL N N 32 119.497 114.583 4.914 1
1 362 . 19 1 1 A 33 33 TYR H H 33 8.366 8.636 -0.270 1
1 363 . 19 1 1 A 33 33 TYR HA H 33 3.485 3.893 -0.408 1
1 370 . 19 1 1 A 33 33 TYR C C 33 174.883 176.801 -1.918 1
1 371 . 19 1 1 A 33 33 TYR CA C 33 62.866 61.389 1.477 1
1 372 . 19 1 1 A 33 33 TYR CB C 33 37.778 38.313 -0.535 1
1 373 . 19 1 1 A 33 33 TYR N N 33 121.842 124.160 -2.318 1
1 374 . 19 1 1 A 34 34 LEU H H 34 8.000 8.234 -0.234 1
1 375 . 19 1 1 A 34 34 LEU HA H 34 3.495 3.499 -0.004 1
1 385 . 19 1 1 A 34 34 LEU C C 34 178.240 178.972 -0.732 1
1 386 . 19 1 1 A 34 34 LEU CA C 34 57.453 57.272 0.181 1
1 387 . 19 1 1 A 34 34 LEU CB C 34 41.828 40.816 1.012 1
1 390 . 19 1 1 A 34 34 LEU N N 34 116.692 119.084 -2.392 1
1 391 . 19 1 1 A 35 35 ASP H H 35 7.688 7.936 -0.248 1
1 392 . 19 1 1 A 35 35 ASP HA H 35 4.302 4.235 0.067 1
1 395 . 19 1 1 A 35 35 ASP C C 35 177.507 178.499 -0.992 1
1 396 . 19 1 1 A 35 35 ASP CA C 35 58.196 57.442 0.754 1
1 397 . 19 1 1 A 35 35 ASP CB C 35 43.070 41.117 1.953 1
1 398 . 19 1 1 A 35 35 ASP N N 35 120.507 120.216 0.291 1
1 399 . 19 1 1 A 36 36 LEU H H 36 8.482 8.272 0.210 1
1 400 . 19 1 1 A 36 36 LEU HA H 36 3.328 3.576 -0.248 1
1 410 . 19 1 1 A 36 36 LEU C C 36 176.774 178.851 -2.077 1
1 411 . 19 1 1 A 36 36 LEU CA C 36 57.461 57.637 -0.176 1
1 412 . 19 1 1 A 36 36 LEU CB C 36 41.344 41.126 0.218 1
1 416 . 19 1 1 A 36 36 LEU N N 36 117.671 120.748 -3.077 1
1 417 . 19 1 1 A 37 37 MET H H 37 7.822 7.698 0.124 1
1 418 . 19 1 1 A 37 37 MET HA H 37 4.401 3.881 0.520 1
1 425 . 19 1 1 A 37 37 MET C C 37 177.862 177.601 0.261 1
1 426 . 19 1 1 A 37 37 MET CA C 37 56.434 58.716 -2.282 1
1 427 . 19 1 1 A 37 37 MET CB C 37 31.573 32.385 -0.812 1
1 430 . 19 1 1 A 37 37 MET N N 37 112.952 116.282 -3.330 1
1 431 . 19 1 1 A 38 38 GLU H H 38 8.667 8.083 0.584 1
1 432 . 19 1 1 A 38 38 GLU HA H 38 4.457 4.168 0.289 1
1 436 . 19 1 1 A 38 38 GLU C C 38 176.582 177.857 -1.275 1
1 437 . 19 1 1 A 38 38 GLU CA C 38 57.659 57.315 0.344 1
1 438 . 19 1 1 A 38 38 GLU CB C 38 29.936 29.917 0.019 1
1 440 . 19 1 1 A 38 38 GLU N N 38 116.463 117.119 -0.656 1
1 441 . 19 1 1 A 39 39 SER H H 39 7.657 8.029 -0.372 1
1 442 . 19 1 1 A 39 39 SER HA H 39 4.658 4.668 -0.010 1
1 445 . 19 1 1 A 39 39 SER C C 39 175.661 176.129 -0.468 1
1 446 . 19 1 1 A 39 39 SER CA C 39 60.449 59.604 0.845 1
1 447 . 19 1 1 A 39 39 SER CB C 39 63.341 64.506 -1.165 1
1 448 . 19 1 1 A 39 39 SER N N 39 113.870 116.120 -2.250 1
1 449 . 19 1 1 A 40 40 LYS H H 40 8.165 7.504 0.661 1
1 450 . 19 1 1 A 40 40 LYS HA H 40 4.454 4.367 0.087 1
1 458 . 19 1 1 A 40 40 LYS C C 40 174.970 176.123 -1.153 1
1 459 . 19 1 1 A 40 40 LYS CA C 40 55.753 55.836 -0.083 1
1 460 . 19 1 1 A 40 40 LYS CB C 40 32.337 32.720 -0.383 1
1 464 . 19 1 1 A 40 40 LYS N N 40 116.671 118.690 -2.019 1
1 465 . 19 1 1 A 41 41 SER H H 41 7.017 7.678 -0.661 1
1 466 . 19 1 1 A 41 41 SER HA H 41 4.209 4.283 -0.074 1
1 469 . 19 1 1 A 41 41 SER C C 41 173.770 173.606 0.164 1
1 470 . 19 1 1 A 41 41 SER CA C 41 58.435 59.071 -0.636 1
1 471 . 19 1 1 A 41 41 SER CB C 41 61.700 61.455 0.245 1
1 472 . 19 1 1 A 41 41 SER N N 41 109.989 114.304 -4.315 1
1 473 . 19 1 1 A 42 42 TRP H H 42 8.876 8.029 0.847 1
1 474 . 19 1 1 A 42 42 TRP HA H 42 4.698 4.737 -0.039 1
1 478 . 19 1 1 A 42 42 TRP C C 42 174.477 177.556 -3.079 1
1 479 . 19 1 1 A 42 42 TRP CA C 42 59.443 57.599 1.844 1
1 480 . 19 1 1 A 42 42 TRP CB C 42 28.203 30.570 -2.367 1
1 481 . 19 1 1 A 42 42 TRP N N 42 121.116 124.692 -3.576 1
1 483 . 19 1 1 A 43 43 HIS H H 43 8.132 8.825 -0.693 1
1 484 . 19 1 1 A 43 43 HIS HA H 43 4.445 4.453 -0.008 1
1 488 . 19 1 1 A 43 43 HIS C C 43 174.405 174.317 0.088 1
1 489 . 19 1 1 A 43 43 HIS CA C 43 58.556 59.219 -0.663 1
1 490 . 19 1 1 A 43 43 HIS CB C 43 29.430 31.096 -1.666 1
1 491 . 19 1 1 A 43 43 HIS N N 43 119.397 121.539 -2.142 1
1 492 . 19 1 1 A 44 44 GLU H H 44 8.140 7.751 0.389 1
1 493 . 19 1 1 A 44 44 GLU HA H 44 4.432 4.813 -0.381 1
1 497 . 19 1 1 A 44 44 GLU C C 44 173.010 174.677 -1.667 1
1 498 . 19 1 1 A 44 44 GLU CA C 44 56.421 55.779 0.642 1
1 499 . 19 1 1 A 44 44 GLU CB C 44 33.285 33.189 0.096 1
1 501 . 19 1 1 A 44 44 GLU N N 44 116.181 118.081 -1.900 1
1 502 . 19 1 1 A 45 45 VAL H H 45 8.428 8.729 -0.301 1
1 503 . 19 1 1 A 45 45 VAL HA H 45 4.492 5.056 -0.564 1
1 511 . 19 1 1 A 45 45 VAL C C 45 172.339 174.596 -2.257 1
1 512 . 19 1 1 A 45 45 VAL CA C 45 63.071 60.921 2.150 1
1 513 . 19 1 1 A 45 45 VAL CB C 45 35.145 35.684 -0.539 1
1 516 . 19 1 1 A 45 45 VAL N N 45 123.272 126.220 -2.948 1
1 517 . 19 1 1 A 46 46 ASN H H 46 9.050 8.775 0.275 1
1 518 . 19 1 1 A 46 46 ASN HA H 46 5.261 5.354 -0.093 1
1 523 . 19 1 1 A 46 46 ASN C C 46 172.845 173.590 -0.745 1
1 524 . 19 1 1 A 46 46 ASN CA C 46 51.895 51.490 0.405 1
1 525 . 19 1 1 A 46 46 ASN CB C 46 42.322 43.394 -1.072 1
1 526 . 19 1 1 A 46 46 ASN N N 46 123.901 123.668 0.233 1
1 528 . 19 1 1 A 47 47 CYS H H 47 9.039 8.706 0.333 1
1 529 . 19 1 1 A 47 47 CYS HA H 47 5.160 5.227 -0.067 1
1 532 . 19 1 1 A 47 47 CYS C C 47 172.454 173.427 -0.973 1
1 533 . 19 1 1 A 47 47 CYS CA C 47 56.473 56.904 -0.431 1
1 534 . 19 1 1 A 47 47 CYS CB C 47 29.297 30.028 -0.731 1
1 535 . 19 1 1 A 47 47 CYS N N 47 119.663 119.108 0.555 1
1 536 . 19 1 1 A 48 48 VAL H H 48 9.083 9.185 -0.102 1
1 537 . 19 1 1 A 48 48 VAL HA H 48 4.344 4.716 -0.372 1
1 542 . 19 1 1 A 48 48 VAL C C 48 173.307 174.851 -1.544 1
1 543 . 19 1 1 A 48 48 VAL CA C 48 61.368 60.682 0.686 1
1 544 . 19 1 1 A 48 48 VAL CB C 48 35.345 36.161 -0.816 1
1 546 . 19 1 1 A 48 48 VAL N N 48 124.672 124.666 0.006 1
1 547 . 19 1 1 A 49 49 GLY H H 49 9.019 9.026 -0.007 1
1 548 . 19 1 1 A 49 49 GLY HA2 H 49 3.460 4.181 -0.721 1
1 549 . 19 1 1 A 49 49 GLY HA3 H 49 4.539 4.185 0.354 1
1 550 . 19 1 1 A 49 49 GLY C C 49 171.278 172.571 -1.293 1
1 551 . 19 1 1 A 49 49 GLY CA C 49 45.075 44.550 0.525 1
1 552 . 19 1 1 A 49 49 GLY N N 49 113.131 115.000 -1.869 1
1 553 . 19 1 1 A 50 50 LEU H H 50 8.747 9.149 -0.402 1
1 554 . 19 1 1 A 50 50 LEU HA H 50 5.102 4.969 0.133 1
1 564 . 19 1 1 A 50 50 LEU CA C 50 51.417 51.407 0.010 1
1 565 . 19 1 1 A 50 50 LEU CB C 50 41.754 42.098 -0.344 1
1 569 . 19 1 1 A 50 50 LEU N N 50 124.471 126.768 -2.297 1
1 570 . 19 1 1 A 51 51 PRO HA H 51 4.106 4.415 -0.309 1
1 577 . 19 1 1 A 51 51 PRO C C 51 178.422 178.007 0.415 1
1 578 . 19 1 1 A 51 51 PRO CA C 51 65.680 64.510 1.170 1
1 579 . 19 1 1 A 51 51 PRO CB C 51 31.939 32.024 -0.085 1
1 582 . 19 1 1 A 52 52 GLU H H 52 9.721 8.255 1.466 1
1 583 . 19 1 1 A 52 52 GLU HA H 52 4.176 4.127 0.049 1
1 588 . 19 1 1 A 52 52 GLU C C 52 176.146 178.305 -2.159 1
1 589 . 19 1 1 A 52 52 GLU CA C 52 59.158 59.485 -0.327 1
1 590 . 19 1 1 A 52 52 GLU CB C 52 28.442 29.529 -1.087 1
1 592 . 19 1 1 A 52 52 GLU N N 52 118.552 118.100 0.452 1
1 593 . 19 1 1 A 53 53 LEU H H 53 7.089 7.894 -0.805 1
1 594 . 19 1 1 A 53 53 LEU HA H 53 4.511 4.257 0.254 1
1 603 . 19 1 1 A 53 53 LEU C C 53 174.027 176.679 -2.652 1
1 604 . 19 1 1 A 53 53 LEU CA C 53 53.825 55.122 -1.297 1
1 605 . 19 1 1 A 53 53 LEU CB C 53 43.825 41.946 1.879 1
1 608 . 19 1 1 A 53 53 LEU N N 53 116.763 117.962 -1.199 1
1 609 . 19 1 1 A 54 54 GLN H H 54 7.964 8.102 -0.138 1
1 610 . 19 1 1 A 54 54 GLN HA H 54 3.591 3.900 -0.309 1
1 616 . 19 1 1 A 54 54 GLN C C 54 172.604 174.585 -1.981 1
1 617 . 19 1 1 A 54 54 GLN CA C 54 56.961 57.291 -0.330 1
1 618 . 19 1 1 A 54 54 GLN CB C 54 26.545 28.168 -1.623 1
1 620 . 19 1 1 A 54 54 GLN N N 54 115.489 118.774 -3.285 1
1 622 . 19 1 1 A 55 55 LEU H H 55 7.139 7.581 -0.442 1
1 623 . 19 1 1 A 55 55 LEU HA H 55 4.750 5.019 -0.269 1
1 629 . 19 1 1 A 55 55 LEU C C 55 173.475 175.170 -1.695 1
1 630 . 19 1 1 A 55 55 LEU CA C 55 53.698 52.630 1.068 1
1 631 . 19 1 1 A 55 55 LEU CB C 55 47.859 45.362 2.497 1
1 633 . 19 1 1 A 55 55 LEU N N 55 116.422 115.895 0.527 1
1 634 . 19 1 1 A 56 56 ILE H H 56 8.223 8.640 -0.417 1
1 635 . 19 1 1 A 56 56 ILE HA H 56 4.540 4.653 -0.113 1
1 643 . 19 1 1 A 56 56 ILE C C 56 173.938 175.097 -1.159 1
1 644 . 19 1 1 A 56 56 ILE CA C 56 61.020 60.326 0.694 1
1 645 . 19 1 1 A 56 56 ILE CB C 56 39.403 38.720 0.683 1
1 648 . 19 1 1 A 56 56 ILE N N 56 122.792 122.862 -0.070 1
1 649 . 19 1 1 A 57 57 CYS H H 57 8.995 9.043 -0.048 1
1 650 . 19 1 1 A 57 57 CYS HA H 57 5.036 5.342 -0.306 1
1 653 . 19 1 1 A 57 57 CYS C C 57 170.483 173.341 -2.858 1
1 654 . 19 1 1 A 57 57 CYS CA C 57 56.484 56.983 -0.499 1
1 655 . 19 1 1 A 57 57 CYS CB C 57 30.545 31.441 -0.896 1
1 656 . 19 1 1 A 57 57 CYS N N 57 121.575 124.177 -2.602 1
1 657 . 19 1 1 A 58 58 LEU H H 58 9.076 8.687 0.389 1
1 658 . 19 1 1 A 58 58 LEU HA H 58 5.472 5.512 -0.040 1
1 668 . 19 1 1 A 58 58 LEU C C 58 174.009 175.859 -1.850 1
1 669 . 19 1 1 A 58 58 LEU CA C 58 52.851 53.612 -0.761 1
1 670 . 19 1 1 A 58 58 LEU CB C 58 42.177 42.842 -0.665 1
1 674 . 19 1 1 A 58 58 LEU N N 58 121.895 124.554 -2.659 1
1 675 . 19 1 1 A 59 59 VAL H H 59 8.966 8.570 0.396 1
1 676 . 19 1 1 A 59 59 VAL HA H 59 5.488 5.063 0.425 1
1 681 . 19 1 1 A 59 59 VAL C C 59 176.034 175.476 0.558 1
1 682 . 19 1 1 A 59 59 VAL CA C 59 59.820 60.817 -0.997 1
1 683 . 19 1 1 A 59 59 VAL CB C 59 34.786 34.245 0.541 1
1 685 . 19 1 1 A 59 59 VAL N N 59 121.702 124.833 -3.131 1
1 686 . 19 1 1 A 60 60 GLY H H 60 9.258 8.981 0.277 1
1 687 . 19 1 1 A 60 60 GLY HA2 H 60 4.673 4.467 0.206 1
1 688 . 19 1 1 A 60 60 GLY HA3 H 60 4.804 4.745 0.059 1
1 689 . 19 1 1 A 60 60 GLY C C 60 169.831 171.953 -2.122 1
1 690 . 19 1 1 A 60 60 GLY CA C 60 46.399 45.299 1.100 1
1 691 . 19 1 1 A 60 60 GLY N N 60 114.126 113.890 0.236 1
1 692 . 19 1 1 A 61 61 THR H H 61 8.834 8.711 0.123 1
1 693 . 19 1 1 A 61 61 THR HA H 61 4.418 4.934 -0.516 1
1 698 . 19 1 1 A 61 61 THR C C 61 171.985 172.482 -0.497 1
1 699 . 19 1 1 A 61 61 THR CA C 61 60.634 61.215 -0.581 1
1 700 . 19 1 1 A 61 61 THR CB C 61 70.983 70.956 0.027 1
1 702 . 19 1 1 A 61 61 THR N N 61 114.856 115.242 -0.386 1
1 703 . 19 1 1 A 62 62 GLU H H 62 8.502 8.566 -0.064 1
1 704 . 19 1 1 A 62 62 GLU HA H 62 2.867 4.024 -1.157 1
1 709 . 19 1 1 A 62 62 GLU C C 62 174.650 175.339 -0.689 1
1 710 . 19 1 1 A 62 62 GLU CA C 62 58.785 54.388 4.397 1
1 711 . 19 1 1 A 62 62 GLU CB C 62 28.981 30.401 -1.420 1
1 713 . 19 1 1 A 62 62 GLU N N 62 129.915 126.331 3.584 1
1 714 . 19 1 1 A 63 63 ILE H H 63 6.928 8.358 -1.430 1
1 715 . 19 1 1 A 63 63 ILE HA H 63 4.038 3.661 0.377 1
1 725 . 19 1 1 A 63 63 ILE C C 63 173.482 174.931 -1.449 1
1 726 . 19 1 1 A 63 63 ILE CA C 63 58.664 61.345 -2.681 1
1 727 . 19 1 1 A 63 63 ILE CB C 63 40.009 36.872 3.137 1
1 731 . 19 1 1 A 63 63 ILE N N 63 117.075 125.357 -8.282 1
1 732 . 19 1 1 A 64 64 GLU H H 64 8.585 7.881 0.704 1
1 733 . 19 1 1 A 64 64 GLU HA H 64 3.427 4.005 -0.578 1
1 738 . 19 1 1 A 64 64 GLU C C 64 175.186 176.913 -1.727 1
1 739 . 19 1 1 A 64 64 GLU CA C 64 58.703 57.430 1.273 1
1 740 . 19 1 1 A 64 64 GLU CB C 64 28.999 28.762 0.237 1
1 742 . 19 1 1 A 64 64 GLU N N 64 126.422 125.879 0.543 1
1 743 . 19 1 1 A 65 65 GLY H H 65 8.754 8.720 0.034 1
1 744 . 19 1 1 A 65 65 GLY HA2 H 65 3.631 3.904 -0.273 1
1 745 . 19 1 1 A 65 65 GLY HA3 H 65 4.287 3.920 0.367 1
1 746 . 19 1 1 A 65 65 GLY C C 65 174.005 175.193 -1.188 1
1 747 . 19 1 1 A 65 65 GLY CA C 65 44.954 45.134 -0.180 1
1 748 . 19 1 1 A 65 65 GLY N N 65 114.614 113.502 1.112 1
1 749 . 19 1 1 A 66 66 GLU H H 66 7.760 8.273 -0.513 1
1 750 . 19 1 1 A 66 66 GLU HA H 66 4.462 4.367 0.095 1
1 754 . 19 1 1 A 66 66 GLU C C 66 175.255 176.424 -1.169 1
1 755 . 19 1 1 A 66 66 GLU CA C 66 55.582 56.178 -0.596 1
1 756 . 19 1 1 A 66 66 GLU CB C 66 30.654 31.199 -0.545 1
1 758 . 19 1 1 A 66 66 GLU N N 66 119.292 118.316 0.976 1
1 759 . 19 1 1 A 67 67 GLY H H 67 8.262 7.122 1.140 1
1 760 . 19 1 1 A 67 67 GLY HA2 H 67 3.875 4.070 -0.195 1
1 761 . 19 1 1 A 67 67 GLY HA3 H 67 4.088 4.121 -0.033 1
1 762 . 19 1 1 A 67 67 GLY C C 67 172.197 172.701 -0.504 1
1 763 . 19 1 1 A 67 67 GLY CA C 67 44.845 45.197 -0.352 1
1 764 . 19 1 1 A 67 67 GLY N N 67 106.161 105.694 0.467 1
1 765 . 19 1 1 A 68 68 LEU H H 68 8.142 8.829 -0.687 1
1 766 . 19 1 1 A 68 68 LEU HA H 68 4.491 4.676 -0.185 1
1 775 . 19 1 1 A 68 68 LEU C C 68 176.194 175.378 0.816 1
1 776 . 19 1 1 A 68 68 LEU CA C 68 55.123 54.389 0.734 1
1 777 . 19 1 1 A 68 68 LEU CB C 68 44.527 42.778 1.749 1
1 780 . 19 1 1 A 68 68 LEU N N 68 120.269 127.572 -7.303 1
1 781 . 19 1 1 A 69 69 GLN H H 69 9.253 8.554 0.699 1
1 782 . 19 1 1 A 69 69 GLN HA H 69 4.770 5.173 -0.403 1
1 788 . 19 1 1 A 69 69 GLN C C 69 173.607 174.514 -0.907 1
1 789 . 19 1 1 A 69 69 GLN CA C 69 54.736 54.127 0.609 1
1 790 . 19 1 1 A 69 69 GLN CB C 69 33.782 31.782 2.000 1
1 792 . 19 1 1 A 69 69 GLN N N 69 119.336 127.673 -8.337 1
1 794 . 19 1 1 A 70 70 THR H H 70 8.803 9.071 -0.268 1
1 795 . 19 1 1 A 70 70 THR HA H 70 5.033 4.997 0.036 1
1 800 . 19 1 1 A 70 70 THR C C 70 172.596 173.639 -1.043 1
1 801 . 19 1 1 A 70 70 THR CA C 70 62.768 62.109 0.659 1
1 802 . 19 1 1 A 70 70 THR CB C 70 69.990 69.846 0.144 1
1 804 . 19 1 1 A 70 70 THR N N 70 118.372 122.930 -4.558 1
1 805 . 19 1 1 A 71 71 VAL H H 71 9.882 9.450 0.432 1
1 806 . 19 1 1 A 71 71 VAL HA H 71 5.239 5.295 -0.056 1
1 811 . 19 1 1 A 71 71 VAL C C 71 174.015 174.900 -0.885 1
1 812 . 19 1 1 A 71 71 VAL CA C 71 60.577 60.719 -0.142 1
1 813 . 19 1 1 A 71 71 VAL CB C 71 34.149 33.697 0.452 1
1 815 . 19 1 1 A 71 71 VAL N N 71 129.063 123.119 5.944 1
1 816 . 19 1 1 A 72 72 VAL H H 72 9.491 8.669 0.822 1
1 817 . 19 1 1 A 72 72 VAL HA H 72 4.672 4.568 0.104 1
1 825 . 19 1 1 A 72 72 VAL CA C 72 59.568 58.723 0.845 1
1 826 . 19 1 1 A 72 72 VAL CB C 72 34.057 35.405 -1.348 1
1 829 . 19 1 1 A 72 72 VAL N N 72 128.521 126.333 2.188 1
1 830 . 19 1 1 A 73 73 PRO HA H 73 5.368 4.601 0.767 1
1 836 . 19 1 1 A 73 73 PRO C C 73 175.079 176.172 -1.093 1
1 837 . 19 1 1 A 73 73 PRO CA C 73 61.324 62.691 -1.367 1
1 838 . 19 1 1 A 73 73 PRO CB C 73 33.089 32.157 0.932 1
1 841 . 19 1 1 A 74 74 THR H H 74 9.103 8.785 0.318 1
1 842 . 19 1 1 A 74 74 THR HA H 74 5.191 4.820 0.371 1
1 847 . 19 1 1 A 74 74 THR CA C 74 57.986 59.317 -1.331 1
1 848 . 19 1 1 A 74 74 THR CB C 74 72.212 72.434 -0.222 1
1 850 . 19 1 1 A 74 74 THR N N 74 118.075 118.340 -0.265 1
1 851 . 19 1 1 A 75 75 PRO HA H 75 5.015 4.806 0.209 1
1 858 . 19 1 1 A 75 75 PRO C C 75 178.704 177.298 1.406 1
1 859 . 19 1 1 A 75 75 PRO CA C 75 63.038 62.058 0.980 1
1 860 . 19 1 1 A 75 75 PRO CB C 75 32.529 32.998 -0.469 1
1 863 . 19 1 1 A 76 76 ILE H H 76 8.221 8.401 -0.180 1
1 864 . 19 1 1 A 76 76 ILE HA H 76 4.218 3.797 0.421 1
1 873 . 19 1 1 A 76 76 ILE C C 76 172.375 176.603 -4.228 1
1 874 . 19 1 1 A 76 76 ILE CA C 76 63.509 63.870 -0.361 1
1 875 . 19 1 1 A 76 76 ILE CB C 76 39.322 37.952 1.370 1
1 879 . 19 1 1 A 76 76 ILE N N 76 122.273 122.205 0.068 1
1 880 . 19 1 1 A 77 77 THR H H 77 6.984 7.674 -0.690 1
1 881 . 19 1 1 A 77 77 THR HA H 77 4.227 4.416 -0.189 1
1 886 . 19 1 1 A 77 77 THR C C 77 173.531 174.193 -0.662 1
1 887 . 19 1 1 A 77 77 THR CA C 77 61.435 61.750 -0.315 1
1 888 . 19 1 1 A 77 77 THR CB C 77 68.944 69.169 -0.225 1
1 890 . 19 1 1 A 77 77 THR N N 77 105.803 114.091 -8.288 1
1 891 . 19 1 1 A 78 78 ALA H H 78 7.647 7.372 0.275 1
1 892 . 19 1 1 A 78 78 ALA HA H 78 4.757 4.623 0.134 1
1 896 . 19 1 1 A 78 78 ALA C C 78 173.520 175.470 -1.950 1
1 897 . 19 1 1 A 78 78 ALA CA C 78 51.164 50.985 0.179 1
1 898 . 19 1 1 A 78 78 ALA CB C 78 20.011 21.970 -1.959 1
1 899 . 19 1 1 A 78 78 ALA N N 78 126.635 124.229 2.406 1
1 900 . 19 1 1 A 79 79 SER H H 79 7.884 8.825 -0.941 1
1 901 . 19 1 1 A 79 79 SER HA H 79 4.386 5.211 -0.825 1
1 903 . 19 1 1 A 79 79 SER C C 79 176.077 173.439 2.638 1
1 904 . 19 1 1 A 79 79 SER CA C 79 57.465 56.577 0.888 1
1 905 . 19 1 1 A 79 79 SER CB C 79 65.285 64.696 0.589 1
1 906 . 19 1 1 A 79 79 SER N N 79 115.272 115.405 -0.133 1
1 907 . 19 1 1 A 80 80 LEU H H 80 7.700 9.038 -1.338 1
1 908 . 19 1 1 A 80 80 LEU HA H 80 4.912 5.259 -0.347 1
1 915 . 19 1 1 A 80 80 LEU C C 80 173.927 175.387 -1.460 1
1 916 . 19 1 1 A 80 80 LEU CA C 80 53.829 53.384 0.445 1
1 917 . 19 1 1 A 80 80 LEU CB C 80 45.990 45.580 0.410 1
1 920 . 19 1 1 A 80 80 LEU N N 80 121.507 128.347 -6.840 1
1 921 . 19 1 1 A 81 81 SER H H 81 7.885 8.778 -0.893 1
1 922 . 19 1 1 A 81 81 SER HA H 81 5.269 5.047 0.222 1
1 925 . 19 1 1 A 81 81 SER C C 81 175.756 174.773 0.983 1
1 926 . 19 1 1 A 81 81 SER CA C 81 55.507 57.531 -2.024 1
1 927 . 19 1 1 A 81 81 SER CB C 81 65.966 67.520 -1.554 1
1 928 . 19 1 1 A 81 81 SER N N 81 118.323 115.925 2.398 1
1 929 . 19 1 1 A 82 82 HIS H H 82 8.935 8.813 0.122 1
1 930 . 19 1 1 A 82 82 HIS HA H 82 4.407 4.401 0.006 1
1 932 . 19 1 1 A 82 82 HIS C C 82 176.550 176.624 -0.074 1
1 933 . 19 1 1 A 82 82 HIS CA C 82 60.960 58.979 1.981 1
1 934 . 19 1 1 A 82 82 HIS CB C 82 30.755 29.401 1.354 1
1 935 . 19 1 1 A 82 82 HIS N N 82 124.042 122.182 1.860 1
1 936 . 19 1 1 A 83 83 ASN H H 83 8.435 7.757 0.678 1
1 937 . 19 1 1 A 83 83 ASN HA H 83 4.439 4.437 0.002 1
1 941 . 19 1 1 A 83 83 ASN C C 83 174.769 178.366 -3.597 1
1 942 . 19 1 1 A 83 83 ASN CA C 83 56.575 55.906 0.669 1
1 943 . 19 1 1 A 83 83 ASN CB C 83 38.731 38.193 0.538 1
1 944 . 19 1 1 A 83 83 ASN N N 83 118.543 118.728 -0.185 1
1 946 . 19 1 1 A 84 84 ARG H H 84 7.716 7.930 -0.214 1
1 947 . 19 1 1 A 84 84 ARG HA H 84 4.183 4.207 -0.024 1
1 953 . 19 1 1 A 84 84 ARG C C 84 177.399 178.697 -1.298 1
1 954 . 19 1 1 A 84 84 ARG CA C 84 59.045 58.582 0.463 1
1 955 . 19 1 1 A 84 84 ARG CB C 84 29.992 29.971 0.021 1
1 957 . 19 1 1 A 84 84 ARG N N 84 121.312 120.468 0.844 1
1 958 . 19 1 1 A 85 85 ILE H H 85 8.354 8.089 0.265 1
1 959 . 19 1 1 A 85 85 ILE HA H 85 3.650 3.928 -0.278 1
1 967 . 19 1 1 A 85 85 ILE C C 85 176.098 178.117 -2.019 1
1 968 . 19 1 1 A 85 85 ILE CA C 85 66.704 64.669 2.035 1
1 969 . 19 1 1 A 85 85 ILE CB C 85 38.017 37.739 0.278 1
1 972 . 19 1 1 A 85 85 ILE N N 85 119.321 119.249 0.072 1
1 973 . 19 1 1 A 86 86 ARG H H 86 7.690 8.112 -0.422 1
1 974 . 19 1 1 A 86 86 ARG HA H 86 3.704 4.014 -0.310 1
1 981 . 19 1 1 A 86 86 ARG C C 86 177.524 178.752 -1.228 1
1 982 . 19 1 1 A 86 86 ARG CA C 86 59.881 59.184 0.697 1
1 983 . 19 1 1 A 86 86 ARG CB C 86 29.248 29.886 -0.638 1
1 986 . 19 1 1 A 86 86 ARG N N 86 118.362 121.708 -3.346 1
1 987 . 19 1 1 A 87 87 GLU H H 87 7.884 7.783 0.101 1
1 988 . 19 1 1 A 87 87 GLU HA H 87 4.064 4.094 -0.030 1
1 993 . 19 1 1 A 87 87 GLU C C 87 178.785 179.243 -0.458 1
1 994 . 19 1 1 A 87 87 GLU CA C 87 58.999 59.184 -0.185 1
1 995 . 19 1 1 A 87 87 GLU CB C 87 29.872 29.436 0.436 1
1 997 . 19 1 1 A 87 87 GLU N N 87 118.124 118.785 -0.661 1
1 998 . 19 1 1 A 88 88 ILE H H 88 8.715 7.760 0.955 1
1 999 . 19 1 1 A 88 88 ILE HA H 88 3.305 3.477 -0.172 1
1 1009 . 19 1 1 A 88 88 ILE C C 88 177.261 177.715 -0.454 1
1 1010 . 19 1 1 A 88 88 ILE CA C 88 65.822 65.642 0.180 1
1 1011 . 19 1 1 A 88 88 ILE CB C 88 37.370 37.600 -0.230 1
1 1015 . 19 1 1 A 88 88 ILE N N 88 122.929 120.732 2.197 1
1 1016 . 19 1 1 A 89 89 LEU H H 89 8.486 8.489 -0.003 1
1 1017 . 19 1 1 A 89 89 LEU HA H 89 3.932 3.807 0.125 1
1 1023 . 19 1 1 A 89 89 LEU C C 89 177.919 178.808 -0.889 1
1 1024 . 19 1 1 A 89 89 LEU CA C 89 59.060 58.237 0.823 1
1 1025 . 19 1 1 A 89 89 LEU CB C 89 41.129 41.752 -0.623 1
1 1028 . 19 1 1 A 89 89 LEU N N 89 122.696 119.888 2.808 1
1 1029 . 19 1 1 A 90 90 LYS H H 90 7.790 8.159 -0.369 1
1 1030 . 19 1 1 A 90 90 LYS HA H 90 4.061 3.924 0.137 1
1 1035 . 19 1 1 A 90 90 LYS C C 90 178.432 178.544 -0.112 1
1 1036 . 19 1 1 A 90 90 LYS CA C 90 59.840 59.669 0.171 1
1 1037 . 19 1 1 A 90 90 LYS CB C 90 32.582 32.370 0.212 1
1 1039 . 19 1 1 A 90 90 LYS N N 90 118.640 119.245 -0.605 1
1 1040 . 19 1 1 A 91 91 ALA H H 91 8.113 8.241 -0.128 1
1 1041 . 19 1 1 A 91 91 ALA HA H 91 4.151 4.068 0.083 1
1 1045 . 19 1 1 A 91 91 ALA C C 91 179.147 179.743 -0.596 1
1 1046 . 19 1 1 A 91 91 ALA CA C 91 54.942 55.224 -0.282 1
1 1047 . 19 1 1 A 91 91 ALA CB C 91 18.242 18.611 -0.369 1
1 1048 . 19 1 1 A 91 91 ALA N N 91 122.939 121.270 1.669 1
1 1049 . 19 1 1 A 92 92 SER H H 92 8.858 8.327 0.531 1
1 1050 . 19 1 1 A 92 92 SER HA H 92 4.898 4.204 0.694 1
1 1052 . 19 1 1 A 92 92 SER C C 92 172.440 176.675 -4.235 1
1 1053 . 19 1 1 A 92 92 SER CA C 92 61.913 60.882 1.031 1
1 1054 . 19 1 1 A 92 92 SER CB C 92 63.081 62.862 0.219 1
1 1055 . 19 1 1 A 92 92 SER N N 92 114.526 113.515 1.011 1
1 1056 . 19 1 1 A 93 93 ARG H H 93 7.704 8.618 -0.914 1
1 1057 . 19 1 1 A 93 93 ARG HA H 93 4.162 4.162 0.000 1
1 1059 . 19 1 1 A 93 93 ARG C C 93 177.757 178.966 -1.209 1
1 1060 . 19 1 1 A 93 93 ARG CA C 93 59.544 59.314 0.230 1
1 1061 . 19 1 1 A 93 93 ARG CB C 93 30.343 29.859 0.484 1
1 1062 . 19 1 1 A 93 93 ARG N N 93 121.505 122.160 -0.655 1
1 1063 . 19 1 1 A 94 94 LYS H H 94 7.456 7.874 -0.418 1
1 1064 . 19 1 1 A 94 94 LYS HA H 94 4.174 4.086 0.088 1
1 1071 . 19 1 1 A 94 94 LYS C C 94 178.861 178.690 0.171 1
1 1072 . 19 1 1 A 94 94 LYS CA C 94 59.030 58.928 0.102 1
1 1073 . 19 1 1 A 94 94 LYS CB C 94 32.239 31.622 0.617 1
1 1077 . 19 1 1 A 94 94 LYS N N 94 119.072 118.580 0.492 1
1 1078 . 19 1 1 A 95 95 LEU H H 95 8.148 7.690 0.458 1
1 1079 . 19 1 1 A 95 95 LEU HA H 95 4.129 4.125 0.004 1
1 1088 . 19 1 1 A 95 95 LEU C C 95 177.274 178.569 -1.295 1
1 1089 . 19 1 1 A 95 95 LEU CA C 95 57.136 57.215 -0.079 1
1 1090 . 19 1 1 A 95 95 LEU CB C 95 41.908 41.990 -0.082 1
1 1093 . 19 1 1 A 95 95 LEU N N 95 119.717 121.679 -1.962 1
1 1094 . 19 1 1 A 96 96 GLN H H 96 7.807 8.129 -0.322 1
1 1095 . 19 1 1 A 96 96 GLN HA H 96 4.242 4.279 -0.037 1
1 1102 . 19 1 1 A 96 96 GLN C C 96 175.371 176.212 -0.841 1
1 1103 . 19 1 1 A 96 96 GLN CA C 96 56.397 55.917 0.480 1
1 1104 . 19 1 1 A 96 96 GLN CB C 96 29.123 29.057 0.066 1
1 1106 . 19 1 1 A 96 96 GLN N N 96 114.581 115.483 -0.902 1
1 1108 . 19 1 1 A 97 97 GLY H H 97 7.802 7.901 -0.099 1
1 1109 . 19 1 1 A 97 97 GLY HA2 H 97 3.839 4.033 -0.194 1
1 1110 . 19 1 1 A 97 97 GLY HA3 H 97 4.096 4.034 0.062 1
1 1111 . 19 1 1 A 97 97 GLY C C 97 172.636 173.628 -0.992 1
1 1112 . 19 1 1 A 97 97 GLY CA C 97 46.372 45.064 1.308 1
1 1113 . 19 1 1 A 97 97 GLY N N 97 106.959 107.198 -0.239 1
1 1114 . 19 1 1 A 98 98 ASP H H 98 8.156 7.799 0.357 1
1 1115 . 19 1 1 A 98 98 ASP HA H 98 4.754 5.010 -0.256 1
1 1118 . 19 1 1 A 98 98 ASP CA C 98 52.882 50.675 2.207 1
1 1119 . 19 1 1 A 98 98 ASP CB C 98 41.603 42.714 -1.111 1
1 1120 . 19 1 1 A 98 98 ASP N N 98 118.447 121.101 -2.654 1
1 1121 . 19 1 1 A 99 99 PRO HA H 99 4.470 4.436 0.034 1
1 1126 . 19 1 1 A 99 99 PRO C C 99 175.500 176.809 -1.309 1
1 1127 . 19 1 1 A 99 99 PRO CA C 99 63.601 65.082 -1.481 1
1 1128 . 19 1 1 A 99 99 PRO CB C 99 32.423 31.723 0.700 1
1 1130 . 19 1 1 A 100 100 ASP H H 100 8.527 8.052 0.475 1
1 1131 . 19 1 1 A 100 100 ASP HA H 100 4.778 4.895 -0.117 1
1 1134 . 19 1 1 A 100 100 ASP C C 100 174.931 175.296 -0.365 1
1 1135 . 19 1 1 A 100 100 ASP CA C 100 53.915 53.132 0.783 1
1 1136 . 19 1 1 A 100 100 ASP CB C 100 40.665 41.806 -1.141 1
1 1137 . 19 1 1 A 100 100 ASP N N 100 119.340 116.116 3.224 1
1 1138 . 19 1 1 A 101 101 LEU H H 101 7.379 7.285 0.094 1
1 1139 . 19 1 1 A 101 101 LEU HA H 101 4.682 4.444 0.238 1
1 1148 . 19 1 1 A 101 101 LEU CA C 101 52.956 52.391 0.565 1
1 1149 . 19 1 1 A 101 101 LEU CB C 101 43.393 41.740 1.653 1
1 1152 . 19 1 1 A 101 101 LEU N N 101 122.107 121.607 0.500 1
1 1153 . 19 1 1 A 102 102 PRO HA H 102 4.487 4.478 0.009 1
1 1158 . 19 1 1 A 102 102 PRO C C 102 175.697 175.523 0.174 1
1 1159 . 19 1 1 A 102 102 PRO CA C 102 63.113 63.244 -0.131 1
1 1160 . 19 1 1 A 102 102 PRO CB C 102 32.138 32.007 0.131 1
1 1163 . 19 1 1 A 103 103 MET H H 103 9.011 8.706 0.305 1
1 1164 . 19 1 1 A 103 103 MET HA H 103 4.769 5.102 -0.333 1
1 1171 . 19 1 1 A 103 103 MET C C 103 174.080 173.936 0.144 1
1 1172 . 19 1 1 A 103 103 MET CA C 103 54.737 53.447 1.290 1
1 1173 . 19 1 1 A 103 103 MET CB C 103 34.857 35.147 -0.290 1
1 1176 . 19 1 1 A 103 103 MET N N 103 123.334 122.293 1.041 1
1 1177 . 19 1 1 A 104 104 SER H H 104 8.239 8.882 -0.643 1
1 1178 . 19 1 1 A 104 104 SER HA H 104 5.079 5.317 -0.238 1
1 1181 . 19 1 1 A 104 104 SER C C 104 171.795 172.470 -0.675 1
1 1182 . 19 1 1 A 104 104 SER CA C 104 57.641 56.751 0.890 1
1 1183 . 19 1 1 A 104 104 SER CB C 104 66.282 65.940 0.342 1
1 1184 . 19 1 1 A 104 104 SER N N 104 114.434 116.225 -1.791 1
1 1185 . 19 1 1 A 105 105 PHE H H 105 9.003 8.473 0.530 1
1 1186 . 19 1 1 A 105 105 PHE HA H 105 5.209 5.311 -0.102 1
1 1193 . 19 1 1 A 105 105 PHE C C 105 170.688 172.196 -1.508 1
1 1194 . 19 1 1 A 105 105 PHE CA C 105 56.917 56.008 0.909 1
1 1195 . 19 1 1 A 105 105 PHE CB C 105 41.350 41.957 -0.607 1
1 1196 . 19 1 1 A 105 105 PHE N N 105 116.224 119.057 -2.833 1
1 1197 . 19 1 1 A 106 106 THR H H 106 9.074 8.659 0.415 1
1 1198 . 19 1 1 A 106 106 THR HA H 106 4.664 4.890 -0.226 1
1 1203 . 19 1 1 A 106 106 THR C C 106 171.767 174.610 -2.843 1
1 1204 . 19 1 1 A 106 106 THR CA C 106 62.162 61.974 0.188 1
1 1205 . 19 1 1 A 106 106 THR CB C 106 70.072 69.791 0.281 1
1 1207 . 19 1 1 A 106 106 THR N N 106 117.469 116.736 0.733 1
1 1208 . 19 1 1 A 107 107 LEU H H 107 9.804 8.860 0.944 1
1 1209 . 19 1 1 A 107 107 LEU HA H 107 4.750 4.771 -0.021 1
1 1219 . 19 1 1 A 107 107 LEU C C 107 172.742 175.841 -3.099 1
1 1220 . 19 1 1 A 107 107 LEU CA C 107 54.151 54.811 -0.660 1
1 1221 . 19 1 1 A 107 107 LEU CB C 107 44.486 42.213 2.273 1
1 1224 . 19 1 1 A 107 107 LEU N N 107 133.400 128.737 4.663 1
1 1225 . 19 1 1 A 108 108 ALA H H 108 8.435 8.867 -0.432 1
1 1226 . 19 1 1 A 108 108 ALA HA H 108 4.683 4.421 0.262 1
1 1230 . 19 1 1 A 108 108 ALA C C 108 173.052 175.957 -2.905 1
1 1231 . 19 1 1 A 108 108 ALA CA C 108 49.308 50.707 -1.399 1
1 1232 . 19 1 1 A 108 108 ALA CB C 108 22.120 19.929 2.191 1
1 1233 . 19 1 1 A 108 108 ALA N N 108 131.422 127.776 3.646 1
1 1234 . 19 1 1 A 109 109 ILE H H 109 8.909 8.918 -0.009 1
1 1235 . 19 1 1 A 109 109 ILE HA H 109 4.063 5.359 -1.296 1
1 1245 . 19 1 1 A 109 109 ILE CA C 109 60.982 60.191 0.791 1
1 1246 . 19 1 1 A 109 109 ILE CB C 109 39.074 38.881 0.193 1
1 1250 . 19 1 1 A 109 109 ILE N N 109 124.415 123.817 0.598 1
1 1251 . 19 1 1 A 110 110 VAL H H 110 8.706 8.952 -0.246 1
1 1252 . 19 1 1 A 110 110 VAL HA H 110 4.324 5.012 -0.688 1
1 1260 . 19 1 1 A 110 110 VAL C C 110 175.700 176.044 -0.344 1
1 1261 . 19 1 1 A 110 110 VAL CA C 110 62.316 60.065 2.251 1
1 1262 . 19 1 1 A 110 110 VAL CB C 110 31.876 34.657 -2.781 1
1 1264 . 19 1 1 A 110 110 VAL N N 110 127.457 122.556 4.901 1
1 1265 . 19 1 1 A 111 111 GLU H H 111 9.024 9.433 -0.409 1
1 1266 . 19 1 1 A 111 111 GLU HA H 111 4.403 3.926 0.477 1
1 1269 . 19 1 1 A 111 111 GLU C C 111 175.987 176.408 -0.421 1
1 1270 . 19 1 1 A 111 111 GLU CA C 111 56.842 57.948 -1.106 1
1 1271 . 19 1 1 A 111 111 GLU CB C 111 31.044 30.402 0.642 1
1 1272 . 19 1 1 A 111 111 GLU N N 111 129.768 125.951 3.817 1
1 1273 . 19 1 1 A 112 112 SER H H 112 9.143 8.063 1.080 1
1 1274 . 19 1 1 A 112 112 SER HA H 112 4.394 4.259 0.135 1
1 1276 . 19 1 1 A 112 112 SER C C 112 173.187 173.755 -0.568 1
1 1277 . 19 1 1 A 112 112 SER CA C 112 60.180 60.991 -0.811 1
1 1278 . 19 1 1 A 112 112 SER CB C 112 63.415 61.066 2.349 1
1 1279 . 19 1 1 A 112 112 SER N N 112 115.956 113.256 2.700 1
1 1280 . 19 1 1 A 113 113 ASP H H 113 8.133 8.172 -0.039 1
1 1281 . 19 1 1 A 113 113 ASP HA H 113 4.573 4.571 0.002 1
1 1284 . 19 1 1 A 113 113 ASP C C 113 175.430 177.062 -1.632 1
1 1285 . 19 1 1 A 113 113 ASP CA C 113 54.115 56.314 -2.199 1
1 1286 . 19 1 1 A 113 113 ASP CB C 113 40.011 41.542 -1.531 1
1 1287 . 19 1 1 A 113 113 ASP N N 113 118.343 121.955 -3.612 1
1 1288 . 19 1 1 A 114 114 SER H H 114 8.034 8.282 -0.248 1
1 1289 . 19 1 1 A 114 114 SER HA H 114 4.057 4.712 -0.655 1
1 1291 . 19 1 1 A 114 114 SER C C 114 172.209 173.587 -1.378 1
1 1292 . 19 1 1 A 114 114 SER CA C 114 60.179 58.383 1.796 1
1 1293 . 19 1 1 A 114 114 SER CB C 114 62.702 65.442 -2.740 1
1 1294 . 19 1 1 A 114 114 SER N N 114 109.836 111.899 -2.063 1
1 1295 . 19 1 1 A 115 115 THR H H 115 7.711 8.107 -0.396 1
1 1296 . 19 1 1 A 115 115 THR HA H 115 4.250 4.386 -0.136 1
1 1300 . 19 1 1 A 115 115 THR C C 115 171.500 173.702 -2.202 1
1 1301 . 19 1 1 A 115 115 THR CA C 115 63.547 62.588 0.959 1
1 1302 . 19 1 1 A 115 115 THR CB C 115 69.595 69.503 0.092 1
1 1303 . 19 1 1 A 115 115 THR N N 115 117.407 115.941 1.466 1
1 1304 . 19 1 1 A 116 116 ILE H H 116 8.219 9.229 -1.010 1
1 1305 . 19 1 1 A 116 116 ILE HA H 116 4.769 5.042 -0.273 1
1 1315 . 19 1 1 A 116 116 ILE C C 116 174.434 175.271 -0.837 1
1 1316 . 19 1 1 A 116 116 ILE CA C 116 60.306 59.522 0.784 1
1 1317 . 19 1 1 A 116 116 ILE CB C 116 40.686 39.099 1.587 1
1 1321 . 19 1 1 A 116 116 ILE N N 116 125.480 128.811 -3.331 1
1 1322 . 19 1 1 A 117 117 VAL H H 117 8.695 9.365 -0.670 1
1 1323 . 19 1 1 A 117 117 VAL HA H 117 4.315 4.718 -0.403 1
1 1328 . 19 1 1 A 117 117 VAL C C 117 172.243 174.336 -2.093 1
1 1329 . 19 1 1 A 117 117 VAL CA C 117 60.621 60.883 -0.262 1
1 1330 . 19 1 1 A 117 117 VAL CB C 117 34.558 34.619 -0.061 1
1 1332 . 19 1 1 A 117 117 VAL N N 117 127.887 127.538 0.349 1
1 1333 . 19 1 1 A 118 118 TYR H H 118 8.270 8.824 -0.554 1
1 1334 . 19 1 1 A 118 118 TYR HA H 118 5.327 5.418 -0.091 1
1 1342 . 19 1 1 A 118 118 TYR C C 118 174.250 174.709 -0.459 1
1 1343 . 19 1 1 A 118 118 TYR CA C 118 57.283 56.237 1.046 1
1 1344 . 19 1 1 A 118 118 TYR CB C 118 39.262 39.862 -0.600 1
1 1345 . 19 1 1 A 118 118 TYR N N 118 124.822 126.822 -2.000 1
1 1346 . 19 1 1 A 119 119 TYR H H 119 9.207 8.781 0.426 1
1 1347 . 19 1 1 A 119 119 TYR HA H 119 4.821 5.318 -0.497 1
1 1354 . 19 1 1 A 119 119 TYR C C 119 171.994 173.535 -1.541 1
1 1355 . 19 1 1 A 119 119 TYR CA C 119 58.116 56.573 1.543 1
1 1356 . 19 1 1 A 119 119 TYR CB C 119 43.544 42.499 1.045 1
1 1357 . 19 1 1 A 119 119 TYR N N 119 125.153 124.001 1.152 1
1 1358 . 19 1 1 A 120 120 LYS H H 120 7.700 8.215 -0.515 1
1 1359 . 19 1 1 A 120 120 LYS HA H 120 4.558 4.539 0.019 1
1 1366 . 19 1 1 A 120 120 LYS C C 120 172.017 174.883 -2.866 1
1 1367 . 19 1 1 A 120 120 LYS CA C 120 57.217 55.850 1.367 1
1 1368 . 19 1 1 A 120 120 LYS CB C 120 33.914 33.356 0.558 1
1 1372 . 19 1 1 A 120 120 LYS N N 120 129.442 127.515 1.927 1
1 1373 . 19 1 1 A 121 121 LEU H H 121 8.112 8.522 -0.410 1
1 1374 . 19 1 1 A 121 121 LEU HA H 121 5.323 5.142 0.181 1
1 1384 . 19 1 1 A 121 121 LEU C C 121 175.733 174.535 1.198 1
1 1385 . 19 1 1 A 121 121 LEU CA C 121 52.716 53.124 -0.408 1
1 1386 . 19 1 1 A 121 121 LEU CB C 121 44.098 45.083 -0.985 1
1 1389 . 19 1 1 A 121 121 LEU N N 121 123.403 128.310 -4.907 1
1 1390 . 19 1 1 A 122 122 THR H H 122 8.338 9.064 -0.726 1
1 1391 . 19 1 1 A 122 122 THR HA H 122 5.097 4.853 0.244 1
1 1396 . 19 1 1 A 122 122 THR C C 122 173.221 172.256 0.965 1
1 1397 . 19 1 1 A 122 122 THR CA C 122 60.306 61.939 -1.633 1
1 1398 . 19 1 1 A 122 122 THR CB C 122 72.473 70.960 1.513 1
1 1400 . 19 1 1 A 122 122 THR N N 122 109.081 122.839 -13.758 1
1 7 . 20 1 1 A 2 2 GLU H H 2 8.994 9.319 -0.325 1
1 8 . 20 1 1 A 2 2 GLU HA H 2 4.278 4.642 -0.364 1
1 13 . 20 1 1 A 2 2 GLU C C 2 175.315 176.164 -0.849 1
1 14 . 20 1 1 A 2 2 GLU CA C 2 57.318 57.307 0.011 1
1 15 . 20 1 1 A 2 2 GLU CB C 2 29.221 32.134 -2.913 1
1 17 . 20 1 1 A 2 2 GLU N N 2 122.259 124.023 -1.764 1
1 18 . 20 1 1 A 3 3 ASP H H 3 8.048 7.712 0.336 1
1 19 . 20 1 1 A 3 3 ASP HA H 3 4.580 5.130 -0.550 1
1 21 . 20 1 1 A 3 3 ASP C C 3 175.636 173.744 1.892 1
1 22 . 20 1 1 A 3 3 ASP CA C 3 54.579 54.261 0.318 1
1 23 . 20 1 1 A 3 3 ASP CB C 3 40.984 44.319 -3.335 1
1 24 . 20 1 1 A 3 3 ASP N N 3 119.830 116.209 3.621 1
1 25 . 20 1 1 A 4 4 ALA H H 4 8.090 8.155 -0.065 1
1 26 . 20 1 1 A 4 4 ALA HA H 4 4.216 4.535 -0.319 1
1 30 . 20 1 1 A 4 4 ALA C C 4 177.157 177.908 -0.751 1
1 31 . 20 1 1 A 4 4 ALA CA C 4 53.620 51.320 2.300 1
1 32 . 20 1 1 A 4 4 ALA CB C 4 18.728 19.593 -0.865 1
1 33 . 20 1 1 A 4 4 ALA N N 4 123.957 126.077 -2.120 1
1 34 . 20 1 1 A 5 5 TRP H H 5 7.941 8.243 -0.302 1
1 35 . 20 1 1 A 5 5 TRP HA H 5 4.559 4.674 -0.115 1
1 39 . 20 1 1 A 5 5 TRP C C 5 176.072 177.572 -1.500 1
1 40 . 20 1 1 A 5 5 TRP CA C 5 57.744 59.100 -1.356 1
1 41 . 20 1 1 A 5 5 TRP CB C 5 28.906 30.635 -1.729 1
1 42 . 20 1 1 A 5 5 TRP N N 5 118.408 119.996 -1.588 1
1 44 . 20 1 1 A 6 6 MET H H 6 7.679 7.904 -0.225 1
1 45 . 20 1 1 A 6 6 MET HA H 6 3.785 4.540 -0.755 1
1 52 . 20 1 1 A 6 6 MET C C 6 175.174 176.830 -1.656 1
1 53 . 20 1 1 A 6 6 MET CA C 6 57.724 57.571 0.153 1
1 54 . 20 1 1 A 6 6 MET CB C 6 31.640 33.331 -1.691 1
1 57 . 20 1 1 A 6 6 MET N N 6 121.538 117.595 3.943 1
1 58 . 20 1 1 A 7 7 GLY H H 7 7.247 8.002 -0.755 1
1 59 . 20 1 1 A 7 7 GLY HA2 H 7 3.455 4.263 -0.808 1
1 60 . 20 1 1 A 7 7 GLY HA3 H 7 3.578 4.314 -0.736 1
1 61 . 20 1 1 A 7 7 GLY C C 7 172.852 174.254 -1.402 1
1 62 . 20 1 1 A 7 7 GLY CA C 7 45.896 44.995 0.901 1
1 63 . 20 1 1 A 7 7 GLY N N 7 104.055 109.137 -5.082 1
1 64 . 20 1 1 A 8 8 THR H H 8 7.436 7.770 -0.334 1
1 65 . 20 1 1 A 8 8 THR HA H 8 4.428 4.460 -0.032 1
1 70 . 20 1 1 A 8 8 THR C C 8 172.973 173.947 -0.974 1
1 71 . 20 1 1 A 8 8 THR CA C 8 60.751 62.555 -1.804 1
1 72 . 20 1 1 A 8 8 THR CB C 8 69.637 71.718 -2.081 1
1 74 . 20 1 1 A 8 8 THR N N 8 107.669 115.930 -8.261 1
1 75 . 20 1 1 A 9 9 HIS H H 9 8.048 7.941 0.107 1
1 76 . 20 1 1 A 9 9 HIS HA H 9 4.654 4.976 -0.322 1
1 79 . 20 1 1 A 9 9 HIS CA C 9 56.163 54.010 2.153 1
1 80 . 20 1 1 A 9 9 HIS CB C 9 32.619 32.211 0.408 1
1 81 . 20 1 1 A 9 9 HIS N N 9 127.281 120.944 6.337 1
1 82 . 20 1 1 A 10 10 PRO HA H 10 4.257 4.242 0.015 1
1 88 . 20 1 1 A 10 10 PRO C C 10 178.779 179.093 -0.314 1
1 89 . 20 1 1 A 10 10 PRO CA C 10 65.565 65.999 -0.434 1
1 90 . 20 1 1 A 10 10 PRO CB C 10 32.422 31.950 0.472 1
1 93 . 20 1 1 A 11 11 LYS H H 11 10.994 8.460 2.534 1
1 94 . 20 1 1 A 11 11 LYS HA H 11 4.282 4.196 0.086 1
1 100 . 20 1 1 A 11 11 LYS C C 11 177.279 178.941 -1.662 1
1 101 . 20 1 1 A 11 11 LYS CA C 11 56.859 59.551 -2.692 1
1 102 . 20 1 1 A 11 11 LYS CB C 11 31.279 32.440 -1.161 1
1 104 . 20 1 1 A 11 11 LYS N N 11 121.398 118.287 3.111 1
1 105 . 20 1 1 A 12 12 TYR H H 12 7.146 8.391 -1.245 1
1 106 . 20 1 1 A 12 12 TYR HA H 12 3.722 4.337 -0.615 1
1 113 . 20 1 1 A 12 12 TYR C C 12 176.265 177.600 -1.335 1
1 114 . 20 1 1 A 12 12 TYR CA C 12 61.189 61.464 -0.275 1
1 115 . 20 1 1 A 12 12 TYR CB C 12 37.796 38.430 -0.634 1
1 116 . 20 1 1 A 12 12 TYR N N 12 121.579 122.331 -0.752 1
1 117 . 20 1 1 A 13 13 LEU H H 13 7.778 8.847 -1.069 1
1 118 . 20 1 1 A 13 13 LEU HA H 13 3.773 4.008 -0.235 1
1 127 . 20 1 1 A 13 13 LEU C C 13 178.462 178.623 -0.161 1
1 128 . 20 1 1 A 13 13 LEU CA C 13 57.942 58.304 -0.362 1
1 129 . 20 1 1 A 13 13 LEU CB C 13 41.064 41.652 -0.588 1
1 132 . 20 1 1 A 13 13 LEU N N 13 117.518 120.949 -3.431 1
1 133 . 20 1 1 A 14 14 GLU H H 14 7.867 8.857 -0.990 1
1 134 . 20 1 1 A 14 14 GLU HA H 14 3.935 3.947 -0.012 1
1 139 . 20 1 1 A 14 14 GLU C C 14 178.326 178.753 -0.427 1
1 140 . 20 1 1 A 14 14 GLU CA C 14 59.368 59.712 -0.344 1
1 141 . 20 1 1 A 14 14 GLU CB C 14 30.147 29.120 1.027 1
1 143 . 20 1 1 A 14 14 GLU N N 14 119.135 119.097 0.038 1
1 144 . 20 1 1 A 15 15 MET H H 15 7.773 7.879 -0.106 1
1 145 . 20 1 1 A 15 15 MET HA H 15 3.936 4.141 -0.205 1
1 152 . 20 1 1 A 15 15 MET C C 15 177.886 177.654 0.232 1
1 153 . 20 1 1 A 15 15 MET CA C 15 59.465 58.038 1.427 1
1 154 . 20 1 1 A 15 15 MET CB C 15 33.987 32.188 1.799 1
1 157 . 20 1 1 A 15 15 MET N N 15 117.884 119.324 -1.440 1
1 158 . 20 1 1 A 16 16 MET H H 16 8.145 8.244 -0.099 1
1 159 . 20 1 1 A 16 16 MET HA H 16 4.159 4.130 0.029 1
1 166 . 20 1 1 A 16 16 MET C C 16 177.835 177.254 0.581 1
1 167 . 20 1 1 A 16 16 MET CA C 16 57.397 57.496 -0.099 1
1 168 . 20 1 1 A 16 16 MET CB C 16 31.867 32.207 -0.340 1
1 171 . 20 1 1 A 16 16 MET N N 16 119.555 115.754 3.801 1
1 172 . 20 1 1 A 17 17 GLU H H 17 7.761 7.804 -0.043 1
1 173 . 20 1 1 A 17 17 GLU HA H 17 4.117 4.326 -0.209 1
1 176 . 20 1 1 A 17 17 GLU C C 17 175.994 176.936 -0.942 1
1 177 . 20 1 1 A 17 17 GLU CA C 17 57.392 57.036 0.356 1
1 178 . 20 1 1 A 17 17 GLU CB C 17 29.432 29.950 -0.518 1
1 180 . 20 1 1 A 17 17 GLU N N 17 118.216 118.141 0.075 1
1 181 . 20 1 1 A 18 18 LEU H H 18 7.201 7.327 -0.126 1
1 182 . 20 1 1 A 18 18 LEU HA H 18 4.111 4.313 -0.202 1
1 191 . 20 1 1 A 18 18 LEU C C 18 175.781 177.766 -1.985 1
1 192 . 20 1 1 A 18 18 LEU CA C 18 56.366 54.942 1.424 1
1 193 . 20 1 1 A 18 18 LEU CB C 18 42.030 42.903 -0.873 1
1 196 . 20 1 1 A 18 18 LEU N N 18 117.448 121.799 -4.351 1
1 197 . 20 1 1 A 19 19 ASP H H 19 7.789 8.704 -0.915 1
1 198 . 20 1 1 A 19 19 ASP HA H 19 4.360 4.345 0.015 1
1 201 . 20 1 1 A 19 19 ASP C C 19 173.765 176.165 -2.400 1
1 202 . 20 1 1 A 19 19 ASP CA C 19 54.851 56.267 -1.416 1
1 203 . 20 1 1 A 19 19 ASP CB C 19 39.115 41.005 -1.890 1
1 204 . 20 1 1 A 19 19 ASP N N 19 115.844 120.270 -4.426 1
1 205 . 20 1 1 A 20 20 ILE H H 20 8.142 7.479 0.663 1
1 206 . 20 1 1 A 20 20 ILE HA H 20 4.128 4.357 -0.229 1
1 216 . 20 1 1 A 20 20 ILE C C 20 174.710 174.344 0.366 1
1 217 . 20 1 1 A 20 20 ILE CA C 20 60.465 60.049 0.416 1
1 218 . 20 1 1 A 20 20 ILE CB C 20 40.407 38.784 1.623 1
1 222 . 20 1 1 A 20 20 ILE N N 20 117.287 114.205 3.082 1
1 223 . 20 1 1 A 21 21 GLY H H 21 8.207 8.475 -0.268 1
1 224 . 20 1 1 A 21 21 GLY HA2 H 21 3.889 4.100 -0.211 1
1 225 . 20 1 1 A 21 21 GLY HA3 H 21 3.924 4.116 -0.192 1
1 226 . 20 1 1 A 21 21 GLY C C 21 172.162 172.611 -0.449 1
1 227 . 20 1 1 A 21 21 GLY CA C 21 45.017 44.791 0.226 1
1 228 . 20 1 1 A 21 21 GLY N N 21 110.656 109.846 0.810 1
1 229 . 20 1 1 A 22 22 ASP H H 22 7.727 8.273 -0.546 1
1 230 . 20 1 1 A 22 22 ASP HA H 22 4.794 5.079 -0.285 1
1 233 . 20 1 1 A 22 22 ASP C C 22 174.884 177.408 -2.524 1
1 234 . 20 1 1 A 22 22 ASP CA C 22 52.471 53.065 -0.594 1
1 235 . 20 1 1 A 22 22 ASP CB C 22 42.069 42.724 -0.655 1
1 236 . 20 1 1 A 22 22 ASP N N 22 119.305 124.302 -4.997 1
1 237 . 20 1 1 A 23 23 ALA H H 23 8.644 8.960 -0.316 1
1 238 . 20 1 1 A 23 23 ALA HA H 23 4.120 4.057 0.063 1
1 242 . 20 1 1 A 23 23 ALA C C 23 179.546 179.893 -0.347 1
1 243 . 20 1 1 A 23 23 ALA CA C 23 55.609 55.865 -0.256 1
1 244 . 20 1 1 A 23 23 ALA CB C 23 18.573 18.302 0.271 1
1 245 . 20 1 1 A 23 23 ALA N N 23 122.468 128.648 -6.180 1
1 246 . 20 1 1 A 24 24 THR H H 24 8.238 7.771 0.467 1
1 247 . 20 1 1 A 24 24 THR HA H 24 4.184 4.019 0.165 1
1 252 . 20 1 1 A 24 24 THR C C 24 174.841 176.623 -1.782 1
1 253 . 20 1 1 A 24 24 THR CA C 24 66.241 66.558 -0.317 1
1 254 . 20 1 1 A 24 24 THR CB C 24 68.376 68.420 -0.044 1
1 256 . 20 1 1 A 24 24 THR N N 24 114.824 114.139 0.685 1
1 257 . 20 1 1 A 25 25 GLN H H 25 8.037 7.976 0.061 1
1 258 . 20 1 1 A 25 25 GLN HA H 25 4.095 4.108 -0.013 1
1 265 . 20 1 1 A 25 25 GLN C C 25 177.603 178.394 -0.791 1
1 266 . 20 1 1 A 25 25 GLN CA C 25 59.261 58.649 0.612 1
1 267 . 20 1 1 A 25 25 GLN CB C 25 28.437 27.803 0.634 1
1 269 . 20 1 1 A 25 25 GLN N N 25 122.518 119.278 3.240 1
1 271 . 20 1 1 A 26 26 VAL H H 26 7.994 8.119 -0.125 1
1 272 . 20 1 1 A 26 26 VAL HA H 26 3.469 3.671 -0.202 1
1 280 . 20 1 1 A 26 26 VAL C C 26 175.552 177.917 -2.365 1
1 281 . 20 1 1 A 26 26 VAL CA C 26 66.909 66.190 0.719 1
1 282 . 20 1 1 A 26 26 VAL CB C 26 31.582 31.509 0.073 1
1 285 . 20 1 1 A 26 26 VAL N N 26 119.112 121.373 -2.261 1
1 286 . 20 1 1 A 27 27 TYR H H 27 8.003 8.418 -0.415 1
1 287 . 20 1 1 A 27 27 TYR HA H 27 4.357 4.359 -0.002 1
1 294 . 20 1 1 A 27 27 TYR C C 27 175.856 177.116 -1.260 1
1 295 . 20 1 1 A 27 27 TYR CA C 27 62.197 62.004 0.193 1
1 296 . 20 1 1 A 27 27 TYR CB C 27 38.394 38.726 -0.332 1
1 297 . 20 1 1 A 27 27 TYR N N 27 119.170 120.979 -1.809 1
1 298 . 20 1 1 A 28 28 VAL H H 28 8.087 8.104 -0.017 1
1 299 . 20 1 1 A 28 28 VAL HA H 28 3.652 3.454 0.198 1
1 307 . 20 1 1 A 28 28 VAL C C 28 176.134 177.907 -1.773 1
1 308 . 20 1 1 A 28 28 VAL CA C 28 66.247 66.212 0.035 1
1 309 . 20 1 1 A 28 28 VAL CB C 28 31.241 31.265 -0.024 1
1 312 . 20 1 1 A 28 28 VAL N N 28 113.112 119.769 -6.657 1
1 313 . 20 1 1 A 29 29 ALA H H 29 7.853 9.013 -1.160 1
1 314 . 20 1 1 A 29 29 ALA HA H 29 3.913 4.007 -0.094 1
1 318 . 20 1 1 A 29 29 ALA C C 29 177.850 179.132 -1.282 1
1 319 . 20 1 1 A 29 29 ALA CA C 29 55.274 54.903 0.371 1
1 320 . 20 1 1 A 29 29 ALA CB C 29 17.876 18.267 -0.391 1
1 321 . 20 1 1 A 29 29 ALA N N 29 121.350 122.865 -1.515 1
1 322 . 20 1 1 A 30 30 PHE H H 30 8.724 8.477 0.247 1
1 323 . 20 1 1 A 30 30 PHE HA H 30 4.098 4.320 -0.222 1
1 327 . 20 1 1 A 30 30 PHE C C 30 175.035 177.371 -2.336 1
1 328 . 20 1 1 A 30 30 PHE CA C 30 61.264 61.557 -0.293 1
1 329 . 20 1 1 A 30 30 PHE CB C 30 38.926 39.335 -0.409 1
1 330 . 20 1 1 A 30 30 PHE N N 30 120.478 120.093 0.385 1
1 331 . 20 1 1 A 31 31 LEU H H 31 8.146 8.148 -0.002 1
1 332 . 20 1 1 A 31 31 LEU HA H 31 3.597 3.614 -0.017 1
1 341 . 20 1 1 A 31 31 LEU C C 31 179.508 179.313 0.195 1
1 342 . 20 1 1 A 31 31 LEU CA C 31 57.884 58.129 -0.245 1
1 343 . 20 1 1 A 31 31 LEU CB C 31 41.829 42.014 -0.185 1
1 346 . 20 1 1 A 31 31 LEU N N 31 118.427 120.132 -1.705 1
1 347 . 20 1 1 A 32 32 VAL H H 32 7.627 7.607 0.020 1
1 348 . 20 1 1 A 32 32 VAL HA H 32 3.464 3.753 -0.289 1
1 356 . 20 1 1 A 32 32 VAL C C 32 174.956 177.611 -2.655 1
1 357 . 20 1 1 A 32 32 VAL CA C 32 66.373 65.564 0.809 1
1 358 . 20 1 1 A 32 32 VAL CB C 32 31.121 31.383 -0.262 1
1 361 . 20 1 1 A 32 32 VAL N N 32 119.497 113.880 5.617 1
1 362 . 20 1 1 A 33 33 TYR H H 33 8.366 8.480 -0.114 1
1 363 . 20 1 1 A 33 33 TYR HA H 33 3.485 3.922 -0.437 1
1 370 . 20 1 1 A 33 33 TYR C C 33 174.883 176.830 -1.947 1
1 371 . 20 1 1 A 33 33 TYR CA C 33 62.866 61.261 1.605 1
1 372 . 20 1 1 A 33 33 TYR CB C 33 37.778 38.214 -0.436 1
1 373 . 20 1 1 A 33 33 TYR N N 33 121.842 124.252 -2.410 1
1 374 . 20 1 1 A 34 34 LEU H H 34 8.000 8.292 -0.292 1
1 375 . 20 1 1 A 34 34 LEU HA H 34 3.495 3.622 -0.127 1
1 385 . 20 1 1 A 34 34 LEU C C 34 178.240 179.079 -0.839 1
1 386 . 20 1 1 A 34 34 LEU CA C 34 57.453 57.297 0.156 1
1 387 . 20 1 1 A 34 34 LEU CB C 34 41.828 41.164 0.664 1
1 390 . 20 1 1 A 34 34 LEU N N 34 116.692 119.433 -2.741 1
1 391 . 20 1 1 A 35 35 ASP H H 35 7.688 8.033 -0.345 1
1 392 . 20 1 1 A 35 35 ASP HA H 35 4.302 4.473 -0.171 1
1 395 . 20 1 1 A 35 35 ASP C C 35 177.507 178.542 -1.035 1
1 396 . 20 1 1 A 35 35 ASP CA C 35 58.196 57.663 0.533 1
1 397 . 20 1 1 A 35 35 ASP CB C 35 43.070 41.328 1.742 1
1 398 . 20 1 1 A 35 35 ASP N N 35 120.507 120.073 0.434 1
1 399 . 20 1 1 A 36 36 LEU H H 36 8.482 8.430 0.052 1
1 400 . 20 1 1 A 36 36 LEU HA H 36 3.328 3.767 -0.439 1
1 410 . 20 1 1 A 36 36 LEU C C 36 176.774 178.992 -2.218 1
1 411 . 20 1 1 A 36 36 LEU CA C 36 57.461 57.800 -0.339 1
1 412 . 20 1 1 A 36 36 LEU CB C 36 41.344 40.987 0.357 1
1 416 . 20 1 1 A 36 36 LEU N N 36 117.671 120.303 -2.632 1
1 417 . 20 1 1 A 37 37 MET H H 37 7.822 7.738 0.084 1
1 418 . 20 1 1 A 37 37 MET HA H 37 4.401 4.023 0.378 1
1 425 . 20 1 1 A 37 37 MET C C 37 177.862 177.563 0.299 1
1 426 . 20 1 1 A 37 37 MET CA C 37 56.434 58.758 -2.324 1
1 427 . 20 1 1 A 37 37 MET CB C 37 31.573 33.288 -1.715 1
1 430 . 20 1 1 A 37 37 MET N N 37 112.952 116.277 -3.325 1
1 431 . 20 1 1 A 38 38 GLU H H 38 8.667 8.361 0.306 1
1 432 . 20 1 1 A 38 38 GLU HA H 38 4.457 4.333 0.124 1
1 436 . 20 1 1 A 38 38 GLU C C 38 176.582 177.645 -1.063 1
1 437 . 20 1 1 A 38 38 GLU CA C 38 57.659 57.965 -0.306 1
1 438 . 20 1 1 A 38 38 GLU CB C 38 29.936 30.477 -0.541 1
1 440 . 20 1 1 A 38 38 GLU N N 38 116.463 117.209 -0.746 1
1 441 . 20 1 1 A 39 39 SER H H 39 7.657 8.125 -0.468 1
1 442 . 20 1 1 A 39 39 SER HA H 39 4.658 4.649 0.009 1
1 445 . 20 1 1 A 39 39 SER C C 39 175.661 176.384 -0.723 1
1 446 . 20 1 1 A 39 39 SER CA C 39 60.449 59.154 1.295 1
1 447 . 20 1 1 A 39 39 SER CB C 39 63.341 64.386 -1.045 1
1 448 . 20 1 1 A 39 39 SER N N 39 113.870 112.695 1.175 1
1 449 . 20 1 1 A 40 40 LYS H H 40 8.165 8.339 -0.174 1
1 450 . 20 1 1 A 40 40 LYS HA H 40 4.454 4.267 0.187 1
1 458 . 20 1 1 A 40 40 LYS C C 40 174.970 175.962 -0.992 1
1 459 . 20 1 1 A 40 40 LYS CA C 40 55.753 58.714 -2.961 1
1 460 . 20 1 1 A 40 40 LYS CB C 40 32.337 32.889 -0.552 1
1 464 . 20 1 1 A 40 40 LYS N N 40 116.671 122.744 -6.073 1
1 465 . 20 1 1 A 41 41 SER H H 41 7.017 8.073 -1.056 1
1 466 . 20 1 1 A 41 41 SER HA H 41 4.209 4.411 -0.202 1
1 469 . 20 1 1 A 41 41 SER C C 41 173.770 173.900 -0.130 1
1 470 . 20 1 1 A 41 41 SER CA C 41 58.435 59.112 -0.677 1
1 471 . 20 1 1 A 41 41 SER CB C 41 61.700 61.832 -0.132 1
1 472 . 20 1 1 A 41 41 SER N N 41 109.989 113.172 -3.183 1
1 473 . 20 1 1 A 42 42 TRP H H 42 8.876 8.554 0.322 1
1 474 . 20 1 1 A 42 42 TRP HA H 42 4.698 4.577 0.121 1
1 478 . 20 1 1 A 42 42 TRP C C 42 174.477 177.579 -3.102 1
1 479 . 20 1 1 A 42 42 TRP CA C 42 59.443 57.770 1.673 1
1 480 . 20 1 1 A 42 42 TRP CB C 42 28.203 29.599 -1.396 1
1 481 . 20 1 1 A 42 42 TRP N N 42 121.116 121.415 -0.299 1
1 483 . 20 1 1 A 43 43 HIS H H 43 8.132 8.741 -0.609 1
1 484 . 20 1 1 A 43 43 HIS HA H 43 4.445 4.370 0.075 1
1 488 . 20 1 1 A 43 43 HIS C C 43 174.405 174.493 -0.088 1
1 489 . 20 1 1 A 43 43 HIS CA C 43 58.556 59.508 -0.952 1
1 490 . 20 1 1 A 43 43 HIS CB C 43 29.430 30.417 -0.987 1
1 491 . 20 1 1 A 43 43 HIS N N 43 119.397 122.555 -3.158 1
1 492 . 20 1 1 A 44 44 GLU H H 44 8.140 7.660 0.480 1
1 493 . 20 1 1 A 44 44 GLU HA H 44 4.432 4.761 -0.329 1
1 497 . 20 1 1 A 44 44 GLU C C 44 173.010 174.532 -1.522 1
1 498 . 20 1 1 A 44 44 GLU CA C 44 56.421 55.891 0.530 1
1 499 . 20 1 1 A 44 44 GLU CB C 44 33.285 32.985 0.300 1
1 501 . 20 1 1 A 44 44 GLU N N 44 116.181 118.164 -1.983 1
1 502 . 20 1 1 A 45 45 VAL H H 45 8.428 8.862 -0.434 1
1 503 . 20 1 1 A 45 45 VAL HA H 45 4.492 5.037 -0.545 1
1 511 . 20 1 1 A 45 45 VAL C C 45 172.339 174.692 -2.353 1
1 512 . 20 1 1 A 45 45 VAL CA C 45 63.071 60.778 2.293 1
1 513 . 20 1 1 A 45 45 VAL CB C 45 35.145 34.800 0.345 1
1 516 . 20 1 1 A 45 45 VAL N N 45 123.272 126.332 -3.060 1
1 517 . 20 1 1 A 46 46 ASN H H 46 9.050 8.915 0.135 1
1 518 . 20 1 1 A 46 46 ASN HA H 46 5.261 5.469 -0.208 1
1 523 . 20 1 1 A 46 46 ASN C C 46 172.845 173.387 -0.542 1
1 524 . 20 1 1 A 46 46 ASN CA C 46 51.895 51.860 0.035 1
1 525 . 20 1 1 A 46 46 ASN CB C 46 42.322 42.257 0.065 1
1 526 . 20 1 1 A 46 46 ASN N N 46 123.901 124.287 -0.386 1
1 528 . 20 1 1 A 47 47 CYS H H 47 9.039 9.045 -0.006 1
1 529 . 20 1 1 A 47 47 CYS HA H 47 5.160 5.242 -0.082 1
1 532 . 20 1 1 A 47 47 CYS C C 47 172.454 173.370 -0.916 1
1 533 . 20 1 1 A 47 47 CYS CA C 47 56.473 56.745 -0.272 1
1 534 . 20 1 1 A 47 47 CYS CB C 47 29.297 29.934 -0.637 1
1 535 . 20 1 1 A 47 47 CYS N N 47 119.663 121.386 -1.723 1
1 536 . 20 1 1 A 48 48 VAL H H 48 9.083 8.979 0.104 1
1 537 . 20 1 1 A 48 48 VAL HA H 48 4.344 4.724 -0.380 1
1 542 . 20 1 1 A 48 48 VAL C C 48 173.307 174.923 -1.616 1
1 543 . 20 1 1 A 48 48 VAL CA C 48 61.368 60.740 0.628 1
1 544 . 20 1 1 A 48 48 VAL CB C 48 35.345 34.987 0.358 1
1 546 . 20 1 1 A 48 48 VAL N N 48 124.672 127.038 -2.366 1
1 547 . 20 1 1 A 49 49 GLY H H 49 9.019 9.126 -0.107 1
1 548 . 20 1 1 A 49 49 GLY HA2 H 49 3.460 4.146 -0.686 1
1 549 . 20 1 1 A 49 49 GLY HA3 H 49 4.539 4.147 0.392 1
1 550 . 20 1 1 A 49 49 GLY C C 49 171.278 172.561 -1.283 1
1 551 . 20 1 1 A 49 49 GLY CA C 49 45.075 44.578 0.497 1
1 552 . 20 1 1 A 49 49 GLY N N 49 113.131 116.251 -3.120 1
1 553 . 20 1 1 A 50 50 LEU H H 50 8.747 8.987 -0.240 1
1 554 . 20 1 1 A 50 50 LEU HA H 50 5.102 4.952 0.150 1
1 564 . 20 1 1 A 50 50 LEU CA C 50 51.417 51.304 0.113 1
1 565 . 20 1 1 A 50 50 LEU CB C 50 41.754 42.226 -0.472 1
1 569 . 20 1 1 A 50 50 LEU N N 50 124.471 127.461 -2.990 1
1 570 . 20 1 1 A 51 51 PRO HA H 51 4.106 4.214 -0.108 1
1 577 . 20 1 1 A 51 51 PRO C C 51 178.422 178.246 0.176 1
1 578 . 20 1 1 A 51 51 PRO CA C 51 65.680 65.429 0.251 1
1 579 . 20 1 1 A 51 51 PRO CB C 51 31.939 31.755 0.184 1
1 582 . 20 1 1 A 52 52 GLU H H 52 9.721 8.228 1.493 1
1 583 . 20 1 1 A 52 52 GLU HA H 52 4.176 4.127 0.049 1
1 588 . 20 1 1 A 52 52 GLU C C 52 176.146 178.181 -2.035 1
1 589 . 20 1 1 A 52 52 GLU CA C 52 59.158 59.503 -0.345 1
1 590 . 20 1 1 A 52 52 GLU CB C 52 28.442 29.538 -1.096 1
1 592 . 20 1 1 A 52 52 GLU N N 52 118.552 117.973 0.579 1
1 593 . 20 1 1 A 53 53 LEU H H 53 7.089 7.910 -0.821 1
1 594 . 20 1 1 A 53 53 LEU HA H 53 4.511 4.246 0.265 1
1 603 . 20 1 1 A 53 53 LEU C C 53 174.027 175.922 -1.895 1
1 604 . 20 1 1 A 53 53 LEU CA C 53 53.825 54.917 -1.092 1
1 605 . 20 1 1 A 53 53 LEU CB C 53 43.825 42.467 1.358 1
1 608 . 20 1 1 A 53 53 LEU N N 53 116.763 118.035 -1.272 1
1 609 . 20 1 1 A 54 54 GLN H H 54 7.964 7.741 0.223 1
1 610 . 20 1 1 A 54 54 GLN HA H 54 3.591 3.860 -0.269 1
1 616 . 20 1 1 A 54 54 GLN C C 54 172.604 174.195 -1.591 1
1 617 . 20 1 1 A 54 54 GLN CA C 54 56.961 56.989 -0.028 1
1 618 . 20 1 1 A 54 54 GLN CB C 54 26.545 26.196 0.349 1
1 620 . 20 1 1 A 54 54 GLN N N 54 115.489 116.074 -0.585 1
1 622 . 20 1 1 A 55 55 LEU H H 55 7.139 7.287 -0.148 1
1 623 . 20 1 1 A 55 55 LEU HA H 55 4.750 4.799 -0.049 1
1 629 . 20 1 1 A 55 55 LEU C C 55 173.475 175.862 -2.387 1
1 630 . 20 1 1 A 55 55 LEU CA C 55 53.698 53.358 0.340 1
1 631 . 20 1 1 A 55 55 LEU CB C 55 47.859 44.182 3.677 1
1 633 . 20 1 1 A 55 55 LEU N N 55 116.422 118.242 -1.820 1
1 634 . 20 1 1 A 56 56 ILE H H 56 8.223 8.542 -0.319 1
1 635 . 20 1 1 A 56 56 ILE HA H 56 4.540 5.161 -0.621 1
1 643 . 20 1 1 A 56 56 ILE C C 56 173.938 175.078 -1.140 1
1 644 . 20 1 1 A 56 56 ILE CA C 56 61.020 60.016 1.004 1
1 645 . 20 1 1 A 56 56 ILE CB C 56 39.403 40.130 -0.727 1
1 648 . 20 1 1 A 56 56 ILE N N 56 122.792 121.199 1.593 1
1 649 . 20 1 1 A 57 57 CYS H H 57 8.995 9.186 -0.191 1
1 650 . 20 1 1 A 57 57 CYS HA H 57 5.036 5.298 -0.262 1
1 653 . 20 1 1 A 57 57 CYS C C 57 170.483 173.236 -2.753 1
1 654 . 20 1 1 A 57 57 CYS CA C 57 56.484 57.345 -0.861 1
1 655 . 20 1 1 A 57 57 CYS CB C 57 30.545 31.261 -0.716 1
1 656 . 20 1 1 A 57 57 CYS N N 57 121.575 124.122 -2.547 1
1 657 . 20 1 1 A 58 58 LEU H H 58 9.076 9.008 0.068 1
1 658 . 20 1 1 A 58 58 LEU HA H 58 5.472 5.648 -0.176 1
1 668 . 20 1 1 A 58 58 LEU C C 58 174.009 176.033 -2.024 1
1 669 . 20 1 1 A 58 58 LEU CA C 58 52.851 53.557 -0.706 1
1 670 . 20 1 1 A 58 58 LEU CB C 58 42.177 42.838 -0.661 1
1 674 . 20 1 1 A 58 58 LEU N N 58 121.895 125.725 -3.830 1
1 675 . 20 1 1 A 59 59 VAL H H 59 8.966 8.632 0.334 1
1 676 . 20 1 1 A 59 59 VAL HA H 59 5.488 5.179 0.309 1
1 681 . 20 1 1 A 59 59 VAL C C 59 176.034 175.759 0.275 1
1 682 . 20 1 1 A 59 59 VAL CA C 59 59.820 60.783 -0.963 1
1 683 . 20 1 1 A 59 59 VAL CB C 59 34.786 34.264 0.522 1
1 685 . 20 1 1 A 59 59 VAL N N 59 121.702 124.962 -3.260 1
1 686 . 20 1 1 A 60 60 GLY H H 60 9.258 8.849 0.409 1
1 687 . 20 1 1 A 60 60 GLY HA2 H 60 4.673 4.459 0.214 1
1 688 . 20 1 1 A 60 60 GLY HA3 H 60 4.804 4.602 0.202 1
1 689 . 20 1 1 A 60 60 GLY C C 60 169.831 171.813 -1.982 1
1 690 . 20 1 1 A 60 60 GLY CA C 60 46.399 46.194 0.205 1
1 691 . 20 1 1 A 60 60 GLY N N 60 114.126 113.011 1.115 1
1 692 . 20 1 1 A 61 61 THR H H 61 8.834 8.690 0.144 1
1 693 . 20 1 1 A 61 61 THR HA H 61 4.418 4.729 -0.311 1
1 698 . 20 1 1 A 61 61 THR C C 61 171.985 174.752 -2.767 1
1 699 . 20 1 1 A 61 61 THR CA C 61 60.634 61.181 -0.547 1
1 700 . 20 1 1 A 61 61 THR CB C 61 70.983 69.445 1.538 1
1 702 . 20 1 1 A 61 61 THR N N 61 114.856 115.415 -0.559 1
1 703 . 20 1 1 A 62 62 GLU H H 62 8.502 8.424 0.078 1
1 704 . 20 1 1 A 62 62 GLU HA H 62 2.867 3.315 -0.448 1
1 709 . 20 1 1 A 62 62 GLU C C 62 174.650 175.721 -1.071 1
1 710 . 20 1 1 A 62 62 GLU CA C 62 58.785 58.642 0.143 1
1 711 . 20 1 1 A 62 62 GLU CB C 62 28.981 28.768 0.213 1
1 713 . 20 1 1 A 62 62 GLU N N 62 129.915 127.341 2.574 1
1 714 . 20 1 1 A 63 63 ILE H H 63 6.928 7.908 -0.980 1
1 715 . 20 1 1 A 63 63 ILE HA H 63 4.038 4.247 -0.209 1
1 725 . 20 1 1 A 63 63 ILE C C 63 173.482 175.046 -1.564 1
1 726 . 20 1 1 A 63 63 ILE CA C 63 58.664 60.293 -1.629 1
1 727 . 20 1 1 A 63 63 ILE CB C 63 40.009 39.862 0.147 1
1 731 . 20 1 1 A 63 63 ILE N N 63 117.075 118.502 -1.427 1
1 732 . 20 1 1 A 64 64 GLU H H 64 8.585 8.371 0.214 1
1 733 . 20 1 1 A 64 64 GLU HA H 64 3.427 3.957 -0.530 1
1 738 . 20 1 1 A 64 64 GLU C C 64 175.186 176.729 -1.543 1
1 739 . 20 1 1 A 64 64 GLU CA C 64 58.703 57.159 1.544 1
1 740 . 20 1 1 A 64 64 GLU CB C 64 28.999 28.994 0.005 1
1 742 . 20 1 1 A 64 64 GLU N N 64 126.422 127.850 -1.428 1
1 743 . 20 1 1 A 65 65 GLY H H 65 8.754 8.756 -0.002 1
1 744 . 20 1 1 A 65 65 GLY HA2 H 65 3.631 3.928 -0.297 1
1 745 . 20 1 1 A 65 65 GLY HA3 H 65 4.287 3.944 0.343 1
1 746 . 20 1 1 A 65 65 GLY C C 65 174.005 174.797 -0.792 1
1 747 . 20 1 1 A 65 65 GLY CA C 65 44.954 45.026 -0.072 1
1 748 . 20 1 1 A 65 65 GLY N N 65 114.614 112.440 2.174 1
1 749 . 20 1 1 A 66 66 GLU H H 66 7.760 7.821 -0.061 1
1 750 . 20 1 1 A 66 66 GLU HA H 66 4.462 4.739 -0.277 1
1 754 . 20 1 1 A 66 66 GLU C C 66 175.255 175.709 -0.454 1
1 755 . 20 1 1 A 66 66 GLU CA C 66 55.582 55.552 0.030 1
1 756 . 20 1 1 A 66 66 GLU CB C 66 30.654 31.539 -0.885 1
1 758 . 20 1 1 A 66 66 GLU N N 66 119.292 120.342 -1.050 1
1 759 . 20 1 1 A 67 67 GLY H H 67 8.262 8.464 -0.202 1
1 760 . 20 1 1 A 67 67 GLY HA2 H 67 3.875 4.098 -0.223 1
1 761 . 20 1 1 A 67 67 GLY HA3 H 67 4.088 4.105 -0.017 1
1 762 . 20 1 1 A 67 67 GLY C C 67 172.197 174.499 -2.302 1
1 763 . 20 1 1 A 67 67 GLY CA C 67 44.845 45.201 -0.356 1
1 764 . 20 1 1 A 67 67 GLY N N 67 106.161 108.954 -2.793 1
1 765 . 20 1 1 A 68 68 LEU H H 68 8.142 7.998 0.144 1
1 766 . 20 1 1 A 68 68 LEU HA H 68 4.491 4.672 -0.181 1
1 775 . 20 1 1 A 68 68 LEU C C 68 176.194 176.408 -0.214 1
1 776 . 20 1 1 A 68 68 LEU CA C 68 55.123 54.335 0.788 1
1 777 . 20 1 1 A 68 68 LEU CB C 68 44.527 43.940 0.587 1
1 780 . 20 1 1 A 68 68 LEU N N 68 120.269 118.333 1.936 1
1 781 . 20 1 1 A 69 69 GLN H H 69 9.253 7.618 1.635 1
1 782 . 20 1 1 A 69 69 GLN HA H 69 4.770 4.852 -0.082 1
1 788 . 20 1 1 A 69 69 GLN C C 69 173.607 175.366 -1.759 1
1 789 . 20 1 1 A 69 69 GLN CA C 69 54.736 54.913 -0.177 1
1 790 . 20 1 1 A 69 69 GLN CB C 69 33.782 29.891 3.891 1
1 792 . 20 1 1 A 69 69 GLN N N 69 119.336 119.005 0.331 1
1 794 . 20 1 1 A 70 70 THR H H 70 8.803 9.097 -0.294 1
1 795 . 20 1 1 A 70 70 THR HA H 70 5.033 5.216 -0.183 1
1 800 . 20 1 1 A 70 70 THR C C 70 172.596 174.160 -1.564 1
1 801 . 20 1 1 A 70 70 THR CA C 70 62.768 61.805 0.963 1
1 802 . 20 1 1 A 70 70 THR CB C 70 69.990 71.416 -1.426 1
1 804 . 20 1 1 A 70 70 THR N N 70 118.372 118.143 0.229 1
1 805 . 20 1 1 A 71 71 VAL H H 71 9.882 9.342 0.540 1
1 806 . 20 1 1 A 71 71 VAL HA H 71 5.239 5.817 -0.578 1
1 811 . 20 1 1 A 71 71 VAL C C 71 174.015 174.632 -0.617 1
1 812 . 20 1 1 A 71 71 VAL CA C 71 60.577 59.912 0.665 1
1 813 . 20 1 1 A 71 71 VAL CB C 71 34.149 34.157 -0.008 1
1 815 . 20 1 1 A 71 71 VAL N N 71 129.063 122.411 6.652 1
1 816 . 20 1 1 A 72 72 VAL H H 72 9.491 8.832 0.659 1
1 817 . 20 1 1 A 72 72 VAL HA H 72 4.672 4.716 -0.044 1
1 825 . 20 1 1 A 72 72 VAL CA C 72 59.568 58.123 1.445 1
1 826 . 20 1 1 A 72 72 VAL CB C 72 34.057 34.432 -0.375 1
1 829 . 20 1 1 A 72 72 VAL N N 72 128.521 125.668 2.853 1
1 830 . 20 1 1 A 73 73 PRO HA H 73 5.368 4.566 0.802 1
1 836 . 20 1 1 A 73 73 PRO C C 73 175.079 176.236 -1.157 1
1 837 . 20 1 1 A 73 73 PRO CA C 73 61.324 62.726 -1.402 1
1 838 . 20 1 1 A 73 73 PRO CB C 73 33.089 32.382 0.707 1
1 841 . 20 1 1 A 74 74 THR H H 74 9.103 8.308 0.795 1
1 842 . 20 1 1 A 74 74 THR HA H 74 5.191 4.816 0.375 1
1 847 . 20 1 1 A 74 74 THR CA C 74 57.986 59.254 -1.268 1
1 848 . 20 1 1 A 74 74 THR CB C 74 72.212 72.492 -0.280 1
1 850 . 20 1 1 A 74 74 THR N N 74 118.075 117.956 0.119 1
1 851 . 20 1 1 A 75 75 PRO HA H 75 5.015 4.619 0.396 1
1 858 . 20 1 1 A 75 75 PRO C C 75 178.704 177.906 0.798 1
1 859 . 20 1 1 A 75 75 PRO CA C 75 63.038 62.750 0.288 1
1 860 . 20 1 1 A 75 75 PRO CB C 75 32.529 32.782 -0.253 1
1 863 . 20 1 1 A 76 76 ILE H H 76 8.221 8.560 -0.339 1
1 864 . 20 1 1 A 76 76 ILE HA H 76 4.218 3.990 0.228 1
1 873 . 20 1 1 A 76 76 ILE C C 76 172.375 177.453 -5.078 1
1 874 . 20 1 1 A 76 76 ILE CA C 76 63.509 63.391 0.118 1
1 875 . 20 1 1 A 76 76 ILE CB C 76 39.322 38.321 1.001 1
1 879 . 20 1 1 A 76 76 ILE N N 76 122.273 123.900 -1.627 1
1 880 . 20 1 1 A 77 77 THR H H 77 6.984 7.681 -0.697 1
1 881 . 20 1 1 A 77 77 THR HA H 77 4.227 4.609 -0.382 1
1 886 . 20 1 1 A 77 77 THR C C 77 173.531 173.711 -0.180 1
1 887 . 20 1 1 A 77 77 THR CA C 77 61.435 60.746 0.689 1
1 888 . 20 1 1 A 77 77 THR CB C 77 68.944 68.538 0.406 1
1 890 . 20 1 1 A 77 77 THR N N 77 105.803 114.375 -8.572 1
1 891 . 20 1 1 A 78 78 ALA H H 78 7.647 7.307 0.340 1
1 892 . 20 1 1 A 78 78 ALA HA H 78 4.757 4.513 0.244 1
1 896 . 20 1 1 A 78 78 ALA C C 78 173.520 176.668 -3.148 1
1 897 . 20 1 1 A 78 78 ALA CA C 78 51.164 51.533 -0.369 1
1 898 . 20 1 1 A 78 78 ALA CB C 78 20.011 21.245 -1.234 1
1 899 . 20 1 1 A 78 78 ALA N N 78 126.635 125.940 0.695 1
1 900 . 20 1 1 A 79 79 SER H H 79 7.884 8.781 -0.897 1
1 901 . 20 1 1 A 79 79 SER HA H 79 4.386 5.341 -0.955 1
1 903 . 20 1 1 A 79 79 SER C C 79 176.077 172.718 3.359 1
1 904 . 20 1 1 A 79 79 SER CA C 79 57.465 56.447 1.018 1
1 905 . 20 1 1 A 79 79 SER CB C 79 65.285 64.711 0.574 1
1 906 . 20 1 1 A 79 79 SER N N 79 115.272 113.102 2.170 1
1 907 . 20 1 1 A 80 80 LEU H H 80 7.700 8.732 -1.032 1
1 908 . 20 1 1 A 80 80 LEU HA H 80 4.912 4.489 0.423 1
1 915 . 20 1 1 A 80 80 LEU C C 80 173.927 175.228 -1.301 1
1 916 . 20 1 1 A 80 80 LEU CA C 80 53.829 54.940 -1.111 1
1 917 . 20 1 1 A 80 80 LEU CB C 80 45.990 43.426 2.564 1
1 920 . 20 1 1 A 80 80 LEU N N 80 121.507 127.597 -6.090 1
1 921 . 20 1 1 A 81 81 SER H H 81 7.885 8.756 -0.871 1
1 922 . 20 1 1 A 81 81 SER HA H 81 5.269 4.872 0.397 1
1 925 . 20 1 1 A 81 81 SER C C 81 175.756 174.899 0.857 1
1 926 . 20 1 1 A 81 81 SER CA C 81 55.507 57.102 -1.595 1
1 927 . 20 1 1 A 81 81 SER CB C 81 65.966 65.560 0.406 1
1 928 . 20 1 1 A 81 81 SER N N 81 118.323 117.044 1.279 1
1 929 . 20 1 1 A 82 82 HIS H H 82 8.935 8.952 -0.017 1
1 930 . 20 1 1 A 82 82 HIS HA H 82 4.407 4.404 0.003 1
1 932 . 20 1 1 A 82 82 HIS C C 82 176.550 176.978 -0.428 1
1 933 . 20 1 1 A 82 82 HIS CA C 82 60.960 58.862 2.098 1
1 934 . 20 1 1 A 82 82 HIS CB C 82 30.755 29.297 1.458 1
1 935 . 20 1 1 A 82 82 HIS N N 82 124.042 119.578 4.464 1
1 936 . 20 1 1 A 83 83 ASN H H 83 8.435 8.222 0.213 1
1 937 . 20 1 1 A 83 83 ASN HA H 83 4.439 4.238 0.201 1
1 941 . 20 1 1 A 83 83 ASN C C 83 174.769 177.392 -2.623 1
1 942 . 20 1 1 A 83 83 ASN CA C 83 56.575 56.630 -0.055 1
1 943 . 20 1 1 A 83 83 ASN CB C 83 38.731 38.526 0.205 1
1 944 . 20 1 1 A 83 83 ASN N N 83 118.543 119.630 -1.087 1
1 946 . 20 1 1 A 84 84 ARG H H 84 7.716 8.202 -0.486 1
1 947 . 20 1 1 A 84 84 ARG HA H 84 4.183 3.954 0.229 1
1 953 . 20 1 1 A 84 84 ARG C C 84 177.399 179.027 -1.628 1
1 954 . 20 1 1 A 84 84 ARG CA C 84 59.045 59.183 -0.138 1
1 955 . 20 1 1 A 84 84 ARG CB C 84 29.992 29.959 0.033 1
1 957 . 20 1 1 A 84 84 ARG N N 84 121.312 118.472 2.840 1
1 958 . 20 1 1 A 85 85 ILE H H 85 8.354 7.697 0.657 1
1 959 . 20 1 1 A 85 85 ILE HA H 85 3.650 4.333 -0.683 1
1 967 . 20 1 1 A 85 85 ILE C C 85 176.098 178.092 -1.994 1
1 968 . 20 1 1 A 85 85 ILE CA C 85 66.704 64.107 2.597 1
1 969 . 20 1 1 A 85 85 ILE CB C 85 38.017 37.953 0.064 1
1 972 . 20 1 1 A 85 85 ILE N N 85 119.321 120.359 -1.038 1
1 973 . 20 1 1 A 86 86 ARG H H 86 7.690 8.511 -0.821 1
1 974 . 20 1 1 A 86 86 ARG HA H 86 3.704 3.944 -0.240 1
1 981 . 20 1 1 A 86 86 ARG C C 86 177.524 178.941 -1.417 1
1 982 . 20 1 1 A 86 86 ARG CA C 86 59.881 60.150 -0.269 1
1 983 . 20 1 1 A 86 86 ARG CB C 86 29.248 29.999 -0.751 1
1 986 . 20 1 1 A 86 86 ARG N N 86 118.362 121.397 -3.035 1
1 987 . 20 1 1 A 87 87 GLU H H 87 7.884 8.303 -0.419 1
1 988 . 20 1 1 A 87 87 GLU HA H 87 4.064 4.099 -0.035 1
1 993 . 20 1 1 A 87 87 GLU C C 87 178.785 179.057 -0.272 1
1 994 . 20 1 1 A 87 87 GLU CA C 87 58.999 59.307 -0.308 1
1 995 . 20 1 1 A 87 87 GLU CB C 87 29.872 29.159 0.713 1
1 997 . 20 1 1 A 87 87 GLU N N 87 118.124 118.262 -0.138 1
1 998 . 20 1 1 A 88 88 ILE H H 88 8.715 7.825 0.890 1
1 999 . 20 1 1 A 88 88 ILE HA H 88 3.305 3.589 -0.284 1
1 1009 . 20 1 1 A 88 88 ILE C C 88 177.261 178.841 -1.580 1
1 1010 . 20 1 1 A 88 88 ILE CA C 88 65.822 64.670 1.152 1
1 1011 . 20 1 1 A 88 88 ILE CB C 88 37.370 37.108 0.262 1
1 1015 . 20 1 1 A 88 88 ILE N N 88 122.929 121.429 1.500 1
1 1016 . 20 1 1 A 89 89 LEU H H 89 8.486 8.824 -0.338 1
1 1017 . 20 1 1 A 89 89 LEU HA H 89 3.932 3.912 0.020 1
1 1023 . 20 1 1 A 89 89 LEU C C 89 177.919 179.071 -1.152 1
1 1024 . 20 1 1 A 89 89 LEU CA C 89 59.060 58.358 0.702 1
1 1025 . 20 1 1 A 89 89 LEU CB C 89 41.129 41.742 -0.613 1
1 1028 . 20 1 1 A 89 89 LEU N N 89 122.696 121.260 1.436 1
1 1029 . 20 1 1 A 90 90 LYS H H 90 7.790 7.943 -0.153 1
1 1030 . 20 1 1 A 90 90 LYS HA H 90 4.061 3.898 0.163 1
1 1035 . 20 1 1 A 90 90 LYS C C 90 178.432 178.790 -0.358 1
1 1036 . 20 1 1 A 90 90 LYS CA C 90 59.840 59.461 0.379 1
1 1037 . 20 1 1 A 90 90 LYS CB C 90 32.582 32.228 0.354 1
1 1039 . 20 1 1 A 90 90 LYS N N 90 118.640 119.475 -0.835 1
1 1040 . 20 1 1 A 91 91 ALA H H 91 8.113 7.818 0.295 1
1 1041 . 20 1 1 A 91 91 ALA HA H 91 4.151 4.121 0.030 1
1 1045 . 20 1 1 A 91 91 ALA C C 91 179.147 179.860 -0.713 1
1 1046 . 20 1 1 A 91 91 ALA CA C 91 54.942 55.328 -0.386 1
1 1047 . 20 1 1 A 91 91 ALA CB C 91 18.242 18.436 -0.194 1
1 1048 . 20 1 1 A 91 91 ALA N N 91 122.939 122.012 0.927 1
1 1049 . 20 1 1 A 92 92 SER H H 92 8.858 8.555 0.303 1
1 1050 . 20 1 1 A 92 92 SER HA H 92 4.898 4.231 0.667 1
1 1052 . 20 1 1 A 92 92 SER C C 92 172.440 176.374 -3.934 1
1 1053 . 20 1 1 A 92 92 SER CA C 92 61.913 60.833 1.080 1
1 1054 . 20 1 1 A 92 92 SER CB C 92 63.081 62.957 0.124 1
1 1055 . 20 1 1 A 92 92 SER N N 92 114.526 114.363 0.163 1
1 1056 . 20 1 1 A 93 93 ARG H H 93 7.704 8.673 -0.969 1
1 1057 . 20 1 1 A 93 93 ARG HA H 93 4.162 4.062 0.100 1
1 1059 . 20 1 1 A 93 93 ARG C C 93 177.757 178.585 -0.828 1
1 1060 . 20 1 1 A 93 93 ARG CA C 93 59.544 58.968 0.576 1
1 1061 . 20 1 1 A 93 93 ARG CB C 93 30.343 29.846 0.497 1
1 1062 . 20 1 1 A 93 93 ARG N N 93 121.505 120.022 1.483 1
1 1063 . 20 1 1 A 94 94 LYS H H 94 7.456 7.691 -0.235 1
1 1064 . 20 1 1 A 94 94 LYS HA H 94 4.174 4.112 0.062 1
1 1071 . 20 1 1 A 94 94 LYS C C 94 178.861 179.079 -0.218 1
1 1072 . 20 1 1 A 94 94 LYS CA C 94 59.030 59.269 -0.239 1
1 1073 . 20 1 1 A 94 94 LYS CB C 94 32.239 31.975 0.264 1
1 1077 . 20 1 1 A 94 94 LYS N N 94 119.072 119.326 -0.254 1
1 1078 . 20 1 1 A 95 95 LEU H H 95 8.148 7.664 0.484 1
1 1079 . 20 1 1 A 95 95 LEU HA H 95 4.129 4.156 -0.027 1
1 1088 . 20 1 1 A 95 95 LEU C C 95 177.274 178.340 -1.066 1
1 1089 . 20 1 1 A 95 95 LEU CA C 95 57.136 56.957 0.179 1
1 1090 . 20 1 1 A 95 95 LEU CB C 95 41.908 41.381 0.527 1
1 1093 . 20 1 1 A 95 95 LEU N N 95 119.717 117.377 2.340 1
1 1094 . 20 1 1 A 96 96 GLN H H 96 7.807 7.815 -0.008 1
1 1095 . 20 1 1 A 96 96 GLN HA H 96 4.242 4.343 -0.101 1
1 1102 . 20 1 1 A 96 96 GLN C C 96 175.371 175.938 -0.567 1
1 1103 . 20 1 1 A 96 96 GLN CA C 96 56.397 56.037 0.360 1
1 1104 . 20 1 1 A 96 96 GLN CB C 96 29.123 30.564 -1.441 1
1 1106 . 20 1 1 A 96 96 GLN N N 96 114.581 117.167 -2.586 1
1 1108 . 20 1 1 A 97 97 GLY H H 97 7.802 7.208 0.594 1
1 1109 . 20 1 1 A 97 97 GLY HA2 H 97 3.839 4.097 -0.258 1
1 1110 . 20 1 1 A 97 97 GLY HA3 H 97 4.096 4.097 -0.001 1
1 1111 . 20 1 1 A 97 97 GLY C C 97 172.636 171.910 0.726 1
1 1112 . 20 1 1 A 97 97 GLY CA C 97 46.372 46.025 0.347 1
1 1113 . 20 1 1 A 97 97 GLY N N 97 106.959 105.273 1.686 1
1 1114 . 20 1 1 A 98 98 ASP H H 98 8.156 8.344 -0.188 1
1 1115 . 20 1 1 A 98 98 ASP HA H 98 4.754 4.744 0.010 1
1 1118 . 20 1 1 A 98 98 ASP CA C 98 52.882 52.316 0.566 1
1 1119 . 20 1 1 A 98 98 ASP CB C 98 41.603 41.788 -0.185 1
1 1120 . 20 1 1 A 98 98 ASP N N 98 118.447 124.634 -6.187 1
1 1121 . 20 1 1 A 99 99 PRO HA H 99 4.470 4.346 0.124 1
1 1126 . 20 1 1 A 99 99 PRO C C 99 175.500 176.941 -1.441 1
1 1127 . 20 1 1 A 99 99 PRO CA C 99 63.601 63.473 0.128 1
1 1128 . 20 1 1 A 99 99 PRO CB C 99 32.423 31.354 1.069 1
1 1130 . 20 1 1 A 100 100 ASP H H 100 8.527 8.512 0.015 1
1 1131 . 20 1 1 A 100 100 ASP HA H 100 4.778 4.350 0.428 1
1 1134 . 20 1 1 A 100 100 ASP C C 100 174.931 175.802 -0.871 1
1 1135 . 20 1 1 A 100 100 ASP CA C 100 53.915 54.794 -0.879 1
1 1136 . 20 1 1 A 100 100 ASP CB C 100 40.665 38.579 2.086 1
1 1137 . 20 1 1 A 100 100 ASP N N 100 119.340 123.903 -4.563 1
1 1138 . 20 1 1 A 101 101 LEU H H 101 7.379 7.823 -0.444 1
1 1139 . 20 1 1 A 101 101 LEU HA H 101 4.682 4.817 -0.135 1
1 1148 . 20 1 1 A 101 101 LEU CA C 101 52.956 52.167 0.789 1
1 1149 . 20 1 1 A 101 101 LEU CB C 101 43.393 42.416 0.977 1
1 1152 . 20 1 1 A 101 101 LEU N N 101 122.107 117.321 4.786 1
1 1153 . 20 1 1 A 102 102 PRO HA H 102 4.487 4.488 -0.001 1
1 1158 . 20 1 1 A 102 102 PRO C C 102 175.697 176.391 -0.694 1
1 1159 . 20 1 1 A 102 102 PRO CA C 102 63.113 63.205 -0.092 1
1 1160 . 20 1 1 A 102 102 PRO CB C 102 32.138 31.685 0.453 1
1 1163 . 20 1 1 A 103 103 MET H H 103 9.011 8.781 0.230 1
1 1164 . 20 1 1 A 103 103 MET HA H 103 4.769 4.898 -0.129 1
1 1171 . 20 1 1 A 103 103 MET C C 103 174.080 174.906 -0.826 1
1 1172 . 20 1 1 A 103 103 MET CA C 103 54.737 53.428 1.309 1
1 1173 . 20 1 1 A 103 103 MET CB C 103 34.857 34.681 0.176 1
1 1176 . 20 1 1 A 103 103 MET N N 103 123.334 122.897 0.437 1
1 1177 . 20 1 1 A 104 104 SER H H 104 8.239 8.609 -0.370 1
1 1178 . 20 1 1 A 104 104 SER HA H 104 5.079 4.952 0.127 1
1 1181 . 20 1 1 A 104 104 SER C C 104 171.795 172.751 -0.956 1
1 1182 . 20 1 1 A 104 104 SER CA C 104 57.641 57.625 0.016 1
1 1183 . 20 1 1 A 104 104 SER CB C 104 66.282 67.334 -1.052 1
1 1184 . 20 1 1 A 104 104 SER N N 104 114.434 116.817 -2.383 1
1 1185 . 20 1 1 A 105 105 PHE H H 105 9.003 8.187 0.816 1
1 1186 . 20 1 1 A 105 105 PHE HA H 105 5.209 5.364 -0.155 1
1 1193 . 20 1 1 A 105 105 PHE C C 105 170.688 172.178 -1.490 1
1 1194 . 20 1 1 A 105 105 PHE CA C 105 56.917 55.892 1.025 1
1 1195 . 20 1 1 A 105 105 PHE CB C 105 41.350 41.203 0.147 1
1 1196 . 20 1 1 A 105 105 PHE N N 105 116.224 118.976 -2.752 1
1 1197 . 20 1 1 A 106 106 THR H H 106 9.074 9.299 -0.225 1
1 1198 . 20 1 1 A 106 106 THR HA H 106 4.664 4.911 -0.247 1
1 1203 . 20 1 1 A 106 106 THR C C 106 171.767 174.104 -2.337 1
1 1204 . 20 1 1 A 106 106 THR CA C 106 62.162 62.195 -0.033 1
1 1205 . 20 1 1 A 106 106 THR CB C 106 70.072 69.961 0.111 1
1 1207 . 20 1 1 A 106 106 THR N N 106 117.469 115.822 1.647 1
1 1208 . 20 1 1 A 107 107 LEU H H 107 9.804 9.050 0.754 1
1 1209 . 20 1 1 A 107 107 LEU HA H 107 4.750 4.877 -0.127 1
1 1219 . 20 1 1 A 107 107 LEU C C 107 172.742 175.188 -2.446 1
1 1220 . 20 1 1 A 107 107 LEU CA C 107 54.151 55.282 -1.131 1
1 1221 . 20 1 1 A 107 107 LEU CB C 107 44.486 43.774 0.712 1
1 1224 . 20 1 1 A 107 107 LEU N N 107 133.400 130.815 2.585 1
1 1225 . 20 1 1 A 108 108 ALA H H 108 8.435 8.566 -0.131 1
1 1226 . 20 1 1 A 108 108 ALA HA H 108 4.683 5.291 -0.608 1
1 1230 . 20 1 1 A 108 108 ALA C C 108 173.052 175.320 -2.268 1
1 1231 . 20 1 1 A 108 108 ALA CA C 108 49.308 50.472 -1.164 1
1 1232 . 20 1 1 A 108 108 ALA CB C 108 22.120 21.422 0.698 1
1 1233 . 20 1 1 A 108 108 ALA N N 108 131.422 128.265 3.157 1
1 1234 . 20 1 1 A 109 109 ILE H H 109 8.909 9.639 -0.730 1
1 1235 . 20 1 1 A 109 109 ILE HA H 109 4.063 4.959 -0.896 1
1 1245 . 20 1 1 A 109 109 ILE CA C 109 60.982 59.586 1.396 1
1 1246 . 20 1 1 A 109 109 ILE CB C 109 39.074 39.137 -0.063 1
1 1250 . 20 1 1 A 109 109 ILE N N 109 124.415 123.938 0.477 1
1 1251 . 20 1 1 A 110 110 VAL H H 110 8.706 8.870 -0.164 1
1 1252 . 20 1 1 A 110 110 VAL HA H 110 4.324 4.987 -0.663 1
1 1260 . 20 1 1 A 110 110 VAL C C 110 175.700 174.767 0.933 1
1 1261 . 20 1 1 A 110 110 VAL CA C 110 62.316 60.755 1.561 1
1 1262 . 20 1 1 A 110 110 VAL CB C 110 31.876 33.282 -1.406 1
1 1264 . 20 1 1 A 110 110 VAL N N 110 127.457 124.300 3.157 1
1 1265 . 20 1 1 A 111 111 GLU H H 111 9.024 9.195 -0.171 1
1 1266 . 20 1 1 A 111 111 GLU HA H 111 4.403 4.386 0.017 1
1 1269 . 20 1 1 A 111 111 GLU C C 111 175.987 176.357 -0.370 1
1 1270 . 20 1 1 A 111 111 GLU CA C 111 56.842 56.284 0.558 1
1 1271 . 20 1 1 A 111 111 GLU CB C 111 31.044 30.912 0.132 1
1 1272 . 20 1 1 A 111 111 GLU N N 111 129.768 127.786 1.982 1
1 1273 . 20 1 1 A 112 112 SER H H 112 9.143 8.639 0.504 1
1 1274 . 20 1 1 A 112 112 SER HA H 112 4.394 4.243 0.151 1
1 1276 . 20 1 1 A 112 112 SER C C 112 173.187 174.967 -1.780 1
1 1277 . 20 1 1 A 112 112 SER CA C 112 60.180 59.305 0.875 1
1 1278 . 20 1 1 A 112 112 SER CB C 112 63.415 62.640 0.775 1
1 1279 . 20 1 1 A 112 112 SER N N 112 115.956 120.662 -4.706 1
1 1280 . 20 1 1 A 113 113 ASP H H 113 8.133 9.175 -1.042 1
1 1281 . 20 1 1 A 113 113 ASP HA H 113 4.573 4.341 0.232 1
1 1284 . 20 1 1 A 113 113 ASP C C 113 175.430 175.510 -0.080 1
1 1285 . 20 1 1 A 113 113 ASP CA C 113 54.115 55.795 -1.680 1
1 1286 . 20 1 1 A 113 113 ASP CB C 113 40.011 39.689 0.322 1
1 1287 . 20 1 1 A 113 113 ASP N N 113 118.343 122.755 -4.412 1
1 1288 . 20 1 1 A 114 114 SER H H 114 8.034 8.420 -0.386 1
1 1289 . 20 1 1 A 114 114 SER HA H 114 4.057 4.806 -0.749 1
1 1291 . 20 1 1 A 114 114 SER C C 114 172.209 173.512 -1.303 1
1 1292 . 20 1 1 A 114 114 SER CA C 114 60.179 59.704 0.475 1
1 1293 . 20 1 1 A 114 114 SER CB C 114 62.702 64.796 -2.094 1
1 1294 . 20 1 1 A 114 114 SER N N 114 109.836 112.590 -2.754 1
1 1295 . 20 1 1 A 115 115 THR H H 115 7.711 7.745 -0.034 1
1 1296 . 20 1 1 A 115 115 THR HA H 115 4.250 4.326 -0.076 1
1 1300 . 20 1 1 A 115 115 THR C C 115 171.500 173.819 -2.319 1
1 1301 . 20 1 1 A 115 115 THR CA C 115 63.547 62.480 1.067 1
1 1302 . 20 1 1 A 115 115 THR CB C 115 69.595 69.275 0.320 1
1 1303 . 20 1 1 A 115 115 THR N N 115 117.407 114.786 2.621 1
1 1304 . 20 1 1 A 116 116 ILE H H 116 8.219 8.867 -0.648 1
1 1305 . 20 1 1 A 116 116 ILE HA H 116 4.769 4.518 0.251 1
1 1315 . 20 1 1 A 116 116 ILE C C 116 174.434 175.194 -0.760 1
1 1316 . 20 1 1 A 116 116 ILE CA C 116 60.306 60.509 -0.203 1
1 1317 . 20 1 1 A 116 116 ILE CB C 116 40.686 37.329 3.357 1
1 1321 . 20 1 1 A 116 116 ILE N N 116 125.480 128.653 -3.173 1
1 1322 . 20 1 1 A 117 117 VAL H H 117 8.695 9.270 -0.575 1
1 1323 . 20 1 1 A 117 117 VAL HA H 117 4.315 4.557 -0.242 1
1 1328 . 20 1 1 A 117 117 VAL C C 117 172.243 174.424 -2.181 1
1 1329 . 20 1 1 A 117 117 VAL CA C 117 60.621 60.764 -0.143 1
1 1330 . 20 1 1 A 117 117 VAL CB C 117 34.558 33.187 1.371 1
1 1332 . 20 1 1 A 117 117 VAL N N 117 127.887 127.861 0.026 1
1 1333 . 20 1 1 A 118 118 TYR H H 118 8.270 8.752 -0.482 1
1 1334 . 20 1 1 A 118 118 TYR HA H 118 5.327 5.038 0.289 1
1 1342 . 20 1 1 A 118 118 TYR C C 118 174.250 175.082 -0.832 1
1 1343 . 20 1 1 A 118 118 TYR CA C 118 57.283 57.783 -0.500 1
1 1344 . 20 1 1 A 118 118 TYR CB C 118 39.262 40.068 -0.806 1
1 1345 . 20 1 1 A 118 118 TYR N N 118 124.822 127.036 -2.214 1
1 1346 . 20 1 1 A 119 119 TYR H H 119 9.207 9.321 -0.114 1
1 1347 . 20 1 1 A 119 119 TYR HA H 119 4.821 5.076 -0.255 1
1 1354 . 20 1 1 A 119 119 TYR C C 119 171.994 173.145 -1.151 1
1 1355 . 20 1 1 A 119 119 TYR CA C 119 58.116 57.987 0.129 1
1 1356 . 20 1 1 A 119 119 TYR CB C 119 43.544 41.830 1.714 1
1 1357 . 20 1 1 A 119 119 TYR N N 119 125.153 123.276 1.877 1
1 1358 . 20 1 1 A 120 120 LYS H H 120 7.700 8.657 -0.957 1
1 1359 . 20 1 1 A 120 120 LYS HA H 120 4.558 4.705 -0.147 1
1 1366 . 20 1 1 A 120 120 LYS C C 120 172.017 174.567 -2.550 1
1 1367 . 20 1 1 A 120 120 LYS CA C 120 57.217 55.456 1.761 1
1 1368 . 20 1 1 A 120 120 LYS CB C 120 33.914 33.563 0.351 1
1 1372 . 20 1 1 A 120 120 LYS N N 120 129.442 129.215 0.227 1
1 1373 . 20 1 1 A 121 121 LEU H H 121 8.112 8.528 -0.416 1
1 1374 . 20 1 1 A 121 121 LEU HA H 121 5.323 5.120 0.203 1
1 1384 . 20 1 1 A 121 121 LEU C C 121 175.733 174.168 1.565 1
1 1385 . 20 1 1 A 121 121 LEU CA C 121 52.716 53.101 -0.385 1
1 1386 . 20 1 1 A 121 121 LEU CB C 121 44.098 45.275 -1.177 1
1 1389 . 20 1 1 A 121 121 LEU N N 121 123.403 127.733 -4.330 1
1 1390 . 20 1 1 A 122 122 THR H H 122 8.338 8.771 -0.433 1
1 1391 . 20 1 1 A 122 122 THR HA H 122 5.097 4.900 0.197 1
1 1396 . 20 1 1 A 122 122 THR C C 122 173.221 172.104 1.117 1
1 1397 . 20 1 1 A 122 122 THR CA C 122 60.306 59.589 0.717 1
1 1398 . 20 1 1 A 122 122 THR CB C 122 72.473 71.425 1.048 1
1 1400 . 20 1 1 A 122 122 THR N N 122 109.081 119.543 -10.462 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 114 1.650 1
2 1 1 1 "RMS(OBS, PRED)" CA 121 1.093 1
3 1 1 1 "RMS(OBS, PRED)" CB 114 1.157 1
4 1 1 1 "RMS(OBS, PRED)" H 115 0.604 1
5 1 1 1 "RMS(OBS, PRED)" HA 128 0.353 1
6 1 1 1 "RMS(OBS, PRED)" N 115 3.458 1
7 1 2 1 "RMS(OBS, PRED)" C 114 1.684 1
8 1 2 1 "RMS(OBS, PRED)" CA 121 1.087 1
9 1 2 1 "RMS(OBS, PRED)" CB 114 1.035 1
10 1 2 1 "RMS(OBS, PRED)" H 115 0.586 1
11 1 2 1 "RMS(OBS, PRED)" HA 128 0.340 1
12 1 2 1 "RMS(OBS, PRED)" N 115 3.126 1
13 1 3 1 "RMS(OBS, PRED)" C 114 1.709 1
14 1 3 1 "RMS(OBS, PRED)" CA 121 1.126 1
15 1 3 1 "RMS(OBS, PRED)" CB 114 1.049 1
16 1 3 1 "RMS(OBS, PRED)" H 115 0.589 1
17 1 3 1 "RMS(OBS, PRED)" HA 128 0.358 1
18 1 3 1 "RMS(OBS, PRED)" N 115 3.558 1
19 1 4 1 "RMS(OBS, PRED)" C 114 1.655 1
20 1 4 1 "RMS(OBS, PRED)" CA 121 1.196 1
21 1 4 1 "RMS(OBS, PRED)" CB 114 1.080 1
22 1 4 1 "RMS(OBS, PRED)" H 115 0.589 1
23 1 4 1 "RMS(OBS, PRED)" HA 128 0.351 1
24 1 4 1 "RMS(OBS, PRED)" N 115 3.524 1
25 1 5 1 "RMS(OBS, PRED)" C 114 1.683 1
26 1 5 1 "RMS(OBS, PRED)" CA 121 1.114 1
27 1 5 1 "RMS(OBS, PRED)" CB 114 1.201 1
28 1 5 1 "RMS(OBS, PRED)" H 115 0.591 1
29 1 5 1 "RMS(OBS, PRED)" HA 128 0.340 1
30 1 5 1 "RMS(OBS, PRED)" N 115 3.189 1
31 1 6 1 "RMS(OBS, PRED)" C 114 1.605 1
32 1 6 1 "RMS(OBS, PRED)" CA 121 1.078 1
33 1 6 1 "RMS(OBS, PRED)" CB 114 1.131 1
34 1 6 1 "RMS(OBS, PRED)" H 115 0.600 1
35 1 6 1 "RMS(OBS, PRED)" HA 128 0.308 1
36 1 6 1 "RMS(OBS, PRED)" N 115 3.485 1
37 1 7 1 "RMS(OBS, PRED)" C 114 1.692 1
38 1 7 1 "RMS(OBS, PRED)" CA 121 1.095 1
39 1 7 1 "RMS(OBS, PRED)" CB 114 1.157 1
40 1 7 1 "RMS(OBS, PRED)" H 115 0.572 1
41 1 7 1 "RMS(OBS, PRED)" HA 128 0.346 1
42 1 7 1 "RMS(OBS, PRED)" N 115 3.402 1
43 1 8 1 "RMS(OBS, PRED)" C 114 1.674 1
44 1 8 1 "RMS(OBS, PRED)" CA 121 1.081 1
45 1 8 1 "RMS(OBS, PRED)" CB 114 1.109 1
46 1 8 1 "RMS(OBS, PRED)" H 115 0.610 1
47 1 8 1 "RMS(OBS, PRED)" HA 128 0.331 1
48 1 8 1 "RMS(OBS, PRED)" N 115 3.423 1
49 1 9 1 "RMS(OBS, PRED)" C 114 1.745 1
50 1 9 1 "RMS(OBS, PRED)" CA 121 1.062 1
51 1 9 1 "RMS(OBS, PRED)" CB 114 1.143 1
52 1 9 1 "RMS(OBS, PRED)" H 115 0.553 1
53 1 9 1 "RMS(OBS, PRED)" HA 128 0.325 1
54 1 9 1 "RMS(OBS, PRED)" N 115 3.095 1
55 1 10 1 "RMS(OBS, PRED)" C 114 1.686 1
56 1 10 1 "RMS(OBS, PRED)" CA 121 1.053 1
57 1 10 1 "RMS(OBS, PRED)" CB 114 1.074 1
58 1 10 1 "RMS(OBS, PRED)" H 115 0.581 1
59 1 10 1 "RMS(OBS, PRED)" HA 128 0.305 1
60 1 10 1 "RMS(OBS, PRED)" N 115 3.154 1
61 1 11 1 "RMS(OBS, PRED)" C 114 1.623 1
62 1 11 1 "RMS(OBS, PRED)" CA 121 1.087 1
63 1 11 1 "RMS(OBS, PRED)" CB 114 1.179 1
64 1 11 1 "RMS(OBS, PRED)" H 115 0.615 1
65 1 11 1 "RMS(OBS, PRED)" HA 128 0.364 1
66 1 11 1 "RMS(OBS, PRED)" N 115 3.577 1
67 1 12 1 "RMS(OBS, PRED)" C 114 1.649 1
68 1 12 1 "RMS(OBS, PRED)" CA 121 1.040 1
69 1 12 1 "RMS(OBS, PRED)" CB 114 1.064 1
70 1 12 1 "RMS(OBS, PRED)" H 115 0.577 1
71 1 12 1 "RMS(OBS, PRED)" HA 128 0.412 1
72 1 12 1 "RMS(OBS, PRED)" N 115 3.172 1
73 1 13 1 "RMS(OBS, PRED)" C 114 1.688 1
74 1 13 1 "RMS(OBS, PRED)" CA 121 1.082 1
75 1 13 1 "RMS(OBS, PRED)" CB 114 1.085 1
76 1 13 1 "RMS(OBS, PRED)" H 115 0.552 1
77 1 13 1 "RMS(OBS, PRED)" HA 128 0.340 1
78 1 13 1 "RMS(OBS, PRED)" N 115 3.085 1
79 1 14 1 "RMS(OBS, PRED)" C 114 1.720 1
80 1 14 1 "RMS(OBS, PRED)" CA 121 1.278 1
81 1 14 1 "RMS(OBS, PRED)" CB 114 1.140 1
82 1 14 1 "RMS(OBS, PRED)" H 115 0.575 1
83 1 14 1 "RMS(OBS, PRED)" HA 128 0.353 1
84 1 14 1 "RMS(OBS, PRED)" N 115 3.301 1
85 1 15 1 "RMS(OBS, PRED)" C 114 1.627 1
86 1 15 1 "RMS(OBS, PRED)" CA 121 1.133 1
87 1 15 1 "RMS(OBS, PRED)" CB 114 1.120 1
88 1 15 1 "RMS(OBS, PRED)" H 115 0.613 1
89 1 15 1 "RMS(OBS, PRED)" HA 128 0.348 1
90 1 15 1 "RMS(OBS, PRED)" N 115 3.307 1
91 1 16 1 "RMS(OBS, PRED)" C 114 1.665 1
92 1 16 1 "RMS(OBS, PRED)" CA 121 1.155 1
93 1 16 1 "RMS(OBS, PRED)" CB 114 1.144 1
94 1 16 1 "RMS(OBS, PRED)" H 115 0.618 1
95 1 16 1 "RMS(OBS, PRED)" HA 128 0.392 1
96 1 16 1 "RMS(OBS, PRED)" N 115 2.967 1
97 1 17 1 "RMS(OBS, PRED)" C 114 1.713 1
98 1 17 1 "RMS(OBS, PRED)" CA 121 1.092 1
99 1 17 1 "RMS(OBS, PRED)" CB 114 1.252 1
100 1 17 1 "RMS(OBS, PRED)" H 115 0.574 1
101 1 17 1 "RMS(OBS, PRED)" HA 128 0.354 1
102 1 17 1 "RMS(OBS, PRED)" N 115 2.841 1
103 1 18 1 "RMS(OBS, PRED)" C 114 1.705 1
104 1 18 1 "RMS(OBS, PRED)" CA 121 1.086 1
105 1 18 1 "RMS(OBS, PRED)" CB 114 1.152 1
106 1 18 1 "RMS(OBS, PRED)" H 115 0.542 1
107 1 18 1 "RMS(OBS, PRED)" HA 128 0.319 1
108 1 18 1 "RMS(OBS, PRED)" N 115 3.258 1
109 1 19 1 "RMS(OBS, PRED)" C 114 1.590 1
110 1 19 1 "RMS(OBS, PRED)" CA 121 1.167 1
111 1 19 1 "RMS(OBS, PRED)" CB 114 1.153 1
112 1 19 1 "RMS(OBS, PRED)" H 115 0.624 1
113 1 19 1 "RMS(OBS, PRED)" HA 128 0.344 1
114 1 19 1 "RMS(OBS, PRED)" N 115 3.333 1
115 1 20 1 "RMS(OBS, PRED)" C 114 1.632 1
116 1 20 1 "RMS(OBS, PRED)" CA 121 1.006 1
117 1 20 1 "RMS(OBS, PRED)" CB 114 1.153 1
118 1 20 1 "RMS(OBS, PRED)" H 115 0.590 1
119 1 20 1 "RMS(OBS, PRED)" HA 128 0.335 1
120 1 20 1 "RMS(OBS, PRED)" N 115 3.233 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 7 . 1 1 A 2 2 GLU H H 2 8.994 8.391 0.603 2
1 8 . 1 1 A 2 2 GLU HA H 2 4.278 4.527 -0.249 2
1 13 . 1 1 A 2 2 GLU C C 2 175.315 176.477 -1.162 2
1 14 . 1 1 A 2 2 GLU CA C 2 57.318 57.049 0.269 2
1 15 . 1 1 A 2 2 GLU CB C 2 29.221 30.560 -1.339 2
1 17 . 1 1 A 2 2 GLU N N 2 122.259 120.515 1.744 2
1 18 . 1 1 A 3 3 ASP H H 3 8.048 8.160 -0.112 2
1 19 . 1 1 A 3 3 ASP HA H 3 4.580 4.608 -0.028 2
1 21 . 1 1 A 3 3 ASP C C 3 175.636 175.894 -0.258 2
1 22 . 1 1 A 3 3 ASP CA C 3 54.579 54.152 0.427 2
1 23 . 1 1 A 3 3 ASP CB C 3 40.984 40.932 0.052 2
1 24 . 1 1 A 3 3 ASP N N 3 119.830 118.637 1.193 2
1 25 . 1 1 A 4 4 ALA H H 4 8.090 7.812 0.278 2
1 26 . 1 1 A 4 4 ALA HA H 4 4.216 4.474 -0.258 2
1 30 . 1 1 A 4 4 ALA C C 4 177.157 177.636 -0.479 2
1 31 . 1 1 A 4 4 ALA CA C 4 53.620 51.977 1.643 2
1 32 . 1 1 A 4 4 ALA CB C 4 18.728 18.913 -0.185 2
1 33 . 1 1 A 4 4 ALA N N 4 123.957 122.505 1.452 2
1 34 . 1 1 A 5 5 TRP H H 5 7.941 7.859 0.083 2
1 35 . 1 1 A 5 5 TRP HA H 5 4.559 4.576 -0.017 2
1 39 . 1 1 A 5 5 TRP C C 5 176.072 177.235 -1.163 2
1 40 . 1 1 A 5 5 TRP CA C 5 57.744 59.042 -1.298 2
1 41 . 1 1 A 5 5 TRP CB C 5 28.906 29.933 -1.027 2
1 42 . 1 1 A 5 5 TRP N N 5 118.408 119.358 -0.950 2
1 44 . 1 1 A 6 6 MET H H 6 7.679 7.956 -0.277 2
1 45 . 1 1 A 6 6 MET HA H 6 3.785 4.616 -0.831 2
1 52 . 1 1 A 6 6 MET C C 6 175.174 176.726 -1.552 2
1 53 . 1 1 A 6 6 MET CA C 6 57.724 56.063 1.661 2
1 54 . 1 1 A 6 6 MET CB C 6 31.640 34.197 -2.557 2
1 57 . 1 1 A 6 6 MET N N 6 121.538 116.527 5.011 2
1 58 . 1 1 A 7 7 GLY H H 7 7.247 7.973 -0.725 2
1 59 . 1 1 A 7 7 GLY HA2 H 7 3.455 3.916 -0.461 2
1 60 . 1 1 A 7 7 GLY HA3 H 7 3.578 4.092 -0.514 2
1 61 . 1 1 A 7 7 GLY C C 7 172.852 174.137 -1.285 2
1 62 . 1 1 A 7 7 GLY CA C 7 45.896 45.306 0.590 2
1 63 . 1 1 A 7 7 GLY N N 7 104.055 108.262 -4.207 2
1 64 . 1 1 A 8 8 THR H H 8 7.436 8.199 -0.763 2
1 65 . 1 1 A 8 8 THR HA H 8 4.428 4.422 0.006 2
1 70 . 1 1 A 8 8 THR C C 8 172.973 173.787 -0.814 2
1 71 . 1 1 A 8 8 THR CA C 8 60.751 62.368 -1.617 2
1 72 . 1 1 A 8 8 THR CB C 8 69.637 69.595 0.042 2
1 74 . 1 1 A 8 8 THR N N 8 107.669 113.915 -6.246 2
1 75 . 1 1 A 9 9 HIS H H 9 8.048 7.792 0.256 2
1 76 . 1 1 A 9 9 HIS HA H 9 4.654 4.885 -0.231 2
1 79 . 1 1 A 9 9 HIS CA C 9 56.163 54.304 1.859 2
1 80 . 1 1 A 9 9 HIS CB C 9 32.619 30.920 1.699 2
1 81 . 1 1 A 9 9 HIS N N 9 127.281 120.799 6.482 2
1 82 . 1 1 A 10 10 PRO HA H 10 4.257 4.253 0.004 2
1 88 . 1 1 A 10 10 PRO C C 10 178.779 179.004 -0.225 2
1 89 . 1 1 A 10 10 PRO CA C 10 65.565 66.003 -0.438 2
1 90 . 1 1 A 10 10 PRO CB C 10 32.422 31.919 0.503 2
1 93 . 1 1 A 11 11 LYS H H 11 10.994 8.551 2.443 2
1 94 . 1 1 A 11 11 LYS HA H 11 4.282 4.177 0.105 2
1 100 . 1 1 A 11 11 LYS C C 11 177.279 178.708 -1.429 2
1 101 . 1 1 A 11 11 LYS CA C 11 56.859 59.374 -2.515 2
1 102 . 1 1 A 11 11 LYS CB C 11 31.279 32.347 -1.068 2
1 104 . 1 1 A 11 11 LYS N N 11 121.398 117.997 3.401 2
1 105 . 1 1 A 12 12 TYR H H 12 7.146 8.292 -1.146 2
1 106 . 1 1 A 12 12 TYR HA H 12 3.722 4.272 -0.550 2
1 113 . 1 1 A 12 12 TYR C C 12 176.265 177.465 -1.201 2
1 114 . 1 1 A 12 12 TYR CA C 12 61.189 61.433 -0.244 2
1 115 . 1 1 A 12 12 TYR CB C 12 37.796 38.406 -0.610 2
1 116 . 1 1 A 12 12 TYR N N 12 121.579 121.906 -0.327 2
1 117 . 1 1 A 13 13 LEU H H 13 7.778 8.863 -1.085 2
1 118 . 1 1 A 13 13 LEU HA H 13 3.773 3.948 -0.175 2
1 127 . 1 1 A 13 13 LEU C C 13 178.462 178.704 -0.242 2
1 128 . 1 1 A 13 13 LEU CA C 13 57.942 58.129 -0.187 2
1 129 . 1 1 A 13 13 LEU CB C 13 41.064 41.498 -0.434 2
1 132 . 1 1 A 13 13 LEU N N 13 117.518 120.655 -3.137 2
1 133 . 1 1 A 14 14 GLU H H 14 7.867 8.633 -0.766 2
1 134 . 1 1 A 14 14 GLU HA H 14 3.935 3.963 -0.028 2
1 139 . 1 1 A 14 14 GLU C C 14 178.326 178.830 -0.504 2
1 140 . 1 1 A 14 14 GLU CA C 14 59.368 59.805 -0.437 2
1 141 . 1 1 A 14 14 GLU CB C 14 30.147 29.183 0.964 2
1 143 . 1 1 A 14 14 GLU N N 14 119.135 118.897 0.238 2
1 144 . 1 1 A 15 15 MET H H 15 7.773 7.733 0.040 2
1 145 . 1 1 A 15 15 MET HA H 15 3.936 4.136 -0.200 2
1 152 . 1 1 A 15 15 MET C C 15 177.886 178.050 -0.164 2
1 153 . 1 1 A 15 15 MET CA C 15 59.465 58.100 1.365 2
1 154 . 1 1 A 15 15 MET CB C 15 33.987 32.176 1.811 2
1 157 . 1 1 A 15 15 MET N N 15 117.884 119.466 -1.582 2
1 158 . 1 1 A 16 16 MET H H 16 8.145 8.264 -0.119 2
1 159 . 1 1 A 16 16 MET HA H 16 4.159 4.090 0.069 2
1 166 . 1 1 A 16 16 MET C C 16 177.835 178.217 -0.382 2
1 167 . 1 1 A 16 16 MET CA C 16 57.397 57.774 -0.377 2
1 168 . 1 1 A 16 16 MET CB C 16 31.867 31.944 -0.077 2
1 171 . 1 1 A 16 16 MET N N 16 119.555 117.928 1.627 2
1 172 . 1 1 A 17 17 GLU H H 17 7.761 8.049 -0.288 2
1 173 . 1 1 A 17 17 GLU HA H 17 4.117 4.178 -0.061 2
1 176 . 1 1 A 17 17 GLU C C 17 175.994 176.898 -0.904 2
1 177 . 1 1 A 17 17 GLU CA C 17 57.392 58.166 -0.774 2
1 178 . 1 1 A 17 17 GLU CB C 17 29.432 29.723 -0.291 2
1 180 . 1 1 A 17 17 GLU N N 17 118.216 118.712 -0.496 2
1 181 . 1 1 A 18 18 LEU H H 18 7.201 7.239 -0.037 2
1 182 . 1 1 A 18 18 LEU HA H 18 4.111 4.287 -0.176 2
1 191 . 1 1 A 18 18 LEU C C 18 175.781 177.014 -1.233 2
1 192 . 1 1 A 18 18 LEU CA C 18 56.366 54.630 1.736 2
1 193 . 1 1 A 18 18 LEU CB C 18 42.030 42.754 -0.724 2
1 196 . 1 1 A 18 18 LEU N N 18 117.448 120.446 -2.998 2
1 197 . 1 1 A 19 19 ASP H H 19 7.789 8.767 -0.978 2
1 198 . 1 1 A 19 19 ASP HA H 19 4.360 4.569 -0.209 2
1 201 . 1 1 A 19 19 ASP C C 19 173.765 176.055 -2.290 2
1 202 . 1 1 A 19 19 ASP CA C 19 54.851 55.148 -0.297 2
1 203 . 1 1 A 19 19 ASP CB C 19 39.115 40.468 -1.353 2
1 204 . 1 1 A 19 19 ASP N N 19 115.844 120.218 -4.374 2
1 205 . 1 1 A 20 20 ILE H H 20 8.142 7.840 0.302 2
1 206 . 1 1 A 20 20 ILE HA H 20 4.128 4.253 -0.125 2
1 216 . 1 1 A 20 20 ILE C C 20 174.710 176.184 -1.474 2
1 217 . 1 1 A 20 20 ILE CA C 20 60.465 61.923 -1.458 2
1 218 . 1 1 A 20 20 ILE CB C 20 40.407 39.202 1.205 2
1 222 . 1 1 A 20 20 ILE N N 20 117.287 116.918 0.369 2
1 223 . 1 1 A 21 21 GLY H H 21 8.207 8.369 -0.162 2
1 224 . 1 1 A 21 21 GLY HA2 H 21 3.889 3.926 -0.037 2
1 225 . 1 1 A 21 21 GLY HA3 H 21 3.924 3.937 -0.013 2
1 226 . 1 1 A 21 21 GLY C C 21 172.162 173.555 -1.393 2
1 227 . 1 1 A 21 21 GLY CA C 21 45.017 46.401 -1.384 2
1 228 . 1 1 A 21 21 GLY N N 21 110.656 110.717 -0.061 2
1 229 . 1 1 A 22 22 ASP H H 22 7.727 8.140 -0.413 2
1 230 . 1 1 A 22 22 ASP HA H 22 4.794 4.928 -0.134 2
1 233 . 1 1 A 22 22 ASP C C 22 174.884 176.525 -1.641 2
1 234 . 1 1 A 22 22 ASP CA C 22 52.471 53.069 -0.598 2
1 235 . 1 1 A 22 22 ASP CB C 22 42.069 42.407 -0.338 2
1 236 . 1 1 A 22 22 ASP N N 22 119.305 121.537 -2.232 2
1 237 . 1 1 A 23 23 ALA H H 23 8.644 9.021 -0.377 2
1 238 . 1 1 A 23 23 ALA HA H 23 4.120 4.034 0.086 2
1 242 . 1 1 A 23 23 ALA C C 23 179.546 179.772 -0.226 2
1 243 . 1 1 A 23 23 ALA CA C 23 55.609 55.381 0.228 2
1 244 . 1 1 A 23 23 ALA CB C 23 18.573 18.461 0.112 2
1 245 . 1 1 A 23 23 ALA N N 23 122.468 128.911 -6.443 2
1 246 . 1 1 A 24 24 THR H H 24 8.238 7.703 0.535 2
1 247 . 1 1 A 24 24 THR HA H 24 4.184 4.045 0.139 2
1 252 . 1 1 A 24 24 THR C C 24 174.841 176.654 -1.813 2
1 253 . 1 1 A 24 24 THR CA C 24 66.241 66.490 -0.249 2
1 254 . 1 1 A 24 24 THR CB C 24 68.376 68.449 -0.073 2
1 256 . 1 1 A 24 24 THR N N 24 114.824 113.909 0.915 2
1 257 . 1 1 A 25 25 GLN H H 25 8.037 8.448 -0.411 2
1 258 . 1 1 A 25 25 GLN HA H 25 4.095 4.029 0.066 2
1 265 . 1 1 A 25 25 GLN C C 25 177.603 178.588 -0.985 2
1 266 . 1 1 A 25 25 GLN CA C 25 59.261 58.847 0.414 2
1 267 . 1 1 A 25 25 GLN CB C 25 28.437 28.334 0.103 2
1 269 . 1 1 A 25 25 GLN N N 25 122.518 120.477 2.041 2
1 271 . 1 1 A 26 26 VAL H H 26 7.994 8.329 -0.335 2
1 272 . 1 1 A 26 26 VAL HA H 26 3.469 3.734 -0.265 2
1 280 . 1 1 A 26 26 VAL C C 26 175.552 177.945 -2.393 2
1 281 . 1 1 A 26 26 VAL CA C 26 66.909 65.967 0.942 2
1 282 . 1 1 A 26 26 VAL CB C 26 31.582 31.374 0.208 2
1 285 . 1 1 A 26 26 VAL N N 26 119.112 118.930 0.182 2
1 286 . 1 1 A 27 27 TYR H H 27 8.003 8.277 -0.274 2
1 287 . 1 1 A 27 27 TYR HA H 27 4.357 4.383 -0.026 2
1 294 . 1 1 A 27 27 TYR C C 27 175.856 177.102 -1.246 2
1 295 . 1 1 A 27 27 TYR CA C 27 62.197 61.719 0.478 2
1 296 . 1 1 A 27 27 TYR CB C 27 38.394 38.827 -0.433 2
1 297 . 1 1 A 27 27 TYR N N 27 119.170 123.220 -4.050 2
1 298 . 1 1 A 28 28 VAL H H 28 8.087 8.429 -0.342 2
1 299 . 1 1 A 28 28 VAL HA H 28 3.652 3.456 0.196 2
1 307 . 1 1 A 28 28 VAL C C 28 176.134 178.032 -1.899 2
1 308 . 1 1 A 28 28 VAL CA C 28 66.247 66.284 -0.037 2
1 309 . 1 1 A 28 28 VAL CB C 28 31.241 31.379 -0.138 2
1 312 . 1 1 A 28 28 VAL N N 28 113.112 119.393 -6.281 2
1 313 . 1 1 A 29 29 ALA H H 29 7.853 8.773 -0.920 2
1 314 . 1 1 A 29 29 ALA HA H 29 3.913 4.060 -0.147 2
1 318 . 1 1 A 29 29 ALA C C 29 177.850 179.263 -1.413 2
1 319 . 1 1 A 29 29 ALA CA C 29 55.274 54.932 0.341 2
1 320 . 1 1 A 29 29 ALA CB C 29 17.876 18.347 -0.471 2
1 321 . 1 1 A 29 29 ALA N N 29 121.350 122.682 -1.332 2
1 322 . 1 1 A 30 30 PHE H H 30 8.724 8.305 0.419 2
1 323 . 1 1 A 30 30 PHE HA H 30 4.098 4.262 -0.164 2
1 327 . 1 1 A 30 30 PHE C C 30 175.035 177.151 -2.116 2
1 328 . 1 1 A 30 30 PHE CA C 30 61.264 61.559 -0.295 2
1 329 . 1 1 A 30 30 PHE CB C 30 38.926 39.345 -0.419 2
1 330 . 1 1 A 30 30 PHE N N 30 120.478 120.212 0.266 2
1 331 . 1 1 A 31 31 LEU H H 31 8.146 8.072 0.074 2
1 332 . 1 1 A 31 31 LEU HA H 31 3.597 3.591 0.006 2
1 341 . 1 1 A 31 31 LEU C C 31 179.508 179.282 0.226 2
1 342 . 1 1 A 31 31 LEU CA C 31 57.884 58.065 -0.181 2
1 343 . 1 1 A 31 31 LEU CB C 31 41.829 42.074 -0.245 2
1 346 . 1 1 A 31 31 LEU N N 31 118.427 120.282 -1.855 2
1 347 . 1 1 A 32 32 VAL H H 32 7.627 7.644 -0.017 2
1 348 . 1 1 A 32 32 VAL HA H 32 3.464 3.815 -0.351 2
1 356 . 1 1 A 32 32 VAL C C 32 174.956 177.669 -2.713 2
1 357 . 1 1 A 32 32 VAL CA C 32 66.373 65.654 0.719 2
1 358 . 1 1 A 32 32 VAL CB C 32 31.121 31.472 -0.351 2
1 361 . 1 1 A 32 32 VAL N N 32 119.497 114.299 5.198 2
1 362 . 1 1 A 33 33 TYR H H 33 8.366 8.653 -0.287 2
1 363 . 1 1 A 33 33 TYR HA H 33 3.485 3.983 -0.498 2
1 370 . 1 1 A 33 33 TYR C C 33 174.883 176.906 -2.023 2
1 371 . 1 1 A 33 33 TYR CA C 33 62.866 61.350 1.516 2
1 372 . 1 1 A 33 33 TYR CB C 33 37.778 38.311 -0.533 2
1 373 . 1 1 A 33 33 TYR N N 33 121.842 124.228 -2.386 2
1 374 . 1 1 A 34 34 LEU H H 34 8.000 8.405 -0.405 2
1 375 . 1 1 A 34 34 LEU HA H 34 3.495 3.627 -0.132 2
1 385 . 1 1 A 34 34 LEU C C 34 178.240 179.067 -0.827 2
1 386 . 1 1 A 34 34 LEU CA C 34 57.453 57.250 0.203 2
1 387 . 1 1 A 34 34 LEU CB C 34 41.828 40.969 0.859 2
1 390 . 1 1 A 34 34 LEU N N 34 116.692 119.405 -2.713 2
1 391 . 1 1 A 35 35 ASP H H 35 7.688 7.946 -0.258 2
1 392 . 1 1 A 35 35 ASP HA H 35 4.302 4.320 -0.018 2
1 395 . 1 1 A 35 35 ASP C C 35 177.507 178.485 -0.978 2
1 396 . 1 1 A 35 35 ASP CA C 35 58.196 57.637 0.559 2
1 397 . 1 1 A 35 35 ASP CB C 35 43.070 41.209 1.861 2
1 398 . 1 1 A 35 35 ASP N N 35 120.507 120.025 0.482 2
1 399 . 1 1 A 36 36 LEU H H 36 8.482 8.462 0.020 2
1 400 . 1 1 A 36 36 LEU HA H 36 3.328 3.730 -0.402 2
1 410 . 1 1 A 36 36 LEU C C 36 176.774 179.034 -2.260 2
1 411 . 1 1 A 36 36 LEU CA C 36 57.461 57.725 -0.264 2
1 412 . 1 1 A 36 36 LEU CB C 36 41.344 41.235 0.109 2
1 416 . 1 1 A 36 36 LEU N N 36 117.671 120.413 -2.742 2
1 417 . 1 1 A 37 37 MET H H 37 7.822 7.921 -0.099 2
1 418 . 1 1 A 37 37 MET HA H 37 4.401 4.043 0.358 2
1 425 . 1 1 A 37 37 MET C C 37 177.862 177.719 0.143 2
1 426 . 1 1 A 37 37 MET CA C 37 56.434 58.261 -1.827 2
1 427 . 1 1 A 37 37 MET CB C 37 31.573 32.423 -0.850 2
1 430 . 1 1 A 37 37 MET N N 37 112.952 117.484 -4.532 2
1 431 . 1 1 A 38 38 GLU H H 38 8.667 8.059 0.608 2
1 432 . 1 1 A 38 38 GLU HA H 38 4.457 4.238 0.219 2
1 436 . 1 1 A 38 38 GLU C C 38 176.582 177.278 -0.696 2
1 437 . 1 1 A 38 38 GLU CA C 38 57.659 57.538 0.121 2
1 438 . 1 1 A 38 38 GLU CB C 38 29.936 30.259 -0.323 2
1 440 . 1 1 A 38 38 GLU N N 38 116.463 117.864 -1.401 2
1 441 . 1 1 A 39 39 SER H H 39 7.657 8.197 -0.540 2
1 442 . 1 1 A 39 39 SER HA H 39 4.658 4.601 0.057 2
1 445 . 1 1 A 39 39 SER C C 39 175.661 175.972 -0.311 2
1 446 . 1 1 A 39 39 SER CA C 39 60.449 59.885 0.564 2
1 447 . 1 1 A 39 39 SER CB C 39 63.341 64.513 -1.172 2
1 448 . 1 1 A 39 39 SER N N 39 113.870 114.793 -0.923 2
1 449 . 1 1 A 40 40 LYS H H 40 8.165 7.829 0.336 2
1 450 . 1 1 A 40 40 LYS HA H 40 4.454 4.139 0.315 2
1 458 . 1 1 A 40 40 LYS C C 40 174.970 175.873 -0.903 2
1 459 . 1 1 A 40 40 LYS CA C 40 55.753 57.014 -1.261 2
1 460 . 1 1 A 40 40 LYS CB C 40 32.337 32.678 -0.341 2
1 464 . 1 1 A 40 40 LYS N N 40 116.671 120.570 -3.899 2
1 465 . 1 1 A 41 41 SER H H 41 7.017 7.858 -0.841 2
1 466 . 1 1 A 41 41 SER HA H 41 4.209 4.293 -0.084 2
1 469 . 1 1 A 41 41 SER C C 41 173.770 173.588 0.182 2
1 470 . 1 1 A 41 41 SER CA C 41 58.435 58.993 -0.558 2
1 471 . 1 1 A 41 41 SER CB C 41 61.700 61.386 0.314 2
1 472 . 1 1 A 41 41 SER N N 41 109.989 113.367 -3.377 2
1 473 . 1 1 A 42 42 TRP H H 42 8.876 8.038 0.838 2
1 474 . 1 1 A 42 42 TRP HA H 42 4.698 4.707 -0.009 2
1 478 . 1 1 A 42 42 TRP C C 42 174.477 177.404 -2.927 2
1 479 . 1 1 A 42 42 TRP CA C 42 59.443 57.475 1.968 2
1 480 . 1 1 A 42 42 TRP CB C 42 28.203 30.438 -2.235 2
1 481 . 1 1 A 42 42 TRP N N 42 121.116 122.822 -1.706 2
1 483 . 1 1 A 43 43 HIS H H 43 8.132 8.551 -0.419 2
1 484 . 1 1 A 43 43 HIS HA H 43 4.445 4.423 0.022 2
1 488 . 1 1 A 43 43 HIS C C 43 174.405 174.444 -0.039 2
1 489 . 1 1 A 43 43 HIS CA C 43 58.556 59.169 -0.613 2
1 490 . 1 1 A 43 43 HIS CB C 43 29.430 30.664 -1.234 2
1 491 . 1 1 A 43 43 HIS N N 43 119.397 121.921 -2.524 2
1 492 . 1 1 A 44 44 GLU H H 44 8.140 7.589 0.551 2
1 493 . 1 1 A 44 44 GLU HA H 44 4.432 4.650 -0.218 2
1 497 . 1 1 A 44 44 GLU C C 44 173.010 174.397 -1.387 2
1 498 . 1 1 A 44 44 GLU CA C 44 56.421 56.018 0.403 2
1 499 . 1 1 A 44 44 GLU CB C 44 33.285 33.234 0.051 2
1 501 . 1 1 A 44 44 GLU N N 44 116.181 117.926 -1.745 2
1 502 . 1 1 A 45 45 VAL H H 45 8.428 8.772 -0.344 2
1 503 . 1 1 A 45 45 VAL HA H 45 4.492 5.042 -0.550 2
1 511 . 1 1 A 45 45 VAL C C 45 172.339 174.611 -2.272 2
1 512 . 1 1 A 45 45 VAL CA C 45 63.071 60.941 2.130 2
1 513 . 1 1 A 45 45 VAL CB C 45 35.145 35.042 0.103 2
1 516 . 1 1 A 45 45 VAL N N 45 123.272 125.407 -2.135 2
1 517 . 1 1 A 46 46 ASN H H 46 9.050 8.986 0.064 2
1 518 . 1 1 A 46 46 ASN HA H 46 5.261 5.489 -0.228 2
1 523 . 1 1 A 46 46 ASN C C 46 172.845 173.737 -0.892 2
1 524 . 1 1 A 46 46 ASN CA C 46 51.895 51.706 0.189 2
1 525 . 1 1 A 46 46 ASN CB C 46 42.322 42.345 -0.023 2
1 526 . 1 1 A 46 46 ASN N N 46 123.901 124.386 -0.485 2
1 528 . 1 1 A 47 47 CYS H H 47 9.039 8.966 0.073 2
1 529 . 1 1 A 47 47 CYS HA H 47 5.160 5.344 -0.184 2
1 532 . 1 1 A 47 47 CYS C C 47 172.454 173.471 -1.017 2
1 533 . 1 1 A 47 47 CYS CA C 47 56.473 57.144 -0.671 2
1 534 . 1 1 A 47 47 CYS CB C 47 29.297 29.663 -0.366 2
1 535 . 1 1 A 47 47 CYS N N 47 119.663 119.279 0.384 2
1 536 . 1 1 A 48 48 VAL H H 48 9.083 9.048 0.035 2
1 537 . 1 1 A 48 48 VAL HA H 48 4.344 4.730 -0.386 2
1 542 . 1 1 A 48 48 VAL C C 48 173.307 174.872 -1.565 2
1 543 . 1 1 A 48 48 VAL CA C 48 61.368 60.745 0.623 2
1 544 . 1 1 A 48 48 VAL CB C 48 35.345 35.335 0.010 2
1 546 . 1 1 A 48 48 VAL N N 48 124.672 124.979 -0.307 2
1 547 . 1 1 A 49 49 GLY H H 49 9.019 9.057 -0.038 2
1 548 . 1 1 A 49 49 GLY HA2 H 49 3.460 4.176 -0.716 2
1 549 . 1 1 A 49 49 GLY HA3 H 49 4.539 4.179 0.360 2
1 550 . 1 1 A 49 49 GLY C C 49 171.278 172.250 -0.972 2
1 551 . 1 1 A 49 49 GLY CA C 49 45.075 44.535 0.540 2
1 552 . 1 1 A 49 49 GLY N N 49 113.131 115.567 -2.436 2
1 553 . 1 1 A 50 50 LEU H H 50 8.747 9.176 -0.429 2
1 554 . 1 1 A 50 50 LEU HA H 50 5.102 4.946 0.156 2
1 564 . 1 1 A 50 50 LEU CA C 50 51.417 51.313 0.104 2
1 565 . 1 1 A 50 50 LEU CB C 50 41.754 42.521 -0.767 2
1 569 . 1 1 A 50 50 LEU N N 50 124.471 126.606 -2.135 2
1 570 . 1 1 A 51 51 PRO HA H 51 4.106 4.289 -0.183 2
1 577 . 1 1 A 51 51 PRO C C 51 178.422 178.286 0.136 2
1 578 . 1 1 A 51 51 PRO CA C 51 65.680 64.855 0.825 2
1 579 . 1 1 A 51 51 PRO CB C 51 31.939 31.991 -0.052 2
1 582 . 1 1 A 52 52 GLU H H 52 9.721 8.469 1.252 2
1 583 . 1 1 A 52 52 GLU HA H 52 4.176 4.096 0.080 2
1 588 . 1 1 A 52 52 GLU C C 52 176.146 178.044 -1.898 2
1 589 . 1 1 A 52 52 GLU CA C 52 59.158 59.293 -0.135 2
1 590 . 1 1 A 52 52 GLU CB C 52 28.442 29.368 -0.926 2
1 592 . 1 1 A 52 52 GLU N N 52 118.552 117.771 0.781 2
1 593 . 1 1 A 53 53 LEU H H 53 7.089 7.771 -0.682 2
1 594 . 1 1 A 53 53 LEU HA H 53 4.511 4.340 0.171 2
1 603 . 1 1 A 53 53 LEU C C 53 174.027 176.384 -2.357 2
1 604 . 1 1 A 53 53 LEU CA C 53 53.825 54.821 -0.996 2
1 605 . 1 1 A 53 53 LEU CB C 53 43.825 42.445 1.380 2
1 608 . 1 1 A 53 53 LEU N N 53 116.763 118.370 -1.607 2
1 609 . 1 1 A 54 54 GLN H H 54 7.964 7.847 0.117 2
1 610 . 1 1 A 54 54 GLN HA H 54 3.591 3.893 -0.302 2
1 616 . 1 1 A 54 54 GLN C C 54 172.604 174.357 -1.753 2
1 617 . 1 1 A 54 54 GLN CA C 54 56.961 57.094 -0.133 2
1 618 . 1 1 A 54 54 GLN CB C 54 26.545 27.167 -0.622 2
1 620 . 1 1 A 54 54 GLN N N 54 115.489 117.933 -2.444 2
1 622 . 1 1 A 55 55 LEU H H 55 7.139 7.412 -0.273 2
1 623 . 1 1 A 55 55 LEU HA H 55 4.750 4.917 -0.167 2
1 629 . 1 1 A 55 55 LEU C C 55 173.475 175.389 -1.914 2
1 630 . 1 1 A 55 55 LEU CA C 55 53.698 52.988 0.710 2
1 631 . 1 1 A 55 55 LEU CB C 55 47.859 44.993 2.866 2
1 633 . 1 1 A 55 55 LEU N N 55 116.422 116.707 -0.285 2
1 634 . 1 1 A 56 56 ILE H H 56 8.223 8.652 -0.429 2
1 635 . 1 1 A 56 56 ILE HA H 56 4.540 5.159 -0.619 2
1 643 . 1 1 A 56 56 ILE C C 56 173.938 174.747 -0.809 2
1 644 . 1 1 A 56 56 ILE CA C 56 61.020 59.914 1.106 2
1 645 . 1 1 A 56 56 ILE CB C 56 39.403 40.439 -1.036 2
1 648 . 1 1 A 56 56 ILE N N 56 122.792 121.829 0.963 2
1 649 . 1 1 A 57 57 CYS H H 57 8.995 9.075 -0.080 2
1 650 . 1 1 A 57 57 CYS HA H 57 5.036 5.182 -0.146 2
1 653 . 1 1 A 57 57 CYS C C 57 170.483 173.022 -2.539 2
1 654 . 1 1 A 57 57 CYS CA C 57 56.484 57.439 -0.955 2
1 655 . 1 1 A 57 57 CYS CB C 57 30.545 31.302 -0.757 2
1 656 . 1 1 A 57 57 CYS N N 57 121.575 124.718 -3.143 2
1 657 . 1 1 A 58 58 LEU H H 58 9.076 8.801 0.275 2
1 658 . 1 1 A 58 58 LEU HA H 58 5.472 5.554 -0.082 2
1 668 . 1 1 A 58 58 LEU C C 58 174.009 175.868 -1.859 2
1 669 . 1 1 A 58 58 LEU CA C 58 52.851 53.691 -0.840 2
1 670 . 1 1 A 58 58 LEU CB C 58 42.177 43.170 -0.993 2
1 674 . 1 1 A 58 58 LEU N N 58 121.895 125.281 -3.386 2
1 675 . 1 1 A 59 59 VAL H H 59 8.966 8.656 0.310 2
1 676 . 1 1 A 59 59 VAL HA H 59 5.488 5.167 0.321 2
1 681 . 1 1 A 59 59 VAL C C 59 176.034 175.612 0.422 2
1 682 . 1 1 A 59 59 VAL CA C 59 59.820 60.790 -0.970 2
1 683 . 1 1 A 59 59 VAL CB C 59 34.786 34.814 -0.028 2
1 685 . 1 1 A 59 59 VAL N N 59 121.702 125.097 -3.395 2
1 686 . 1 1 A 60 60 GLY H H 60 9.258 8.543 0.715 2
1 687 . 1 1 A 60 60 GLY HA2 H 60 4.673 4.382 0.291 2
1 688 . 1 1 A 60 60 GLY HA3 H 60 4.804 4.476 0.328 2
1 689 . 1 1 A 60 60 GLY C C 60 169.831 172.401 -2.570 2
1 690 . 1 1 A 60 60 GLY CA C 60 46.399 45.644 0.755 2
1 691 . 1 1 A 60 60 GLY N N 60 114.126 113.399 0.727 2
1 692 . 1 1 A 61 61 THR H H 61 8.834 8.494 0.340 2
1 693 . 1 1 A 61 61 THR HA H 61 4.418 4.933 -0.515 2
1 698 . 1 1 A 61 61 THR C C 61 171.985 174.757 -2.772 2
1 699 . 1 1 A 61 61 THR CA C 61 60.634 60.823 -0.189 2
1 700 . 1 1 A 61 61 THR CB C 61 70.983 70.216 0.767 2
1 702 . 1 1 A 61 61 THR N N 61 114.856 113.122 1.734 2
1 703 . 1 1 A 62 62 GLU H H 62 8.502 8.598 -0.096 2
1 704 . 1 1 A 62 62 GLU HA H 62 2.867 3.535 -0.668 2
1 709 . 1 1 A 62 62 GLU C C 62 174.650 175.958 -1.308 2
1 710 . 1 1 A 62 62 GLU CA C 62 58.785 58.292 0.493 2
1 711 . 1 1 A 62 62 GLU CB C 62 28.981 29.316 -0.335 2
1 713 . 1 1 A 62 62 GLU N N 62 129.915 124.537 5.378 2
1 714 . 1 1 A 63 63 ILE H H 63 6.928 7.820 -0.892 2
1 715 . 1 1 A 63 63 ILE HA H 63 4.038 4.407 -0.369 2
1 725 . 1 1 A 63 63 ILE C C 63 173.482 174.898 -1.416 2
1 726 . 1 1 A 63 63 ILE CA C 63 58.664 60.167 -1.503 2
1 727 . 1 1 A 63 63 ILE CB C 63 40.009 40.718 -0.709 2
1 731 . 1 1 A 63 63 ILE N N 63 117.075 118.515 -1.440 2
1 732 . 1 1 A 64 64 GLU H H 64 8.585 8.386 0.199 2
1 733 . 1 1 A 64 64 GLU HA H 64 3.427 3.872 -0.445 2
1 738 . 1 1 A 64 64 GLU C C 64 175.186 177.015 -1.829 2
1 739 . 1 1 A 64 64 GLU CA C 64 58.703 57.786 0.917 2
1 740 . 1 1 A 64 64 GLU CB C 64 28.999 29.024 -0.025 2
1 742 . 1 1 A 64 64 GLU N N 64 126.422 127.224 -0.802 2
1 743 . 1 1 A 65 65 GLY H H 65 8.754 8.789 -0.034 2
1 744 . 1 1 A 65 65 GLY HA2 H 65 3.631 3.935 -0.304 2
1 745 . 1 1 A 65 65 GLY HA3 H 65 4.287 3.949 0.338 2
1 746 . 1 1 A 65 65 GLY C C 65 174.005 174.625 -0.620 2
1 747 . 1 1 A 65 65 GLY CA C 65 44.954 45.150 -0.196 2
1 748 . 1 1 A 65 65 GLY N N 65 114.614 113.915 0.699 2
1 749 . 1 1 A 66 66 GLU H H 66 7.760 7.796 -0.036 2
1 750 . 1 1 A 66 66 GLU HA H 66 4.462 4.574 -0.112 2
1 754 . 1 1 A 66 66 GLU C C 66 175.255 176.110 -0.855 2
1 755 . 1 1 A 66 66 GLU CA C 66 55.582 55.625 -0.043 2
1 756 . 1 1 A 66 66 GLU CB C 66 30.654 31.041 -0.387 2
1 758 . 1 1 A 66 66 GLU N N 66 119.292 120.495 -1.203 2
1 759 . 1 1 A 67 67 GLY H H 67 8.262 8.211 0.051 2
1 760 . 1 1 A 67 67 GLY HA2 H 67 3.875 4.036 -0.161 2
1 761 . 1 1 A 67 67 GLY HA3 H 67 4.088 4.057 0.031 2
1 762 . 1 1 A 67 67 GLY C C 67 172.197 173.787 -1.590 2
1 763 . 1 1 A 67 67 GLY CA C 67 44.845 45.691 -0.846 2
1 764 . 1 1 A 67 67 GLY N N 67 106.161 108.946 -2.785 2
1 765 . 1 1 A 68 68 LEU H H 68 8.142 8.067 0.075 2
1 766 . 1 1 A 68 68 LEU HA H 68 4.491 4.638 -0.147 2
1 775 . 1 1 A 68 68 LEU C C 68 176.194 175.616 0.578 2
1 776 . 1 1 A 68 68 LEU CA C 68 55.123 54.385 0.738 2
1 777 . 1 1 A 68 68 LEU CB C 68 44.527 43.278 1.249 2
1 780 . 1 1 A 68 68 LEU N N 68 120.269 121.910 -1.641 2
1 781 . 1 1 A 69 69 GLN H H 69 9.253 8.188 1.065 2
1 782 . 1 1 A 69 69 GLN HA H 69 4.770 4.839 -0.069 2
1 788 . 1 1 A 69 69 GLN C C 69 173.607 174.419 -0.812 2
1 789 . 1 1 A 69 69 GLN CA C 69 54.736 55.205 -0.469 2
1 790 . 1 1 A 69 69 GLN CB C 69 33.782 31.171 2.611 2
1 792 . 1 1 A 69 69 GLN N N 69 119.336 122.224 -2.888 2
1 794 . 1 1 A 70 70 THR H H 70 8.803 8.983 -0.180 2
1 795 . 1 1 A 70 70 THR HA H 70 5.033 5.135 -0.102 2
1 800 . 1 1 A 70 70 THR C C 70 172.596 173.912 -1.316 2
1 801 . 1 1 A 70 70 THR CA C 70 62.768 61.906 0.862 2
1 802 . 1 1 A 70 70 THR CB C 70 69.990 70.894 -0.904 2
1 804 . 1 1 A 70 70 THR N N 70 118.372 120.061 -1.689 2
1 805 . 1 1 A 71 71 VAL H H 71 9.882 9.369 0.513 2
1 806 . 1 1 A 71 71 VAL HA H 71 5.239 5.467 -0.228 2
1 811 . 1 1 A 71 71 VAL C C 71 174.015 174.800 -0.785 2
1 812 . 1 1 A 71 71 VAL CA C 71 60.577 60.180 0.397 2
1 813 . 1 1 A 71 71 VAL CB C 71 34.149 34.571 -0.422 2
1 815 . 1 1 A 71 71 VAL N N 71 129.063 122.656 6.407 2
1 816 . 1 1 A 72 72 VAL H H 72 9.491 8.737 0.754 2
1 817 . 1 1 A 72 72 VAL HA H 72 4.672 4.744 -0.072 2
1 825 . 1 1 A 72 72 VAL CA C 72 59.568 58.367 1.201 2
1 826 . 1 1 A 72 72 VAL CB C 72 34.057 34.759 -0.702 2
1 829 . 1 1 A 72 72 VAL N N 72 128.521 123.960 4.561 2
1 830 . 1 1 A 73 73 PRO HA H 73 5.368 4.551 0.817 2
1 836 . 1 1 A 73 73 PRO C C 73 175.079 176.035 -0.956 2
1 837 . 1 1 A 73 73 PRO CA C 73 61.324 63.002 -1.678 2
1 838 . 1 1 A 73 73 PRO CB C 73 33.089 32.043 1.046 2
1 841 . 1 1 A 74 74 THR H H 74 9.103 8.803 0.300 2
1 842 . 1 1 A 74 74 THR HA H 74 5.191 4.821 0.370 2
1 847 . 1 1 A 74 74 THR CA C 74 57.986 59.218 -1.232 2
1 848 . 1 1 A 74 74 THR CB C 74 72.212 72.162 0.050 2
1 850 . 1 1 A 74 74 THR N N 74 118.075 118.621 -0.546 2
1 851 . 1 1 A 75 75 PRO HA H 75 5.015 4.752 0.263 2
1 858 . 1 1 A 75 75 PRO C C 75 178.704 177.460 1.244 2
1 859 . 1 1 A 75 75 PRO CA C 75 63.038 62.361 0.677 2
1 860 . 1 1 A 75 75 PRO CB C 75 32.529 32.865 -0.336 2
1 863 . 1 1 A 76 76 ILE H H 76 8.221 8.405 -0.184 2
1 864 . 1 1 A 76 76 ILE HA H 76 4.218 3.885 0.333 2
1 873 . 1 1 A 76 76 ILE C C 76 172.375 177.083 -4.708 2
1 874 . 1 1 A 76 76 ILE CA C 76 63.509 63.669 -0.160 2
1 875 . 1 1 A 76 76 ILE CB C 76 39.322 37.917 1.405 2
1 879 . 1 1 A 76 76 ILE N N 76 122.273 122.657 -0.384 2
1 880 . 1 1 A 77 77 THR H H 77 6.984 7.651 -0.667 2
1 881 . 1 1 A 77 77 THR HA H 77 4.227 4.425 -0.198 2
1 886 . 1 1 A 77 77 THR C C 77 173.531 174.174 -0.643 2
1 887 . 1 1 A 77 77 THR CA C 77 61.435 62.309 -0.874 2
1 888 . 1 1 A 77 77 THR CB C 77 68.944 69.324 -0.380 2
1 890 . 1 1 A 77 77 THR N N 77 105.803 113.626 -7.823 2
1 891 . 1 1 A 78 78 ALA H H 78 7.647 7.453 0.194 2
1 892 . 1 1 A 78 78 ALA HA H 78 4.757 4.521 0.236 2
1 896 . 1 1 A 78 78 ALA C C 78 173.520 176.647 -3.127 2
1 897 . 1 1 A 78 78 ALA CA C 78 51.164 51.434 -0.270 2
1 898 . 1 1 A 78 78 ALA CB C 78 20.011 21.296 -1.285 2
1 899 . 1 1 A 78 78 ALA N N 78 126.635 124.239 2.396 2
1 900 . 1 1 A 79 79 SER H H 79 7.884 8.749 -0.865 2
1 901 . 1 1 A 79 79 SER HA H 79 4.386 5.308 -0.922 2
1 903 . 1 1 A 79 79 SER C C 79 176.077 172.728 3.349 2
1 904 . 1 1 A 79 79 SER CA C 79 57.465 56.413 1.052 2
1 905 . 1 1 A 79 79 SER CB C 79 65.285 65.483 -0.198 2
1 906 . 1 1 A 79 79 SER N N 79 115.272 112.999 2.273 2
1 907 . 1 1 A 80 80 LEU H H 80 7.700 8.824 -1.124 2
1 908 . 1 1 A 80 80 LEU HA H 80 4.912 4.960 -0.048 2
1 915 . 1 1 A 80 80 LEU C C 80 173.927 175.062 -1.135 2
1 916 . 1 1 A 80 80 LEU CA C 80 53.829 54.011 -0.182 2
1 917 . 1 1 A 80 80 LEU CB C 80 45.990 44.761 1.229 2
1 920 . 1 1 A 80 80 LEU N N 80 121.507 126.545 -5.038 2
1 921 . 1 1 A 81 81 SER H H 81 7.885 8.737 -0.852 2
1 922 . 1 1 A 81 81 SER HA H 81 5.269 4.904 0.365 2
1 925 . 1 1 A 81 81 SER C C 81 175.756 174.864 0.892 2
1 926 . 1 1 A 81 81 SER CA C 81 55.507 57.113 -1.606 2
1 927 . 1 1 A 81 81 SER CB C 81 65.966 65.915 0.051 2
1 928 . 1 1 A 81 81 SER N N 81 118.323 118.137 0.186 2
1 929 . 1 1 A 82 82 HIS H H 82 8.935 8.912 0.023 2
1 930 . 1 1 A 82 82 HIS HA H 82 4.407 4.372 0.036 2
1 932 . 1 1 A 82 82 HIS C C 82 176.550 176.980 -0.430 2
1 933 . 1 1 A 82 82 HIS CA C 82 60.960 59.093 1.867 2
1 934 . 1 1 A 82 82 HIS CB C 82 30.755 29.435 1.320 2
1 935 . 1 1 A 82 82 HIS N N 82 124.042 120.923 3.119 2
1 936 . 1 1 A 83 83 ASN H H 83 8.435 8.162 0.273 2
1 937 . 1 1 A 83 83 ASN HA H 83 4.439 4.263 0.176 2
1 941 . 1 1 A 83 83 ASN C C 83 174.769 177.739 -2.970 2
1 942 . 1 1 A 83 83 ASN CA C 83 56.575 56.422 0.153 2
1 943 . 1 1 A 83 83 ASN CB C 83 38.731 38.640 0.091 2
1 944 . 1 1 A 83 83 ASN N N 83 118.543 119.436 -0.893 2
1 946 . 1 1 A 84 84 ARG H H 84 7.716 8.031 -0.315 2
1 947 . 1 1 A 84 84 ARG HA H 84 4.183 4.181 0.002 2
1 953 . 1 1 A 84 84 ARG C C 84 177.399 178.631 -1.232 2
1 954 . 1 1 A 84 84 ARG CA C 84 59.045 58.842 0.203 2
1 955 . 1 1 A 84 84 ARG CB C 84 29.992 29.891 0.101 2
1 957 . 1 1 A 84 84 ARG N N 84 121.312 119.521 1.791 2
1 958 . 1 1 A 85 85 ILE H H 85 8.354 8.030 0.324 2
1 959 . 1 1 A 85 85 ILE HA H 85 3.650 4.013 -0.362 2
1 967 . 1 1 A 85 85 ILE C C 85 176.098 178.005 -1.907 2
1 968 . 1 1 A 85 85 ILE CA C 85 66.704 64.626 2.078 2
1 969 . 1 1 A 85 85 ILE CB C 85 38.017 37.763 0.254 2
1 972 . 1 1 A 85 85 ILE N N 85 119.321 119.423 -0.102 2
1 973 . 1 1 A 86 86 ARG H H 86 7.690 8.060 -0.370 2
1 974 . 1 1 A 86 86 ARG HA H 86 3.704 3.948 -0.244 2
1 981 . 1 1 A 86 86 ARG C C 86 177.524 178.722 -1.198 2
1 982 . 1 1 A 86 86 ARG CA C 86 59.881 59.668 0.213 2
1 983 . 1 1 A 86 86 ARG CB C 86 29.248 29.869 -0.621 2
1 986 . 1 1 A 86 86 ARG N N 86 118.362 121.273 -2.911 2
1 987 . 1 1 A 87 87 GLU H H 87 7.884 7.830 0.054 2
1 988 . 1 1 A 87 87 GLU HA H 87 4.064 4.089 -0.025 2
1 993 . 1 1 A 87 87 GLU C C 87 178.785 179.246 -0.461 2
1 994 . 1 1 A 87 87 GLU CA C 87 58.999 59.005 -0.006 2
1 995 . 1 1 A 87 87 GLU CB C 87 29.872 29.599 0.273 2
1 997 . 1 1 A 87 87 GLU N N 87 118.124 118.751 -0.627 2
1 998 . 1 1 A 88 88 ILE H H 88 8.715 7.954 0.761 2
1 999 . 1 1 A 88 88 ILE HA H 88 3.305 3.518 -0.213 2
1 1009 . 1 1 A 88 88 ILE C C 88 177.261 178.135 -0.874 2
1 1010 . 1 1 A 88 88 ILE CA C 88 65.822 65.300 0.522 2
1 1011 . 1 1 A 88 88 ILE CB C 88 37.370 37.314 0.056 2
1 1015 . 1 1 A 88 88 ILE N N 88 122.929 120.921 2.008 2
1 1016 . 1 1 A 89 89 LEU H H 89 8.486 8.646 -0.160 2
1 1017 . 1 1 A 89 89 LEU HA H 89 3.932 3.905 0.027 2
1 1023 . 1 1 A 89 89 LEU C C 89 177.919 179.112 -1.193 2
1 1024 . 1 1 A 89 89 LEU CA C 89 59.060 58.159 0.901 2
1 1025 . 1 1 A 89 89 LEU CB C 89 41.129 41.695 -0.566 2
1 1028 . 1 1 A 89 89 LEU N N 89 122.696 120.366 2.330 2
1 1029 . 1 1 A 90 90 LYS H H 90 7.790 7.952 -0.162 2
1 1030 . 1 1 A 90 90 LYS HA H 90 4.061 3.941 0.120 2
1 1035 . 1 1 A 90 90 LYS C C 90 178.432 178.660 -0.228 2
1 1036 . 1 1 A 90 90 LYS CA C 90 59.840 59.230 0.610 2
1 1037 . 1 1 A 90 90 LYS CB C 90 32.582 32.238 0.344 2
1 1039 . 1 1 A 90 90 LYS N N 90 118.640 119.586 -0.946 2
1 1040 . 1 1 A 91 91 ALA H H 91 8.113 8.093 0.020 2
1 1041 . 1 1 A 91 91 ALA HA H 91 4.151 4.089 0.062 2
1 1045 . 1 1 A 91 91 ALA C C 91 179.147 179.794 -0.647 2
1 1046 . 1 1 A 91 91 ALA CA C 91 54.942 55.264 -0.322 2
1 1047 . 1 1 A 91 91 ALA CB C 91 18.242 18.500 -0.258 2
1 1048 . 1 1 A 91 91 ALA N N 91 122.939 121.928 1.011 2
1 1049 . 1 1 A 92 92 SER H H 92 8.858 8.458 0.400 2
1 1050 . 1 1 A 92 92 SER HA H 92 4.898 4.179 0.719 2
1 1052 . 1 1 A 92 92 SER C C 92 172.440 176.800 -4.360 2
1 1053 . 1 1 A 92 92 SER CA C 92 61.913 61.263 0.650 2
1 1054 . 1 1 A 92 92 SER CB C 92 63.081 62.800 0.281 2
1 1055 . 1 1 A 92 92 SER N N 92 114.526 113.143 1.383 2
1 1056 . 1 1 A 93 93 ARG H H 93 7.704 8.299 -0.595 2
1 1057 . 1 1 A 93 93 ARG HA H 93 4.162 4.129 0.033 2
1 1059 . 1 1 A 93 93 ARG C C 93 177.757 178.649 -0.892 2
1 1060 . 1 1 A 93 93 ARG CA C 93 59.544 58.758 0.786 2
1 1061 . 1 1 A 93 93 ARG CB C 93 30.343 29.713 0.630 2
1 1062 . 1 1 A 93 93 ARG N N 93 121.505 121.239 0.266 2
1 1063 . 1 1 A 94 94 LYS H H 94 7.456 7.707 -0.251 2
1 1064 . 1 1 A 94 94 LYS HA H 94 4.174 4.143 0.031 2
1 1071 . 1 1 A 94 94 LYS C C 94 178.861 178.830 0.031 2
1 1072 . 1 1 A 94 94 LYS CA C 94 59.030 59.078 -0.048 2
1 1073 . 1 1 A 94 94 LYS CB C 94 32.239 32.018 0.221 2
1 1077 . 1 1 A 94 94 LYS N N 94 119.072 119.616 -0.544 2
1 1078 . 1 1 A 95 95 LEU H H 95 8.148 7.788 0.360 2
1 1079 . 1 1 A 95 95 LEU HA H 95 4.129 4.129 -0.000 2
1 1088 . 1 1 A 95 95 LEU C C 95 177.274 178.451 -1.177 2
1 1089 . 1 1 A 95 95 LEU CA C 95 57.136 57.043 0.093 2
1 1090 . 1 1 A 95 95 LEU CB C 95 41.908 41.879 0.029 2
1 1093 . 1 1 A 95 95 LEU N N 95 119.717 119.888 -0.171 2
1 1094 . 1 1 A 96 96 GLN H H 96 7.807 7.981 -0.174 2
1 1095 . 1 1 A 96 96 GLN HA H 96 4.242 4.350 -0.108 2
1 1102 . 1 1 A 96 96 GLN C C 96 175.371 176.315 -0.944 2
1 1103 . 1 1 A 96 96 GLN CA C 96 56.397 55.748 0.649 2
1 1104 . 1 1 A 96 96 GLN CB C 96 29.123 29.260 -0.137 2
1 1106 . 1 1 A 96 96 GLN N N 96 114.581 116.299 -1.718 2
1 1108 . 1 1 A 97 97 GLY H H 97 7.802 8.123 -0.321 2
1 1109 . 1 1 A 97 97 GLY HA2 H 97 3.839 3.958 -0.119 2
1 1110 . 1 1 A 97 97 GLY HA3 H 97 4.096 3.958 0.138 2
1 1111 . 1 1 A 97 97 GLY C C 97 172.636 173.670 -1.034 2
1 1112 . 1 1 A 97 97 GLY CA C 97 46.372 46.115 0.257 2
1 1113 . 1 1 A 97 97 GLY N N 97 106.959 108.703 -1.744 2
1 1114 . 1 1 A 98 98 ASP H H 98 8.156 7.989 0.167 2
1 1115 . 1 1 A 98 98 ASP HA H 98 4.754 4.983 -0.229 2
1 1118 . 1 1 A 98 98 ASP CA C 98 52.882 51.062 1.820 2
1 1119 . 1 1 A 98 98 ASP CB C 98 41.603 42.133 -0.530 2
1 1120 . 1 1 A 98 98 ASP N N 98 118.447 120.751 -2.304 2
1 1121 . 1 1 A 99 99 PRO HA H 99 4.470 4.483 -0.013 2
1 1126 . 1 1 A 99 99 PRO C C 99 175.500 176.669 -1.169 2
1 1127 . 1 1 A 99 99 PRO CA C 99 63.601 64.149 -0.548 2
1 1128 . 1 1 A 99 99 PRO CB C 99 32.423 32.019 0.404 2
1 1130 . 1 1 A 100 100 ASP H H 100 8.527 8.221 0.306 2
1 1131 . 1 1 A 100 100 ASP HA H 100 4.778 4.770 0.008 2
1 1134 . 1 1 A 100 100 ASP C C 100 174.931 175.334 -0.403 2
1 1135 . 1 1 A 100 100 ASP CA C 100 53.915 53.805 0.110 2
1 1136 . 1 1 A 100 100 ASP CB C 100 40.665 41.413 -0.748 2
1 1137 . 1 1 A 100 100 ASP N N 100 119.340 117.380 1.960 2
1 1138 . 1 1 A 101 101 LEU H H 101 7.379 7.823 -0.444 2
1 1139 . 1 1 A 101 101 LEU HA H 101 4.682 4.590 0.092 2
1 1148 . 1 1 A 101 101 LEU CA C 101 52.956 52.538 0.418 2
1 1149 . 1 1 A 101 101 LEU CB C 101 43.393 42.730 0.663 2
1 1152 . 1 1 A 101 101 LEU N N 101 122.107 121.761 0.346 2
1 1153 . 1 1 A 102 102 PRO HA H 102 4.487 4.663 -0.176 2
1 1158 . 1 1 A 102 102 PRO C C 102 175.697 175.794 -0.097 2
1 1159 . 1 1 A 102 102 PRO CA C 102 63.113 62.861 0.252 2
1 1160 . 1 1 A 102 102 PRO CB C 102 32.138 31.860 0.278 2
1 1163 . 1 1 A 103 103 MET H H 103 9.011 8.748 0.263 2
1 1164 . 1 1 A 103 103 MET HA H 103 4.769 4.971 -0.202 2
1 1171 . 1 1 A 103 103 MET C C 103 174.080 174.440 -0.360 2
1 1172 . 1 1 A 103 103 MET CA C 103 54.737 53.782 0.955 2
1 1173 . 1 1 A 103 103 MET CB C 103 34.857 35.088 -0.231 2
1 1176 . 1 1 A 103 103 MET N N 103 123.334 122.486 0.849 2
1 1177 . 1 1 A 104 104 SER H H 104 8.239 8.701 -0.463 2
1 1178 . 1 1 A 104 104 SER HA H 104 5.079 5.176 -0.097 2
1 1181 . 1 1 A 104 104 SER C C 104 171.795 172.785 -0.990 2
1 1182 . 1 1 A 104 104 SER CA C 104 57.641 56.950 0.691 2
1 1183 . 1 1 A 104 104 SER CB C 104 66.282 66.403 -0.122 2
1 1184 . 1 1 A 104 104 SER N N 104 114.434 115.654 -1.220 2
1 1185 . 1 1 A 105 105 PHE H H 105 9.003 8.379 0.624 2
1 1186 . 1 1 A 105 105 PHE HA H 105 5.209 5.365 -0.156 2
1 1193 . 1 1 A 105 105 PHE C C 105 170.688 172.191 -1.503 2
1 1194 . 1 1 A 105 105 PHE CA C 105 56.917 55.897 1.021 2
1 1195 . 1 1 A 105 105 PHE CB C 105 41.350 41.745 -0.395 2
1 1196 . 1 1 A 105 105 PHE N N 105 116.224 118.377 -2.153 2
1 1197 . 1 1 A 106 106 THR H H 106 9.074 9.020 0.054 2
1 1198 . 1 1 A 106 106 THR HA H 106 4.664 4.869 -0.205 2
1 1203 . 1 1 A 106 106 THR C C 106 171.767 174.471 -2.704 2
1 1204 . 1 1 A 106 106 THR CA C 106 62.162 61.973 0.189 2
1 1205 . 1 1 A 106 106 THR CB C 106 70.072 70.040 0.032 2
1 1207 . 1 1 A 106 106 THR N N 106 117.469 116.319 1.150 2
1 1208 . 1 1 A 107 107 LEU H H 107 9.804 9.253 0.551 2
1 1209 . 1 1 A 107 107 LEU HA H 107 4.750 4.790 -0.040 2
1 1219 . 1 1 A 107 107 LEU C C 107 172.742 176.004 -3.262 2
1 1220 . 1 1 A 107 107 LEU CA C 107 54.151 54.665 -0.514 2
1 1221 . 1 1 A 107 107 LEU CB C 107 44.486 42.618 1.868 2
1 1224 . 1 1 A 107 107 LEU N N 107 133.400 128.476 4.924 2
1 1225 . 1 1 A 108 108 ALA H H 108 8.435 8.812 -0.377 2
1 1226 . 1 1 A 108 108 ALA HA H 108 4.683 4.603 0.080 2
1 1230 . 1 1 A 108 108 ALA C C 108 173.052 175.689 -2.637 2
1 1231 . 1 1 A 108 108 ALA CA C 108 49.308 50.566 -1.259 2
1 1232 . 1 1 A 108 108 ALA CB C 108 22.120 20.043 2.078 2
1 1233 . 1 1 A 108 108 ALA N N 108 131.422 127.146 4.276 2
1 1234 . 1 1 A 109 109 ILE H H 109 8.909 9.091 -0.182 2
1 1235 . 1 1 A 109 109 ILE HA H 109 4.063 5.123 -1.060 2
1 1245 . 1 1 A 109 109 ILE CA C 109 60.982 60.266 0.716 2
1 1246 . 1 1 A 109 109 ILE CB C 109 39.074 38.329 0.745 2
1 1250 . 1 1 A 109 109 ILE N N 109 124.415 123.885 0.529 2
1 1251 . 1 1 A 110 110 VAL H H 110 8.706 9.035 -0.329 2
1 1252 . 1 1 A 110 110 VAL HA H 110 4.324 5.140 -0.816 2
1 1260 . 1 1 A 110 110 VAL C C 110 175.700 174.333 1.367 2
1 1261 . 1 1 A 110 110 VAL CA C 110 62.316 59.908 2.408 2
1 1262 . 1 1 A 110 110 VAL CB C 110 31.876 34.249 -2.373 2
1 1264 . 1 1 A 110 110 VAL N N 110 127.457 125.358 2.099 2
1 1265 . 1 1 A 111 111 GLU H H 111 9.024 8.875 0.149 2
1 1266 . 1 1 A 111 111 GLU HA H 111 4.403 4.452 -0.049 2
1 1269 . 1 1 A 111 111 GLU C C 111 175.987 177.291 -1.304 2
1 1270 . 1 1 A 111 111 GLU CA C 111 56.842 56.185 0.657 2
1 1271 . 1 1 A 111 111 GLU CB C 111 31.044 31.482 -0.438 2
1 1272 . 1 1 A 111 111 GLU N N 111 129.768 127.810 1.958 2
1 1273 . 1 1 A 112 112 SER H H 112 9.143 8.844 0.299 2
1 1274 . 1 1 A 112 112 SER HA H 112 4.394 4.247 0.147 2
1 1276 . 1 1 A 112 112 SER C C 112 173.187 175.136 -1.949 2
1 1277 . 1 1 A 112 112 SER CA C 112 60.180 60.774 -0.594 2
1 1278 . 1 1 A 112 112 SER CB C 112 63.415 62.675 0.740 2
1 1279 . 1 1 A 112 112 SER N N 112 115.956 119.722 -3.766 2
1 1280 . 1 1 A 113 113 ASP H H 113 8.133 8.074 0.059 2
1 1281 . 1 1 A 113 113 ASP HA H 113 4.573 4.625 -0.052 2
1 1284 . 1 1 A 113 113 ASP C C 113 175.430 176.056 -0.626 2
1 1285 . 1 1 A 113 113 ASP CA C 113 54.115 55.484 -1.369 2
1 1286 . 1 1 A 113 113 ASP CB C 113 40.011 41.409 -1.398 2
1 1287 . 1 1 A 113 113 ASP N N 113 118.343 120.718 -2.375 2
1 1288 . 1 1 A 114 114 SER H H 114 8.034 7.904 0.130 2
1 1289 . 1 1 A 114 114 SER HA H 114 4.057 4.504 -0.447 2
1 1291 . 1 1 A 114 114 SER C C 114 172.209 173.691 -1.482 2
1 1292 . 1 1 A 114 114 SER CA C 114 60.179 58.805 1.374 2
1 1293 . 1 1 A 114 114 SER CB C 114 62.702 64.113 -1.411 2
1 1294 . 1 1 A 114 114 SER N N 114 109.836 111.969 -2.133 2
1 1295 . 1 1 A 115 115 THR H H 115 7.711 7.732 -0.021 2
1 1296 . 1 1 A 115 115 THR HA H 115 4.250 4.347 -0.097 2
1 1300 . 1 1 A 115 115 THR C C 115 171.500 173.842 -2.342 2
1 1301 . 1 1 A 115 115 THR CA C 115 63.547 62.546 1.001 2
1 1302 . 1 1 A 115 115 THR CB C 115 69.595 69.490 0.105 2
1 1303 . 1 1 A 115 115 THR N N 115 117.407 115.299 2.108 2
1 1304 . 1 1 A 116 116 ILE H H 116 8.219 9.032 -0.813 2
1 1305 . 1 1 A 116 116 ILE HA H 116 4.769 4.935 -0.166 2
1 1315 . 1 1 A 116 116 ILE C C 116 174.434 174.939 -0.505 2
1 1316 . 1 1 A 116 116 ILE CA C 116 60.306 59.730 0.576 2
1 1317 . 1 1 A 116 116 ILE CB C 116 40.686 38.697 1.990 2
1 1321 . 1 1 A 116 116 ILE N N 116 125.480 128.339 -2.859 2
1 1322 . 1 1 A 117 117 VAL H H 117 8.695 9.433 -0.738 2
1 1323 . 1 1 A 117 117 VAL HA H 117 4.315 4.640 -0.325 2
1 1328 . 1 1 A 117 117 VAL C C 117 172.243 174.478 -2.235 2
1 1329 . 1 1 A 117 117 VAL CA C 117 60.621 60.915 -0.294 2
1 1330 . 1 1 A 117 117 VAL CB C 117 34.558 33.797 0.761 2
1 1332 . 1 1 A 117 117 VAL N N 117 127.887 127.383 0.504 2
1 1333 . 1 1 A 118 118 TYR H H 118 8.270 8.848 -0.578 2
1 1334 . 1 1 A 118 118 TYR HA H 118 5.327 5.336 -0.009 2
1 1342 . 1 1 A 118 118 TYR C C 118 174.250 174.851 -0.601 2
1 1343 . 1 1 A 118 118 TYR CA C 118 57.283 57.219 0.064 2
1 1344 . 1 1 A 118 118 TYR CB C 118 39.262 39.623 -0.361 2
1 1345 . 1 1 A 118 118 TYR N N 118 124.822 126.975 -2.153 2
1 1346 . 1 1 A 119 119 TYR H H 119 9.207 9.139 0.068 2
1 1347 . 1 1 A 119 119 TYR HA H 119 4.821 5.274 -0.453 2
1 1354 . 1 1 A 119 119 TYR C C 119 171.994 173.624 -1.630 2
1 1355 . 1 1 A 119 119 TYR CA C 119 58.116 56.983 1.133 2
1 1356 . 1 1 A 119 119 TYR CB C 119 43.544 42.054 1.490 2
1 1357 . 1 1 A 119 119 TYR N N 119 125.153 124.270 0.883 2
1 1358 . 1 1 A 120 120 LYS H H 120 7.700 8.498 -0.798 2
1 1359 . 1 1 A 120 120 LYS HA H 120 4.558 4.621 -0.063 2
1 1366 . 1 1 A 120 120 LYS C C 120 172.017 174.940 -2.922 2
1 1367 . 1 1 A 120 120 LYS CA C 120 57.217 55.725 1.492 2
1 1368 . 1 1 A 120 120 LYS CB C 120 33.914 33.542 0.372 2
1 1372 . 1 1 A 120 120 LYS N N 120 129.442 128.525 0.917 2
1 1373 . 1 1 A 121 121 LEU H H 121 8.112 8.491 -0.379 2
1 1374 . 1 1 A 121 121 LEU HA H 121 5.323 4.989 0.334 2
1 1384 . 1 1 A 121 121 LEU C C 121 175.733 174.572 1.161 2
1 1385 . 1 1 A 121 121 LEU CA C 121 52.716 53.116 -0.400 2
1 1386 . 1 1 A 121 121 LEU CB C 121 44.098 45.188 -1.090 2
1 1389 . 1 1 A 121 121 LEU N N 121 123.403 127.041 -3.638 2
1 1390 . 1 1 A 122 122 THR H H 122 8.338 8.927 -0.589 2
1 1391 . 1 1 A 122 122 THR HA H 122 5.097 4.923 0.174 2
1 1396 . 1 1 A 122 122 THR C C 122 173.221 172.602 0.619 2
1 1397 . 1 1 A 122 122 THR CA C 122 60.306 60.625 -0.319 2
1 1398 . 1 1 A 122 122 THR CB C 122 72.473 71.763 0.710 2
1 1400 . 1 1 A 122 122 THR N N 122 109.081 120.115 -11.034 2
stop_
save_