data_15581_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 15581
_Entry.PDB_ID 2KGF
_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 50
_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 6 . 1 1 1 A 2 2 VAL H H 2 8.992 8.863 0.129 1
1 7 . 1 1 1 A 2 2 VAL HA H 2 5.370 4.985 0.385 1
1 15 . 1 1 1 A 2 2 VAL C C 2 174.325 174.362 -0.037 1
1 16 . 1 1 1 A 2 2 VAL CA C 2 61.267 60.429 0.838 1
1 17 . 1 1 1 A 2 2 VAL CB C 2 33.890 34.452 -0.562 1
1 20 . 1 1 1 A 2 2 VAL N N 2 126.939 120.649 6.290 1
1 21 . 1 1 1 A 3 3 THR H H 3 8.912 8.768 0.144 1
1 22 . 1 1 1 A 3 3 THR HA H 3 4.505 5.364 -0.859 1
1 27 . 1 1 1 A 3 3 THR C C 3 172.710 173.346 -0.636 1
1 28 . 1 1 1 A 3 3 THR CA C 3 59.689 59.970 -0.281 1
1 29 . 1 1 1 A 3 3 THR CB C 3 72.398 71.495 0.903 1
1 31 . 1 1 1 A 3 3 THR N N 3 118.091 123.159 -5.068 1
1 32 . 1 1 1 A 4 4 GLU H H 4 8.631 8.943 -0.312 1
1 33 . 1 1 1 A 4 4 GLU HA H 4 5.788 4.835 0.953 1
1 38 . 1 1 1 A 4 4 GLU C C 4 175.758 174.568 1.190 1
1 39 . 1 1 1 A 4 4 GLU CA C 4 54.902 55.027 -0.125 1
1 40 . 1 1 1 A 4 4 GLU CB C 4 35.097 31.347 3.750 1
1 42 . 1 1 1 A 4 4 GLU N N 4 120.966 126.252 -5.286 1
1 43 . 1 1 1 A 5 5 THR H H 5 9.188 8.874 0.314 1
1 44 . 1 1 1 A 5 5 THR HA H 5 4.739 4.920 -0.181 1
1 49 . 1 1 1 A 5 5 THR C C 5 172.757 172.459 0.298 1
1 50 . 1 1 1 A 5 5 THR CA C 5 60.382 59.763 0.619 1
1 51 . 1 1 1 A 5 5 THR CB C 5 71.558 70.982 0.576 1
1 53 . 1 1 1 A 5 5 THR N N 5 119.366 115.282 4.084 1
1 54 . 1 1 1 A 6 6 VAL H H 6 8.476 8.919 -0.443 1
1 55 . 1 1 1 A 6 6 VAL HA H 6 5.026 5.330 -0.304 1
1 63 . 1 1 1 A 6 6 VAL C C 6 176.674 173.886 2.788 1
1 64 . 1 1 1 A 6 6 VAL CA C 6 61.008 59.142 1.866 1
1 65 . 1 1 1 A 6 6 VAL CB C 6 33.861 34.444 -0.583 1
1 68 . 1 1 1 A 6 6 VAL N N 6 121.384 122.036 -0.652 1
1 69 . 1 1 1 A 7 7 ASP H H 7 8.848 9.195 -0.347 1
1 70 . 1 1 1 A 7 7 ASP HA H 7 4.797 5.099 -0.302 1
1 73 . 1 1 1 A 7 7 ASP CA C 7 52.834 54.025 -1.191 1
1 74 . 1 1 1 A 7 7 ASP CB C 7 42.219 42.640 -0.421 1
1 75 . 1 1 1 A 7 7 ASP N N 7 127.061 125.078 1.983 1
1 76 . 1 1 1 A 8 8 GLY C C 8 175.143 174.711 0.432 1
1 77 . 1 1 1 A 8 8 GLY CA C 8 46.553 46.832 -0.279 1
1 78 . 1 1 1 A 9 9 GLN H H 9 8.408 7.894 0.514 1
1 79 . 1 1 1 A 9 9 GLN HA H 9 4.541 4.230 0.311 1
1 86 . 1 1 1 A 9 9 GLN C C 9 176.463 176.531 -0.068 1
1 87 . 1 1 1 A 9 9 GLN CA C 9 55.167 55.293 -0.126 1
1 88 . 1 1 1 A 9 9 GLN CB C 9 29.376 28.067 1.309 1
1 90 . 1 1 1 A 9 9 GLN N N 9 118.300 116.999 1.301 1
1 92 . 1 1 1 A 10 10 GLY H H 10 8.162 8.313 -0.151 1
1 93 . 1 1 1 A 10 10 GLY HA2 H 10 4.174 3.919 0.255 1
1 94 . 1 1 1 A 10 10 GLY HA3 H 10 3.521 3.929 -0.408 1
1 95 . 1 1 1 A 10 10 GLY C C 10 174.092 174.502 -0.410 1
1 96 . 1 1 1 A 10 10 GLY CA C 10 45.558 45.421 0.137 1
1 97 . 1 1 1 A 10 10 GLY N N 10 108.747 109.362 -0.615 1
1 98 . 1 1 1 A 11 11 GLN H H 11 8.507 7.885 0.622 1
1 99 . 1 1 1 A 11 11 GLN HA H 11 4.202 4.455 -0.253 1
1 106 . 1 1 1 A 11 11 GLN C C 11 173.992 174.881 -0.889 1
1 107 . 1 1 1 A 11 11 GLN CA C 11 55.098 55.710 -0.612 1
1 108 . 1 1 1 A 11 11 GLN CB C 11 29.097 29.687 -0.590 1
1 110 . 1 1 1 A 11 11 GLN N N 11 122.979 120.722 2.257 1
1 112 . 1 1 1 A 12 12 ALA H H 12 8.259 8.787 -0.528 1
1 113 . 1 1 1 A 12 12 ALA HA H 12 5.156 5.700 -0.544 1
1 117 . 1 1 1 A 12 12 ALA C C 12 177.284 176.589 0.695 1
1 118 . 1 1 1 A 12 12 ALA CA C 12 51.087 50.399 0.688 1
1 119 . 1 1 1 A 12 12 ALA CB C 12 20.500 22.270 -1.770 1
1 120 . 1 1 1 A 12 12 ALA N N 12 127.100 124.817 2.283 1
1 121 . 1 1 1 A 13 13 TRP H H 13 9.245 8.915 0.330 1
1 122 . 1 1 1 A 13 13 TRP HA H 13 4.717 5.443 -0.726 1
1 131 . 1 1 1 A 13 13 TRP C C 13 175.108 173.841 1.267 1
1 132 . 1 1 1 A 13 13 TRP CA C 13 55.966 55.354 0.612 1
1 133 . 1 1 1 A 13 13 TRP CB C 13 31.912 32.311 -0.399 1
1 139 . 1 1 1 A 13 13 TRP N N 13 123.088 118.310 4.778 1
1 141 . 1 1 1 A 14 14 ARG H H 14 8.575 8.989 -0.414 1
1 142 . 1 1 1 A 14 14 ARG HA H 14 5.335 4.855 0.480 1
1 150 . 1 1 1 A 14 14 ARG C C 14 175.191 173.514 1.677 1
1 151 . 1 1 1 A 14 14 ARG CA C 14 53.106 55.417 -2.311 1
1 152 . 1 1 1 A 14 14 ARG CB C 14 32.749 33.672 -0.923 1
1 154 . 1 1 1 A 14 14 ARG N N 14 121.163 118.259 2.904 1
1 156 . 1 1 1 A 15 15 HIS H H 15 8.595 8.518 0.077 1
1 157 . 1 1 1 A 15 15 HIS HA H 15 4.790 4.762 0.028 1
1 161 . 1 1 1 A 15 15 HIS C C 15 173.770 174.381 -0.611 1
1 162 . 1 1 1 A 15 15 HIS CA C 15 55.289 54.730 0.559 1
1 163 . 1 1 1 A 15 15 HIS CB C 15 33.208 33.394 -0.186 1
1 165 . 1 1 1 A 15 15 HIS N N 15 117.643 116.458 1.185 1
1 166 . 1 1 1 A 16 16 HIS H H 16 8.993 8.843 0.150 1
1 167 . 1 1 1 A 16 16 HIS HA H 16 5.158 4.737 0.421 1
1 171 . 1 1 1 A 16 16 HIS C C 16 173.608 174.892 -1.284 1
1 172 . 1 1 1 A 16 16 HIS CA C 16 56.450 56.668 -0.218 1
1 173 . 1 1 1 A 16 16 HIS CB C 16 34.171 30.402 3.769 1
1 175 . 1 1 1 A 16 16 HIS N N 16 123.520 120.056 3.464 1
1 176 . 1 1 1 A 17 17 ASN H H 17 7.829 9.364 -1.535 1
1 177 . 1 1 1 A 17 17 ASN HA H 17 4.713 5.331 -0.618 1
1 182 . 1 1 1 A 17 17 ASN C C 17 173.682 174.304 -0.622 1
1 183 . 1 1 1 A 17 17 ASN CA C 17 51.822 51.237 0.585 1
1 184 . 1 1 1 A 17 17 ASN CB C 17 43.176 42.082 1.094 1
1 185 . 1 1 1 A 17 17 ASN N N 17 122.213 120.297 1.916 1
1 187 . 1 1 1 A 18 18 GLY H H 18 8.423 8.571 -0.148 1
1 188 . 1 1 1 A 18 18 GLY HA2 H 18 3.931 3.727 0.204 1
1 189 . 1 1 1 A 18 18 GLY HA3 H 18 3.707 3.967 -0.260 1
1 190 . 1 1 1 A 18 18 GLY C C 18 173.985 173.104 0.881 1
1 191 . 1 1 1 A 18 18 GLY CA C 18 43.949 45.216 -1.267 1
1 192 . 1 1 1 A 18 18 GLY N N 18 106.991 111.356 -4.365 1
1 193 . 1 1 1 A 19 19 PHE H H 19 8.338 8.004 0.334 1
1 194 . 1 1 1 A 19 19 PHE HA H 19 4.068 4.618 -0.550 1
1 197 . 1 1 1 A 19 19 PHE C C 19 176.568 175.407 1.161 1
1 198 . 1 1 1 A 19 19 PHE CA C 19 59.338 59.289 0.049 1
1 199 . 1 1 1 A 19 19 PHE CB C 19 40.201 39.378 0.823 1
1 200 . 1 1 1 A 19 19 PHE N N 19 116.857 119.245 -2.388 1
1 201 . 1 1 1 A 20 20 ASP H H 20 8.794 8.731 0.063 1
1 202 . 1 1 1 A 20 20 ASP HA H 20 4.485 4.804 -0.319 1
1 205 . 1 1 1 A 20 20 ASP C C 20 177.379 176.763 0.616 1
1 206 . 1 1 1 A 20 20 ASP CA C 20 54.140 54.200 -0.060 1
1 207 . 1 1 1 A 20 20 ASP CB C 20 41.915 41.627 0.288 1
1 208 . 1 1 1 A 20 20 ASP N N 20 123.025 124.537 -1.512 1
1 209 . 1 1 1 A 21 21 PHE H H 21 8.862 9.104 -0.242 1
1 210 . 1 1 1 A 21 21 PHE HA H 21 4.087 4.087 0.000 1
1 218 . 1 1 1 A 21 21 PHE C C 21 176.952 177.191 -0.239 1
1 219 . 1 1 1 A 21 21 PHE CA C 21 61.095 62.319 -1.224 1
1 220 . 1 1 1 A 21 21 PHE CB C 21 38.678 39.441 -0.763 1
1 226 . 1 1 1 A 21 21 PHE N N 21 127.163 127.388 -0.225 1
1 227 . 1 1 1 A 22 22 ALA H H 22 8.561 8.371 0.190 1
1 228 . 1 1 1 A 22 22 ALA HA H 22 3.878 3.967 -0.089 1
1 232 . 1 1 1 A 22 22 ALA C C 22 180.710 180.046 0.664 1
1 233 . 1 1 1 A 22 22 ALA CA C 22 55.211 55.196 0.015 1
1 234 . 1 1 1 A 22 22 ALA CB C 22 18.321 18.548 -0.227 1
1 235 . 1 1 1 A 22 22 ALA N N 22 120.293 121.139 -0.846 1
1 236 . 1 1 1 A 23 23 VAL H H 23 7.241 7.714 -0.473 1
1 237 . 1 1 1 A 23 23 VAL HA H 23 3.684 3.478 0.206 1
1 245 . 1 1 1 A 23 23 VAL C C 23 177.101 178.227 -1.126 1
1 246 . 1 1 1 A 23 23 VAL CA C 23 65.237 66.961 -1.724 1
1 247 . 1 1 1 A 23 23 VAL CB C 23 31.780 31.595 0.185 1
1 250 . 1 1 1 A 23 23 VAL N N 23 118.775 117.670 1.105 1
1 251 . 1 1 1 A 24 24 ILE H H 24 6.761 8.153 -1.392 1
1 252 . 1 1 1 A 24 24 ILE HA H 24 3.196 3.478 -0.282 1
1 262 . 1 1 1 A 24 24 ILE C C 24 177.287 177.946 -0.659 1
1 263 . 1 1 1 A 24 24 ILE CA C 24 63.404 65.734 -2.330 1
1 264 . 1 1 1 A 24 24 ILE CB C 24 36.294 37.718 -1.424 1
1 268 . 1 1 1 A 24 24 ILE N N 24 119.036 119.814 -0.778 1
1 269 . 1 1 1 A 25 25 LYS H H 25 8.032 8.195 -0.163 1
1 270 . 1 1 1 A 25 25 LYS HA H 25 3.809 3.566 0.243 1
1 279 . 1 1 1 A 25 25 LYS C C 25 179.450 178.862 0.588 1
1 280 . 1 1 1 A 25 25 LYS CA C 25 59.621 59.422 0.199 1
1 281 . 1 1 1 A 25 25 LYS CB C 25 32.259 31.974 0.285 1
1 285 . 1 1 1 A 25 25 LYS N N 25 118.368 120.314 -1.946 1
1 286 . 1 1 1 A 26 26 GLU H H 26 7.845 7.845 0.000 1
1 287 . 1 1 1 A 26 26 GLU HA H 26 4.021 4.294 -0.273 1
1 292 . 1 1 1 A 26 26 GLU C C 26 179.191 179.050 0.141 1
1 293 . 1 1 1 A 26 26 GLU CA C 26 59.530 59.539 -0.009 1
1 294 . 1 1 1 A 26 26 GLU CB C 26 29.449 29.111 0.338 1
1 296 . 1 1 1 A 26 26 GLU N N 26 120.522 119.103 1.419 1
1 297 . 1 1 1 A 27 27 LEU H H 27 8.165 8.208 -0.043 1
1 298 . 1 1 1 A 27 27 LEU HA H 27 4.163 4.097 0.066 1
1 308 . 1 1 1 A 27 27 LEU C C 27 177.256 178.348 -1.092 1
1 309 . 1 1 1 A 27 27 LEU CA C 27 58.049 57.585 0.464 1
1 310 . 1 1 1 A 27 27 LEU CB C 27 41.365 41.675 -0.310 1
1 314 . 1 1 1 A 27 27 LEU N N 27 120.879 122.569 -1.690 1
1 315 . 1 1 1 A 28 28 LYS H H 28 8.902 8.307 0.595 1
1 316 . 1 1 1 A 28 28 LYS HA H 28 4.199 4.285 -0.086 1
1 317 . 1 1 1 A 28 28 LYS C C 28 179.707 178.792 0.915 1
1 318 . 1 1 1 A 28 28 LYS CA C 28 60.097 59.337 0.760 1
1 319 . 1 1 1 A 28 28 LYS CB C 28 33.420 32.072 1.348 1
1 320 . 1 1 1 A 28 28 LYS N N 28 120.050 119.845 0.205 1
1 321 . 1 1 1 A 29 29 THR H H 29 8.294 8.007 0.287 1
1 322 . 1 1 1 A 29 29 THR HA H 29 3.892 3.936 -0.044 1
1 327 . 1 1 1 A 29 29 THR C C 29 175.711 176.904 -1.193 1
1 328 . 1 1 1 A 29 29 THR CA C 29 66.846 66.683 0.163 1
1 329 . 1 1 1 A 29 29 THR CB C 29 68.794 68.693 0.101 1
1 331 . 1 1 1 A 29 29 THR N N 29 115.933 116.661 -0.728 1
1 332 . 1 1 1 A 30 30 ALA H H 30 8.244 8.635 -0.391 1
1 333 . 1 1 1 A 30 30 ALA HA H 30 4.241 4.229 0.012 1
1 337 . 1 1 1 A 30 30 ALA C C 30 179.128 179.305 -0.177 1
1 338 . 1 1 1 A 30 30 ALA CA C 30 55.714 55.495 0.219 1
1 339 . 1 1 1 A 30 30 ALA CB C 30 18.955 18.369 0.586 1
1 340 . 1 1 1 A 30 30 ALA N N 30 124.617 123.464 1.153 1
1 341 . 1 1 1 A 31 31 ALA H H 31 8.968 8.514 0.454 1
1 342 . 1 1 1 A 31 31 ALA HA H 31 3.890 4.071 -0.181 1
1 346 . 1 1 1 A 31 31 ALA C C 31 180.352 179.765 0.587 1
1 347 . 1 1 1 A 31 31 ALA CA C 31 55.454 55.465 -0.011 1
1 348 . 1 1 1 A 31 31 ALA CB C 31 17.124 17.997 -0.873 1
1 349 . 1 1 1 A 31 31 ALA N N 31 119.327 120.445 -1.118 1
1 350 . 1 1 1 A 32 32 SER H H 32 7.995 7.863 0.132 1
1 351 . 1 1 1 A 32 32 SER HA H 32 4.238 4.445 -0.207 1
1 354 . 1 1 1 A 32 32 SER C C 32 175.612 176.107 -0.495 1
1 355 . 1 1 1 A 32 32 SER CA C 32 61.203 61.157 0.046 1
1 356 . 1 1 1 A 32 32 SER CB C 32 63.406 63.342 0.064 1
1 357 . 1 1 1 A 32 32 SER N N 32 111.962 114.331 -2.369 1
1 358 . 1 1 1 A 33 33 GLN H H 33 8.333 7.919 0.414 1
1 359 . 1 1 1 A 33 33 GLN HA H 33 3.992 4.238 -0.246 1
1 366 . 1 1 1 A 33 33 GLN C C 33 177.486 177.854 -0.368 1
1 367 . 1 1 1 A 33 33 GLN CA C 33 58.277 57.882 0.395 1
1 368 . 1 1 1 A 33 33 GLN CB C 33 29.140 29.477 -0.337 1
1 370 . 1 1 1 A 33 33 GLN N N 33 119.527 120.415 -0.888 1
1 372 . 1 1 1 A 34 34 TYR H H 34 8.587 8.367 0.220 1
1 373 . 1 1 1 A 34 34 TYR HA H 34 4.792 4.470 0.322 1
1 380 . 1 1 1 A 34 34 TYR C C 34 176.499 176.699 -0.200 1
1 381 . 1 1 1 A 34 34 TYR CA C 34 57.711 59.642 -1.931 1
1 382 . 1 1 1 A 34 34 TYR CB C 34 39.561 38.981 0.580 1
1 387 . 1 1 1 A 34 34 TYR N N 34 114.610 116.488 -1.878 1
1 388 . 1 1 1 A 35 35 GLY H H 35 7.346 8.107 -0.761 1
1 389 . 1 1 1 A 35 35 GLY HA2 H 35 4.785 4.113 0.672 1
1 390 . 1 1 1 A 35 35 GLY HA3 H 35 4.007 4.119 -0.112 1
1 391 . 1 1 1 A 35 35 GLY C C 35 175.796 173.378 2.418 1
1 392 . 1 1 1 A 35 35 GLY CA C 35 44.355 44.701 -0.346 1
1 393 . 1 1 1 A 35 35 GLY N N 35 108.501 106.000 2.501 1
1 394 . 1 1 1 A 36 36 ALA H H 36 9.363 8.406 0.957 1
1 395 . 1 1 1 A 36 36 ALA HA H 36 4.217 4.613 -0.396 1
1 399 . 1 1 1 A 36 36 ALA C C 36 178.039 177.582 0.457 1
1 400 . 1 1 1 A 36 36 ALA CA C 36 56.114 51.778 4.336 1
1 401 . 1 1 1 A 36 36 ALA CB C 36 19.179 18.656 0.523 1
1 402 . 1 1 1 A 36 36 ALA N N 36 125.811 123.595 2.216 1
1 403 . 1 1 1 A 37 37 THR H H 37 8.070 8.438 -0.368 1
1 404 . 1 1 1 A 37 37 THR HA H 37 4.570 4.518 0.052 1
1 409 . 1 1 1 A 37 37 THR C C 37 173.685 174.250 -0.565 1
1 410 . 1 1 1 A 37 37 THR CA C 37 59.822 62.840 -3.018 1
1 411 . 1 1 1 A 37 37 THR CB C 37 68.267 71.716 -3.449 1
1 413 . 1 1 1 A 37 37 THR N N 37 129.410 118.627 10.783 1
1 414 . 1 1 1 A 38 38 ALA H H 38 6.853 7.736 -0.883 1
1 415 . 1 1 1 A 38 38 ALA HA H 38 4.601 4.622 -0.021 1
1 419 . 1 1 1 A 38 38 ALA CA C 38 50.758 50.643 0.115 1
1 420 . 1 1 1 A 38 38 ALA CB C 38 18.325 19.630 -1.305 1
1 421 . 1 1 1 A 38 38 ALA N N 38 124.674 124.849 -0.175 1
1 422 . 1 1 1 A 40 40 TYR HA H 40 4.032 3.986 0.046 1
1 429 . 1 1 1 A 40 40 TYR C C 40 176.456 177.291 -0.835 1
1 430 . 1 1 1 A 40 40 TYR CA C 40 61.010 61.838 -0.828 1
1 431 . 1 1 1 A 40 40 TYR CB C 40 39.286 38.525 0.761 1
1 436 . 1 1 1 A 41 41 THR H H 41 6.874 7.815 -0.941 1
1 437 . 1 1 1 A 41 41 THR HA H 41 3.616 3.683 -0.067 1
1 442 . 1 1 1 A 41 41 THR C C 41 176.930 176.520 0.410 1
1 443 . 1 1 1 A 41 41 THR CA C 41 65.557 65.392 0.165 1
1 444 . 1 1 1 A 41 41 THR CB C 41 68.228 69.172 -0.944 1
1 446 . 1 1 1 A 41 41 THR N N 41 115.143 113.671 1.472 1
1 447 . 1 1 1 A 42 42 LEU H H 42 8.623 7.292 1.331 1
1 448 . 1 1 1 A 42 42 LEU HA H 42 3.708 4.002 -0.294 1
1 458 . 1 1 1 A 42 42 LEU C C 42 178.206 179.060 -0.854 1
1 459 . 1 1 1 A 42 42 LEU CA C 42 57.417 57.792 -0.375 1
1 460 . 1 1 1 A 42 42 LEU CB C 42 41.342 41.211 0.131 1
1 464 . 1 1 1 A 42 42 LEU N N 42 120.418 118.728 1.690 1
1 465 . 1 1 1 A 43 43 ALA H H 43 7.735 8.084 -0.349 1
1 466 . 1 1 1 A 43 43 ALA HA H 43 4.020 3.943 0.077 1
1 470 . 1 1 1 A 43 43 ALA C C 43 180.826 180.572 0.254 1
1 471 . 1 1 1 A 43 43 ALA CA C 43 54.925 55.074 -0.149 1
1 472 . 1 1 1 A 43 43 ALA CB C 43 17.506 18.154 -0.648 1
1 473 . 1 1 1 A 43 43 ALA N N 43 120.203 121.814 -1.611 1
1 474 . 1 1 1 A 44 44 ILE H H 44 7.149 7.327 -0.178 1
1 475 . 1 1 1 A 44 44 ILE HA H 44 3.603 3.550 0.053 1
1 485 . 1 1 1 A 44 44 ILE C C 44 178.594 178.109 0.485 1
1 486 . 1 1 1 A 44 44 ILE CA C 44 64.782 64.629 0.153 1
1 487 . 1 1 1 A 44 44 ILE CB C 44 37.472 37.628 -0.156 1
1 491 . 1 1 1 A 44 44 ILE N N 44 118.881 119.463 -0.582 1
1 492 . 1 1 1 A 45 45 VAL H H 45 7.968 7.869 0.099 1
1 493 . 1 1 1 A 45 45 VAL HA H 45 2.925 3.349 -0.424 1
1 501 . 1 1 1 A 45 45 VAL C C 45 177.023 177.867 -0.844 1
1 502 . 1 1 1 A 45 45 VAL CA C 45 67.081 67.095 -0.014 1
1 503 . 1 1 1 A 45 45 VAL CB C 45 30.854 31.223 -0.369 1
1 506 . 1 1 1 A 45 45 VAL N N 45 120.764 119.849 0.915 1
1 507 . 1 1 1 A 46 46 GLU H H 46 8.399 8.262 0.137 1
1 508 . 1 1 1 A 46 46 GLU HA H 46 3.848 3.925 -0.077 1
1 513 . 1 1 1 A 46 46 GLU C C 46 178.656 178.472 0.184 1
1 514 . 1 1 1 A 46 46 GLU CA C 46 59.491 58.996 0.495 1
1 515 . 1 1 1 A 46 46 GLU CB C 46 28.991 28.881 0.110 1
1 517 . 1 1 1 A 46 46 GLU N N 46 116.599 119.702 -3.103 1
1 518 . 1 1 1 A 47 47 SER H H 47 7.273 7.948 -0.675 1
1 519 . 1 1 1 A 47 47 SER HA H 47 4.287 4.133 0.154 1
1 521 . 1 1 1 A 47 47 SER CA C 47 61.047 62.516 -1.469 1
1 522 . 1 1 1 A 47 47 SER CB C 47 63.016 63.017 -0.001 1
1 523 . 1 1 1 A 47 47 SER N N 47 113.609 118.005 -4.396 1
1 524 . 1 1 1 A 48 48 VAL H H 48 8.006 8.382 -0.376 1
1 525 . 1 1 1 A 48 48 VAL HA H 48 3.556 3.538 0.018 1
1 533 . 1 1 1 A 48 48 VAL C C 48 177.257 177.984 -0.727 1
1 534 . 1 1 1 A 48 48 VAL CA C 48 65.025 66.542 -1.517 1
1 535 . 1 1 1 A 48 48 VAL CB C 48 31.841 31.528 0.313 1
1 538 . 1 1 1 A 48 48 VAL N N 48 122.327 121.423 0.904 1
1 539 . 1 1 1 A 49 49 ALA H H 49 8.369 7.810 0.559 1
1 540 . 1 1 1 A 49 49 ALA HA H 49 4.115 4.256 -0.141 1
1 544 . 1 1 1 A 49 49 ALA C C 49 177.307 178.490 -1.183 1
1 545 . 1 1 1 A 49 49 ALA CA C 49 53.253 53.874 -0.621 1
1 546 . 1 1 1 A 49 49 ALA CB C 49 20.131 18.252 1.879 1
1 547 . 1 1 1 A 49 49 ALA N N 49 118.050 121.308 -3.258 1
1 548 . 1 1 1 A 50 50 ASP H H 50 7.052 7.849 -0.797 1
1 549 . 1 1 1 A 50 50 ASP HA H 50 4.788 4.555 0.233 1
1 552 . 1 1 1 A 50 50 ASP C C 50 175.481 176.162 -0.681 1
1 553 . 1 1 1 A 50 50 ASP CA C 50 53.681 55.261 -1.580 1
1 554 . 1 1 1 A 50 50 ASP CB C 50 39.333 40.993 -1.660 1
1 555 . 1 1 1 A 50 50 ASP N N 50 116.997 117.084 -0.087 1
1 556 . 1 1 1 A 51 51 ASN H H 51 8.535 7.651 0.884 1
1 557 . 1 1 1 A 51 51 ASN HA H 51 4.628 4.821 -0.193 1
1 562 . 1 1 1 A 51 51 ASN C C 51 174.077 175.160 -1.083 1
1 563 . 1 1 1 A 51 51 ASN CA C 51 52.315 51.704 0.611 1
1 564 . 1 1 1 A 51 51 ASN CB C 51 41.928 40.034 1.894 1
1 565 . 1 1 1 A 51 51 ASN N N 51 118.626 117.190 1.436 1
1 567 . 1 1 1 A 52 52 TRP H H 52 8.555 8.160 0.395 1
1 574 . 1 1 1 A 52 52 TRP C C 52 173.269 176.035 -2.766 1
1 575 . 1 1 1 A 52 52 TRP CA C 52 55.031 57.930 -2.899 1
1 576 . 1 1 1 A 52 52 TRP CB C 52 26.801 29.607 -2.806 1
1 582 . 1 1 1 A 52 52 TRP N N 52 120.693 121.015 -0.322 1
1 584 . 1 1 1 A 53 53 LEU H H 53 7.847 9.133 -1.286 1
1 585 . 1 1 1 A 53 53 LEU HA H 53 4.859 5.127 -0.268 1
1 595 . 1 1 1 A 53 53 LEU C C 53 177.397 175.022 2.375 1
1 596 . 1 1 1 A 53 53 LEU CA C 53 53.619 53.535 0.084 1
1 597 . 1 1 1 A 53 53 LEU CB C 53 41.812 46.739 -4.927 1
1 601 . 1 1 1 A 53 53 LEU N N 53 124.741 124.980 -0.239 1
1 602 . 1 1 1 A 54 54 THR H H 54 8.850 8.801 0.049 1
1 603 . 1 1 1 A 54 54 THR HA H 54 4.598 4.610 -0.012 1
1 608 . 1 1 1 A 54 54 THR CA C 54 60.531 58.380 2.151 1
1 609 . 1 1 1 A 54 54 THR CB C 54 67.183 69.830 -2.647 1
1 611 . 1 1 1 A 54 54 THR N N 54 113.407 115.098 -1.691 1
1 612 . 1 1 1 A 55 55 PRO HA H 55 4.511 4.546 -0.035 1
1 619 . 1 1 1 A 55 55 PRO C C 55 179.383 178.975 0.408 1
1 620 . 1 1 1 A 55 55 PRO CA C 55 67.159 65.122 2.037 1
1 621 . 1 1 1 A 55 55 PRO CB C 55 32.095 31.802 0.293 1
1 622 . 1 1 1 A 56 56 THR H H 56 8.575 7.792 0.783 1
1 623 . 1 1 1 A 56 56 THR HA H 56 4.229 4.075 0.154 1
1 628 . 1 1 1 A 56 56 THR C C 56 176.668 176.289 0.379 1
1 629 . 1 1 1 A 56 56 THR CA C 56 66.943 65.594 1.349 1
1 630 . 1 1 1 A 56 56 THR CB C 56 68.129 68.620 -0.491 1
1 632 . 1 1 1 A 56 56 THR N N 56 114.855 112.374 2.481 1
1 633 . 1 1 1 A 57 57 ASP H H 57 8.730 8.054 0.676 1
1 634 . 1 1 1 A 57 57 ASP HA H 57 4.425 4.782 -0.357 1
1 637 . 1 1 1 A 57 57 ASP C C 57 178.351 178.975 -0.624 1
1 638 . 1 1 1 A 57 57 ASP CA C 57 57.963 56.516 1.447 1
1 639 . 1 1 1 A 57 57 ASP CB C 57 40.134 39.916 0.218 1
1 640 . 1 1 1 A 57 57 ASP N N 57 126.239 119.729 6.510 1
1 641 . 1 1 1 A 58 58 TRP H H 58 8.244 8.271 -0.027 1
1 642 . 1 1 1 A 58 58 TRP HA H 58 4.030 4.595 -0.565 1
1 650 . 1 1 1 A 58 58 TRP C C 58 177.432 179.395 -1.963 1
1 651 . 1 1 1 A 58 58 TRP CA C 58 62.731 60.493 2.238 1
1 652 . 1 1 1 A 58 58 TRP CB C 58 29.122 29.448 -0.326 1
1 657 . 1 1 1 A 58 58 TRP N N 58 119.241 119.995 -0.754 1
1 659 . 1 1 1 A 59 59 ASN H H 59 8.098 8.822 -0.724 1
1 660 . 1 1 1 A 59 59 ASN HA H 59 4.424 4.423 0.001 1
1 663 . 1 1 1 A 59 59 ASN C C 59 176.952 177.961 -1.009 1
1 664 . 1 1 1 A 59 59 ASN CA C 59 58.135 56.508 1.627 1
1 665 . 1 1 1 A 59 59 ASN CB C 59 40.168 38.019 2.149 1
1 666 . 1 1 1 A 59 59 ASN N N 59 115.747 118.026 -2.279 1
1 667 . 1 1 1 A 60 60 THR H H 60 8.712 7.893 0.819 1
1 668 . 1 1 1 A 60 60 THR HA H 60 3.717 3.979 -0.262 1
1 673 . 1 1 1 A 60 60 THR C C 60 176.044 176.643 -0.599 1
1 674 . 1 1 1 A 60 60 THR CA C 60 66.576 67.180 -0.604 1
1 675 . 1 1 1 A 60 60 THR CB C 60 69.251 67.617 1.634 1
1 677 . 1 1 1 A 60 60 THR N N 60 114.896 118.213 -3.317 1
1 678 . 1 1 1 A 61 61 LEU H H 61 8.485 8.509 -0.024 1
1 679 . 1 1 1 A 61 61 LEU HA H 61 3.391 4.054 -0.663 1
1 689 . 1 1 1 A 61 61 LEU C C 61 177.433 178.619 -1.186 1
1 690 . 1 1 1 A 61 61 LEU CA C 61 58.354 58.636 -0.282 1
1 691 . 1 1 1 A 61 61 LEU CB C 61 41.761 42.371 -0.610 1
1 695 . 1 1 1 A 61 61 LEU N N 61 123.433 121.854 1.579 1
1 696 . 1 1 1 A 62 62 VAL H H 62 8.073 8.413 -0.340 1
1 697 . 1 1 1 A 62 62 VAL HA H 62 3.207 3.812 -0.605 1
1 705 . 1 1 1 A 62 62 VAL C C 62 177.585 177.440 0.145 1
1 706 . 1 1 1 A 62 62 VAL CA C 62 67.345 65.176 2.169 1
1 707 . 1 1 1 A 62 62 VAL CB C 62 30.905 30.583 0.322 1
1 710 . 1 1 1 A 62 62 VAL N N 62 116.018 118.474 -2.456 1
1 711 . 1 1 1 A 63 63 ARG H H 63 7.765 8.008 -0.243 1
1 712 . 1 1 1 A 63 63 ARG HA H 63 3.602 4.034 -0.432 1
1 719 . 1 1 1 A 63 63 ARG C C 63 177.818 178.242 -0.424 1
1 720 . 1 1 1 A 63 63 ARG CA C 63 58.049 57.938 0.111 1
1 721 . 1 1 1 A 63 63 ARG CB C 63 29.955 29.141 0.814 1
1 724 . 1 1 1 A 63 63 ARG N N 63 116.700 120.595 -3.895 1
1 725 . 1 1 1 A 64 64 ALA H H 64 7.574 7.550 0.024 1
1 726 . 1 1 1 A 64 64 ALA HA H 64 4.158 4.340 -0.182 1
1 730 . 1 1 1 A 64 64 ALA C C 64 179.886 179.306 0.580 1
1 731 . 1 1 1 A 64 64 ALA CA C 64 54.007 54.064 -0.057 1
1 732 . 1 1 1 A 64 64 ALA CB C 64 19.147 19.724 -0.577 1
1 733 . 1 1 1 A 64 64 ALA N N 64 117.555 121.838 -4.283 1
1 734 . 1 1 1 A 65 65 VAL H H 65 7.554 8.049 -0.495 1
1 735 . 1 1 1 A 65 65 VAL HA H 65 4.253 3.803 0.450 1
1 743 . 1 1 1 A 65 65 VAL C C 65 174.180 176.358 -2.178 1
1 744 . 1 1 1 A 65 65 VAL CA C 65 62.683 65.228 -2.545 1
1 745 . 1 1 1 A 65 65 VAL CB C 65 33.458 31.370 2.088 1
1 748 . 1 1 1 A 65 65 VAL N N 65 110.013 115.864 -5.851 1
1 749 . 1 1 1 A 66 66 LEU H H 66 7.792 7.266 0.526 1
1 750 . 1 1 1 A 66 66 LEU HA H 66 4.790 4.769 0.021 1
1 760 . 1 1 1 A 66 66 LEU C C 66 177.537 175.729 1.808 1
1 761 . 1 1 1 A 66 66 LEU CA C 66 52.823 52.693 0.130 1
1 762 . 1 1 1 A 66 66 LEU CB C 66 44.071 45.460 -1.389 1
1 766 . 1 1 1 A 66 66 LEU N N 66 118.967 121.252 -2.285 1
1 767 . 1 1 1 A 67 67 SER H H 67 9.208 8.400 0.808 1
1 768 . 1 1 1 A 67 67 SER HA H 67 4.414 4.790 -0.376 1
1 771 . 1 1 1 A 67 67 SER CA C 67 57.943 57.532 0.411 1
1 772 . 1 1 1 A 67 67 SER CB C 67 64.743 65.771 -1.028 1
1 773 . 1 1 1 A 67 67 SER N N 67 116.378 116.068 0.310 1
1 774 . 1 1 1 A 69 69 GLY HA2 H 69 3.916 3.709 0.207 1
1 775 . 1 1 1 A 69 69 GLY HA3 H 69 3.867 3.746 0.121 1
1 776 . 1 1 1 A 69 69 GLY C C 69 176.783 175.500 1.283 1
1 777 . 1 1 1 A 69 69 GLY CA C 69 46.977 46.723 0.254 1
1 778 . 1 1 1 A 70 70 ASP H H 70 7.674 8.107 -0.433 1
1 779 . 1 1 1 A 70 70 ASP HA H 70 4.511 3.686 0.825 1
1 782 . 1 1 1 A 70 70 ASP C C 70 178.096 178.153 -0.057 1
1 783 . 1 1 1 A 70 70 ASP CA C 70 57.262 56.506 0.756 1
1 784 . 1 1 1 A 70 70 ASP CB C 70 40.594 39.735 0.859 1
1 785 . 1 1 1 A 70 70 ASP N N 70 123.930 121.732 2.198 1
1 786 . 1 1 1 A 71 71 HIS H H 71 8.729 7.990 0.739 1
1 787 . 1 1 1 A 71 71 HIS HA H 71 4.235 4.162 0.073 1
1 790 . 1 1 1 A 71 71 HIS C C 71 176.769 176.771 -0.002 1
1 791 . 1 1 1 A 71 71 HIS CA C 71 60.041 59.921 0.120 1
1 792 . 1 1 1 A 71 71 HIS CB C 71 30.682 29.978 0.704 1
1 793 . 1 1 1 A 71 71 HIS N N 71 121.003 119.464 1.539 1
1 794 . 1 1 1 A 72 72 LEU H H 72 7.620 7.929 -0.309 1
1 795 . 1 1 1 A 72 72 LEU HA H 72 3.769 4.002 -0.233 1
1 805 . 1 1 1 A 72 72 LEU C C 72 180.275 179.253 1.022 1
1 806 . 1 1 1 A 72 72 LEU CA C 72 58.192 58.009 0.183 1
1 807 . 1 1 1 A 72 72 LEU CB C 72 41.381 41.240 0.141 1
1 811 . 1 1 1 A 72 72 LEU N N 72 118.569 118.517 0.052 1
1 812 . 1 1 1 A 73 73 LEU H H 73 7.542 7.472 0.070 1
1 813 . 1 1 1 A 73 73 LEU HA H 73 4.107 4.237 -0.130 1
1 823 . 1 1 1 A 73 73 LEU C C 73 179.436 179.143 0.293 1
1 824 . 1 1 1 A 73 73 LEU CA C 73 58.026 57.226 0.800 1
1 825 . 1 1 1 A 73 73 LEU CB C 73 41.638 42.053 -0.415 1
1 829 . 1 1 1 A 73 73 LEU N N 73 121.418 120.603 0.815 1
1 830 . 1 1 1 A 74 74 TRP H H 74 8.786 7.906 0.880 1
1 831 . 1 1 1 A 74 74 TRP HA H 74 3.589 5.384 -1.795 1
1 840 . 1 1 1 A 74 74 TRP C C 74 176.816 178.604 -1.788 1
1 841 . 1 1 1 A 74 74 TRP CA C 74 63.046 59.965 3.081 1
1 842 . 1 1 1 A 74 74 TRP CB C 74 28.065 29.038 -0.973 1
1 848 . 1 1 1 A 74 74 TRP N N 74 121.111 118.298 2.813 1
1 850 . 1 1 1 A 75 75 LYS H H 75 8.939 7.830 1.109 1
1 851 . 1 1 1 A 75 75 LYS HA H 75 3.055 4.183 -1.128 1
1 860 . 1 1 1 A 75 75 LYS C C 75 177.967 179.224 -1.257 1
1 861 . 1 1 1 A 75 75 LYS CA C 75 60.029 58.644 1.385 1
1 862 . 1 1 1 A 75 75 LYS CB C 75 32.533 32.935 -0.402 1
1 866 . 1 1 1 A 75 75 LYS N N 75 119.783 118.684 1.099 1
1 867 . 1 1 1 A 76 76 SER H H 76 7.832 8.134 -0.302 1
1 868 . 1 1 1 A 76 76 SER HA H 76 4.040 4.444 -0.404 1
1 871 . 1 1 1 A 76 76 SER C C 76 177.816 175.993 1.823 1
1 872 . 1 1 1 A 76 76 SER CA C 76 62.105 61.289 0.816 1
1 873 . 1 1 1 A 76 76 SER CB C 76 62.679 63.201 -0.522 1
1 874 . 1 1 1 A 76 76 SER N N 76 113.395 117.166 -3.771 1
1 875 . 1 1 1 A 77 77 GLU H H 77 7.590 7.734 -0.144 1
1 876 . 1 1 1 A 77 77 GLU HA H 77 4.042 4.164 -0.122 1
1 881 . 1 1 1 A 77 77 GLU C C 77 177.809 178.948 -1.139 1
1 882 . 1 1 1 A 77 77 GLU CA C 77 58.270 58.975 -0.705 1
1 883 . 1 1 1 A 77 77 GLU CB C 77 29.208 29.180 0.028 1
1 885 . 1 1 1 A 77 77 GLU N N 77 121.574 122.004 -0.430 1
1 886 . 1 1 1 A 78 78 PHE H H 78 9.081 7.846 1.235 1
1 887 . 1 1 1 A 78 78 PHE HA H 78 3.778 4.209 -0.431 1
1 895 . 1 1 1 A 78 78 PHE C C 78 178.114 177.481 0.633 1
1 896 . 1 1 1 A 78 78 PHE CA C 78 60.629 61.273 -0.644 1
1 897 . 1 1 1 A 78 78 PHE CB C 78 38.295 38.957 -0.662 1
1 902 . 1 1 1 A 78 78 PHE N N 78 122.682 121.106 1.576 1
1 903 . 1 1 1 A 79 79 PHE H H 79 8.890 8.304 0.586 1
1 904 . 1 1 1 A 79 79 PHE HA H 79 3.800 4.095 -0.295 1
1 912 . 1 1 1 A 79 79 PHE C C 79 178.354 178.215 0.139 1
1 913 . 1 1 1 A 79 79 PHE CA C 79 60.704 62.532 -1.828 1
1 914 . 1 1 1 A 79 79 PHE CB C 79 37.184 38.684 -1.500 1
1 920 . 1 1 1 A 79 79 PHE N N 79 121.056 117.624 3.432 1
1 921 . 1 1 1 A 80 80 GLU H H 80 7.793 8.057 -0.264 1
1 922 . 1 1 1 A 80 80 GLU HA H 80 4.082 4.062 0.020 1
1 927 . 1 1 1 A 80 80 GLU C C 80 179.068 178.929 0.139 1
1 928 . 1 1 1 A 80 80 GLU CA C 80 59.735 59.756 -0.021 1
1 929 . 1 1 1 A 80 80 GLU CB C 80 28.722 29.444 -0.722 1
1 931 . 1 1 1 A 80 80 GLU N N 80 120.312 120.200 0.112 1
1 932 . 1 1 1 A 81 81 ASN H H 81 8.624 8.979 -0.355 1
1 933 . 1 1 1 A 81 81 ASN HA H 81 4.521 4.431 0.090 1
1 938 . 1 1 1 A 81 81 ASN C C 81 179.262 177.384 1.878 1
1 939 . 1 1 1 A 81 81 ASN CA C 81 55.504 55.984 -0.480 1
1 940 . 1 1 1 A 81 81 ASN CB C 81 37.517 37.328 0.189 1
1 941 . 1 1 1 A 81 81 ASN N N 81 119.338 117.239 2.099 1
1 943 . 1 1 1 A 82 82 CYS H H 82 8.554 8.206 0.348 1
1 944 . 1 1 1 A 82 82 CYS HA H 82 3.792 3.888 -0.096 1
1 947 . 1 1 1 A 82 82 CYS C C 82 176.478 177.234 -0.756 1
1 948 . 1 1 1 A 82 82 CYS CA C 82 65.232 63.272 1.960 1
1 949 . 1 1 1 A 82 82 CYS CB C 82 26.762 26.674 0.088 1
1 950 . 1 1 1 A 82 82 CYS N N 82 120.576 117.529 3.047 1
1 951 . 1 1 1 A 83 83 ARG H H 83 8.522 7.997 0.525 1
1 952 . 1 1 1 A 83 83 ARG HA H 83 3.932 4.233 -0.301 1
1 960 . 1 1 1 A 83 83 ARG C C 83 179.138 178.796 0.342 1
1 961 . 1 1 1 A 83 83 ARG CA C 83 60.443 58.971 1.472 1
1 962 . 1 1 1 A 83 83 ARG CB C 83 29.550 29.624 -0.074 1
1 965 . 1 1 1 A 83 83 ARG N N 83 123.035 119.709 3.326 1
1 967 . 1 1 1 A 84 84 ASP H H 84 7.791 8.412 -0.621 1
1 968 . 1 1 1 A 84 84 ASP HA H 84 4.353 4.392 -0.039 1
1 971 . 1 1 1 A 84 84 ASP C C 84 178.649 178.601 0.048 1
1 972 . 1 1 1 A 84 84 ASP CA C 84 57.767 57.533 0.234 1
1 973 . 1 1 1 A 84 84 ASP CB C 84 41.305 41.666 -0.361 1
1 974 . 1 1 1 A 84 84 ASP N N 84 120.332 119.535 0.797 1
1 975 . 1 1 1 A 85 85 THR H H 85 8.370 8.282 0.088 1
1 976 . 1 1 1 A 85 85 THR HA H 85 3.730 3.910 -0.180 1
1 981 . 1 1 1 A 85 85 THR C C 85 175.198 176.482 -1.284 1
1 982 . 1 1 1 A 85 85 THR CA C 85 66.830 65.335 1.495 1
1 983 . 1 1 1 A 85 85 THR CB C 85 68.533 68.372 0.161 1
1 985 . 1 1 1 A 85 85 THR N N 85 117.360 115.689 1.671 1
1 986 . 1 1 1 A 86 86 ALA H H 86 8.845 8.170 0.675 1
1 987 . 1 1 1 A 86 86 ALA HA H 86 3.991 4.079 -0.088 1
1 991 . 1 1 1 A 86 86 ALA C C 86 179.980 179.791 0.189 1
1 992 . 1 1 1 A 86 86 ALA CA C 86 55.769 55.640 0.129 1
1 993 . 1 1 1 A 86 86 ALA CB C 86 17.881 18.812 -0.931 1
1 994 . 1 1 1 A 86 86 ALA N N 86 123.613 123.256 0.357 1
1 995 . 1 1 1 A 87 87 LYS H H 87 7.686 8.490 -0.804 1
1 996 . 1 1 1 A 87 87 LYS HA H 87 4.099 3.904 0.195 1
1 1005 . 1 1 1 A 87 87 LYS C C 87 179.592 179.696 -0.104 1
1 1006 . 1 1 1 A 87 87 LYS CA C 87 59.708 59.771 -0.063 1
1 1007 . 1 1 1 A 87 87 LYS CB C 87 32.054 32.308 -0.254 1
1 1011 . 1 1 1 A 87 87 LYS N N 87 119.623 117.377 2.246 1
1 1012 . 1 1 1 A 88 88 ARG H H 88 7.683 7.774 -0.091 1
1 1013 . 1 1 1 A 88 88 ARG HA H 88 4.051 4.116 -0.065 1
1 1020 . 1 1 1 A 88 88 ARG C C 88 180.053 179.095 0.958 1
1 1021 . 1 1 1 A 88 88 ARG CA C 88 59.558 59.173 0.385 1
1 1022 . 1 1 1 A 88 88 ARG CB C 88 29.684 29.915 -0.231 1
1 1025 . 1 1 1 A 88 88 ARG N N 88 120.788 119.207 1.581 1
1 1026 . 1 1 1 A 89 89 ASN H H 89 8.973 8.482 0.491 1
1 1027 . 1 1 1 A 89 89 ASN HA H 89 4.354 4.604 -0.250 1
1 1032 . 1 1 1 A 89 89 ASN C C 89 178.382 177.278 1.104 1
1 1033 . 1 1 1 A 89 89 ASN CA C 89 55.334 55.684 -0.350 1
1 1034 . 1 1 1 A 89 89 ASN CB C 89 37.864 38.359 -0.495 1
1 1035 . 1 1 1 A 89 89 ASN N N 89 121.012 116.913 4.099 1
1 1037 . 1 1 1 A 90 90 GLN H H 90 8.152 8.229 -0.077 1
1 1038 . 1 1 1 A 90 90 GLN HA H 90 4.020 4.316 -0.296 1
1 1045 . 1 1 1 A 90 90 GLN C C 90 179.075 177.719 1.356 1
1 1046 . 1 1 1 A 90 90 GLN CA C 90 59.318 57.139 2.179 1
1 1047 . 1 1 1 A 90 90 GLN CB C 90 28.049 29.203 -1.154 1
1 1049 . 1 1 1 A 90 90 GLN N N 90 122.122 118.711 3.411 1
1 1051 . 1 1 1 A 91 91 GLN H H 91 7.514 7.749 -0.235 1
1 1052 . 1 1 1 A 91 91 GLN HA H 91 4.053 4.048 0.005 1
1 1059 . 1 1 1 A 91 91 GLN C C 91 177.081 177.798 -0.717 1
1 1060 . 1 1 1 A 91 91 GLN CA C 91 58.031 58.924 -0.893 1
1 1061 . 1 1 1 A 91 91 GLN CB C 91 28.365 28.286 0.079 1
1 1063 . 1 1 1 A 91 91 GLN N N 91 118.124 119.285 -1.161 1
1 1065 . 1 1 1 A 92 92 ALA H H 92 7.704 7.144 0.560 1
1 1066 . 1 1 1 A 92 92 ALA HA H 92 4.246 4.339 -0.093 1
1 1070 . 1 1 1 A 92 92 ALA C C 92 178.450 178.059 0.391 1
1 1071 . 1 1 1 A 92 92 ALA CA C 92 52.671 52.362 0.309 1
1 1072 . 1 1 1 A 92 92 ALA CB C 92 19.316 19.737 -0.421 1
1 1073 . 1 1 1 A 92 92 ALA N N 92 119.880 119.046 0.834 1
1 1074 . 1 1 1 A 93 93 GLY H H 93 7.693 7.491 0.202 1
1 1075 . 1 1 1 A 93 93 GLY HA2 H 93 3.941 3.951 -0.010 1
1 1076 . 1 1 1 A 93 93 GLY HA3 H 93 3.744 3.965 -0.221 1
1 1077 . 1 1 1 A 93 93 GLY C C 93 174.344 175.084 -0.740 1
1 1078 . 1 1 1 A 93 93 GLY CA C 93 45.949 46.272 -0.323 1
1 1079 . 1 1 1 A 93 93 GLY N N 93 105.347 106.462 -1.115 1
1 1080 . 1 1 1 A 94 94 ASN H H 94 7.076 8.167 -1.091 1
1 1081 . 1 1 1 A 94 94 ASN HA H 94 4.115 4.533 -0.418 1
1 1085 . 1 1 1 A 94 94 ASN C C 94 175.410 175.945 -0.535 1
1 1086 . 1 1 1 A 94 94 ASN CA C 94 52.651 54.271 -1.620 1
1 1087 . 1 1 1 A 94 94 ASN CB C 94 38.330 38.885 -0.555 1
1 1088 . 1 1 1 A 94 94 ASN N N 94 115.747 117.018 -1.271 1
1 1090 . 1 1 1 A 95 95 GLY H H 95 8.236 9.004 -0.768 1
1 1091 . 1 1 1 A 95 95 GLY HA2 H 95 3.633 3.795 -0.162 1
1 1092 . 1 1 1 A 95 95 GLY HA3 H 95 3.633 3.960 -0.327 1
1 1093 . 1 1 1 A 95 95 GLY C C 95 174.450 173.587 0.863 1
1 1094 . 1 1 1 A 95 95 GLY CA C 95 45.522 46.293 -0.771 1
1 1095 . 1 1 1 A 95 95 GLY N N 95 109.166 106.389 2.777 1
1 1096 . 1 1 1 A 96 96 TRP H H 96 7.899 7.944 -0.045 1
1 1097 . 1 1 1 A 96 96 TRP HA H 96 5.241 5.299 -0.058 1
1 1106 . 1 1 1 A 96 96 TRP C C 96 175.661 175.976 -0.315 1
1 1107 . 1 1 1 A 96 96 TRP CA C 96 55.090 56.155 -1.065 1
1 1108 . 1 1 1 A 96 96 TRP CB C 96 27.138 33.355 -6.217 1
1 1114 . 1 1 1 A 96 96 TRP N N 96 122.840 119.574 3.266 1
1 1116 . 1 1 1 A 97 97 ASP H H 97 7.344 9.071 -1.727 1
1 1117 . 1 1 1 A 97 97 ASP HA H 97 4.829 4.297 0.532 1
1 1120 . 1 1 1 A 97 97 ASP C C 97 175.019 176.455 -1.436 1
1 1121 . 1 1 1 A 97 97 ASP CA C 97 52.149 57.065 -4.916 1
1 1122 . 1 1 1 A 97 97 ASP CB C 97 42.697 38.868 3.829 1
1 1123 . 1 1 1 A 97 97 ASP N N 97 126.861 117.378 9.483 1
1 1124 . 1 1 1 A 98 98 PHE H H 98 8.566 8.991 -0.425 1
1 1125 . 1 1 1 A 98 98 PHE HA H 98 3.727 4.175 -0.448 1
1 1133 . 1 1 1 A 98 98 PHE C C 98 177.443 177.412 0.031 1
1 1134 . 1 1 1 A 98 98 PHE CA C 98 62.471 61.421 1.050 1
1 1135 . 1 1 1 A 98 98 PHE CB C 98 39.919 39.378 0.541 1
1 1141 . 1 1 1 A 98 98 PHE N N 98 117.781 120.756 -2.975 1
1 1142 . 1 1 1 A 99 99 ASP H H 99 8.259 8.169 0.090 1
1 1143 . 1 1 1 A 99 99 ASP HA H 99 3.960 4.096 -0.136 1
1 1146 . 1 1 1 A 99 99 ASP C C 99 178.132 178.495 -0.363 1
1 1147 . 1 1 1 A 99 99 ASP CA C 99 57.658 56.331 1.327 1
1 1148 . 1 1 1 A 99 99 ASP CB C 99 38.572 40.750 -2.178 1
1 1149 . 1 1 1 A 99 99 ASP N N 99 121.709 119.049 2.660 1
1 1150 . 1 1 1 A 100 100 MET H H 100 8.008 8.194 -0.186 1
1 1151 . 1 1 1 A 100 100 MET HA H 100 3.644 4.135 -0.491 1
1 1156 . 1 1 1 A 100 100 MET C C 100 180.008 177.604 2.404 1
1 1157 . 1 1 1 A 100 100 MET CA C 100 58.598 58.496 0.102 1
1 1158 . 1 1 1 A 100 100 MET CB C 100 33.423 33.354 0.069 1
1 1160 . 1 1 1 A 100 100 MET N N 100 119.668 118.250 1.418 1
1 1161 . 1 1 1 A 101 101 LEU H H 101 7.961 7.885 0.076 1
1 1162 . 1 1 1 A 101 101 LEU HA H 101 3.523 4.411 -0.888 1
1 1172 . 1 1 1 A 101 101 LEU C C 101 173.873 176.359 -2.486 1
1 1173 . 1 1 1 A 101 101 LEU CA C 101 58.743 54.523 4.220 1
1 1174 . 1 1 1 A 101 101 LEU CB C 101 42.632 41.158 1.474 1
1 1178 . 1 1 1 A 101 101 LEU N N 101 119.752 118.766 0.986 1
1 1179 . 1 1 1 A 102 102 THR H H 102 6.955 8.605 -1.650 1
1 1180 . 1 1 1 A 102 102 THR HA H 102 4.134 4.541 -0.407 1
1 1185 . 1 1 1 A 102 102 THR C C 102 176.513 174.744 1.769 1
1 1186 . 1 1 1 A 102 102 THR CA C 102 61.125 63.322 -2.197 1
1 1187 . 1 1 1 A 102 102 THR CB C 102 71.415 71.361 0.054 1
1 1189 . 1 1 1 A 102 102 THR N N 102 124.665 119.944 4.721 1
1 1190 . 1 1 1 A 103 103 GLY H H 103 7.816 7.138 0.678 1
1 1191 . 1 1 1 A 103 103 GLY HA2 H 103 3.824 4.189 -0.365 1
1 1192 . 1 1 1 A 103 103 GLY HA3 H 103 3.824 4.202 -0.378 1
1 1193 . 1 1 1 A 103 103 GLY C C 103 174.126 172.878 1.248 1
1 1194 . 1 1 1 A 103 103 GLY CA C 103 47.805 45.926 1.879 1
1 1195 . 1 1 1 A 103 103 GLY N N 103 114.191 106.565 7.626 1
1 1196 . 1 1 1 A 104 104 SER H H 104 8.860 7.883 0.977 1
1 1197 . 1 1 1 A 104 104 SER HA H 104 4.758 4.941 -0.183 1
1 1200 . 1 1 1 A 104 104 SER C C 104 174.591 174.153 0.438 1
1 1201 . 1 1 1 A 104 104 SER CA C 104 56.755 57.867 -1.112 1
1 1202 . 1 1 1 A 104 104 SER CB C 104 65.050 65.606 -0.556 1
1 1203 . 1 1 1 A 104 104 SER N N 104 114.771 111.945 2.826 1
1 1204 . 1 1 1 A 105 105 GLY H H 105 8.788 8.697 0.091 1
1 1205 . 1 1 1 A 105 105 GLY HA2 H 105 3.733 3.646 0.087 1
1 1206 . 1 1 1 A 105 105 GLY HA3 H 105 3.733 3.766 -0.033 1
1 1207 . 1 1 1 A 105 105 GLY CA C 105 47.247 46.921 0.326 1
1 1208 . 1 1 1 A 105 105 GLY N N 105 110.394 110.970 -0.576 1
1 1209 . 1 1 1 A 106 106 ASN HA H 106 4.454 4.924 -0.470 1
1 1212 . 1 1 1 A 106 106 ASN C C 106 175.180 176.573 -1.393 1
1 1213 . 1 1 1 A 106 106 ASN CA C 106 54.492 54.104 0.388 1
1 1214 . 1 1 1 A 106 106 ASN CB C 106 37.282 40.985 -3.703 1
1 1215 . 1 1 1 A 107 107 TYR H H 107 8.241 7.548 0.693 1
1 1216 . 1 1 1 A 107 107 TYR HA H 107 4.335 4.750 -0.415 1
1 1223 . 1 1 1 A 107 107 TYR C C 107 173.954 177.329 -3.375 1
1 1224 . 1 1 1 A 107 107 TYR CA C 107 57.727 58.246 -0.519 1
1 1225 . 1 1 1 A 107 107 TYR CB C 107 37.063 39.771 -2.708 1
1 1230 . 1 1 1 A 107 107 TYR N N 107 120.708 116.252 4.456 1
1 1231 . 1 1 1 A 108 108 SER H H 108 7.117 8.606 -1.489 1
1 1232 . 1 1 1 A 108 108 SER HA H 108 4.221 4.118 0.103 1
1 1235 . 1 1 1 A 108 108 SER C C 108 174.834 174.921 -0.087 1
1 1236 . 1 1 1 A 108 108 SER CA C 108 59.859 62.143 -2.284 1
1 1237 . 1 1 1 A 108 108 SER CB C 108 63.846 62.868 0.978 1
1 1238 . 1 1 1 A 108 108 SER N N 108 113.362 117.191 -3.829 1
1 1239 . 1 1 1 A 109 109 SER H H 109 8.053 8.007 0.046 1
1 1240 . 1 1 1 A 109 109 SER HA H 109 4.560 4.612 -0.052 1
1 1243 . 1 1 1 A 109 109 SER CA C 109 57.141 59.123 -1.982 1
1 1244 . 1 1 1 A 109 109 SER CB C 109 64.874 63.174 1.700 1
1 1245 . 1 1 1 A 109 109 SER N N 109 116.657 116.153 0.504 1
1 1246 . 1 1 1 A 110 110 THR HA H 110 3.541 3.900 -0.359 1
1 1251 . 1 1 1 A 110 110 THR C C 110 175.477 176.114 -0.637 1
1 1252 . 1 1 1 A 110 110 THR CA C 110 66.443 67.156 -0.713 1
1 1253 . 1 1 1 A 110 110 THR CB C 110 68.091 68.376 -0.285 1
1 1255 . 1 1 1 A 111 111 ASP H H 111 8.224 8.332 -0.108 1
1 1256 . 1 1 1 A 111 111 ASP HA H 111 4.237 4.246 -0.009 1
1 1259 . 1 1 1 A 111 111 ASP C C 111 177.520 178.197 -0.677 1
1 1260 . 1 1 1 A 111 111 ASP CA C 111 57.559 56.992 0.567 1
1 1261 . 1 1 1 A 111 111 ASP CB C 111 40.292 41.090 -0.798 1
1 1262 . 1 1 1 A 111 111 ASP N N 111 119.490 121.275 -1.785 1
1 1263 . 1 1 1 A 112 112 ALA H H 112 7.431 7.888 -0.457 1
1 1264 . 1 1 1 A 112 112 ALA HA H 112 4.191 4.056 0.135 1
1 1268 . 1 1 1 A 112 112 ALA C C 112 180.646 179.644 1.002 1
1 1269 . 1 1 1 A 112 112 ALA CA C 112 54.534 54.969 -0.435 1
1 1270 . 1 1 1 A 112 112 ALA CB C 112 18.992 18.164 0.828 1
1 1271 . 1 1 1 A 112 112 ALA N N 112 119.710 120.699 -0.989 1
1 1272 . 1 1 1 A 113 113 GLN H H 113 7.576 8.099 -0.523 1
1 1273 . 1 1 1 A 113 113 GLN HA H 113 3.562 3.906 -0.344 1
1 1278 . 1 1 1 A 113 113 GLN C C 113 176.756 177.490 -0.734 1
1 1279 . 1 1 1 A 113 113 GLN CA C 113 57.736 58.493 -0.757 1
1 1280 . 1 1 1 A 113 113 GLN CB C 113 29.110 28.347 0.763 1
1 1281 . 1 1 1 A 113 113 GLN N N 113 117.518 118.775 -1.257 1
1 1283 . 1 1 1 A 114 114 MET H H 114 8.192 7.917 0.275 1
1 1284 . 1 1 1 A 114 114 MET HA H 114 4.231 3.654 0.577 1
1 1289 . 1 1 1 A 114 114 MET C C 114 175.648 177.243 -1.595 1
1 1290 . 1 1 1 A 114 114 MET CA C 114 57.446 57.188 0.258 1
1 1291 . 1 1 1 A 114 114 MET CB C 114 33.570 32.237 1.333 1
1 1293 . 1 1 1 A 114 114 MET N N 114 111.509 118.801 -7.292 1
1 1294 . 1 1 1 A 115 115 GLN H H 115 6.940 7.105 -0.165 1
1 1295 . 1 1 1 A 115 115 GLN HA H 115 4.307 4.279 0.028 1
1 1302 . 1 1 1 A 115 115 GLN C C 115 176.270 176.179 0.091 1
1 1303 . 1 1 1 A 115 115 GLN CA C 115 54.680 55.611 -0.931 1
1 1304 . 1 1 1 A 115 115 GLN CB C 115 28.233 29.347 -1.114 1
1 1306 . 1 1 1 A 115 115 GLN N N 115 114.300 116.963 -2.663 1
1 1308 . 1 1 1 A 116 116 TYR H H 116 6.677 7.954 -1.277 1
1 1309 . 1 1 1 A 116 116 TYR HA H 116 4.193 4.670 -0.477 1
1 1312 . 1 1 1 A 116 116 TYR C C 116 175.268 173.536 1.732 1
1 1313 . 1 1 1 A 116 116 TYR CA C 116 54.357 60.077 -5.720 1
1 1314 . 1 1 1 A 116 116 TYR CB C 116 35.498 37.233 -1.735 1
1 1315 . 1 1 1 A 116 116 TYR N N 116 117.919 117.886 0.033 1
1 1316 . 1 1 1 A 117 117 ASP H H 117 8.081 9.142 -1.061 1
1 1317 . 1 1 1 A 117 117 ASP HA H 117 4.665 5.257 -0.592 1
1 1320 . 1 1 1 A 117 117 ASP CA C 117 52.422 51.146 1.276 1
1 1321 . 1 1 1 A 117 117 ASP CB C 117 42.416 44.214 -1.798 1
1 1322 . 1 1 1 A 117 117 ASP N N 117 120.887 119.416 1.471 1
1 1323 . 1 1 1 A 118 118 PRO C C 118 179.180 177.858 1.322 1
1 1324 . 1 1 1 A 118 118 PRO CA C 118 65.942 65.462 0.480 1
1 1325 . 1 1 1 A 118 118 PRO CB C 118 32.197 31.899 0.298 1
1 1326 . 1 1 1 A 119 119 GLY H H 119 9.742 8.305 1.437 1
1 1327 . 1 1 1 A 119 119 GLY C C 119 175.622 175.134 0.488 1
1 1328 . 1 1 1 A 119 119 GLY CA C 119 46.785 45.772 1.013 1
1 1329 . 1 1 1 A 119 119 GLY N N 119 106.412 105.555 0.857 1
1 1330 . 1 1 1 A 120 120 LEU H H 120 6.666 7.554 -0.888 1
1 1331 . 1 1 1 A 120 120 LEU HA H 120 3.365 3.825 -0.460 1
1 1341 . 1 1 1 A 120 120 LEU C C 120 179.262 178.240 1.022 1
1 1342 . 1 1 1 A 120 120 LEU CA C 120 56.605 57.016 -0.411 1
1 1343 . 1 1 1 A 120 120 LEU CB C 120 39.262 41.748 -2.486 1
1 1347 . 1 1 1 A 120 120 LEU N N 120 126.226 122.286 3.940 1
1 1348 . 1 1 1 A 121 121 PHE H H 121 7.356 9.034 -1.678 1
1 1349 . 1 1 1 A 121 121 PHE HA H 121 4.459 4.070 0.389 1
1 1352 . 1 1 1 A 121 121 PHE C C 121 179.716 177.298 2.418 1
1 1353 . 1 1 1 A 121 121 PHE CA C 121 62.838 62.244 0.594 1
1 1354 . 1 1 1 A 121 121 PHE CB C 121 37.603 39.129 -1.526 1
1 1355 . 1 1 1 A 121 121 PHE N N 121 117.437 119.425 -1.988 1
1 1356 . 1 1 1 A 122 122 ALA H H 122 7.926 7.969 -0.043 1
1 1357 . 1 1 1 A 122 122 ALA HA H 122 4.523 3.747 0.776 1
1 1361 . 1 1 1 A 122 122 ALA C C 122 180.435 179.857 0.578 1
1 1362 . 1 1 1 A 122 122 ALA CA C 122 55.527 55.353 0.174 1
1 1363 . 1 1 1 A 122 122 ALA CB C 122 17.814 17.912 -0.098 1
1 1364 . 1 1 1 A 122 122 ALA N N 122 121.068 121.341 -0.273 1
1 1365 . 1 1 1 A 123 123 GLN H H 123 7.507 7.612 -0.105 1
1 1366 . 1 1 1 A 123 123 GLN HA H 123 4.153 3.982 0.171 1
1 1371 . 1 1 1 A 123 123 GLN C C 123 180.561 178.312 2.249 1
1 1372 . 1 1 1 A 123 123 GLN CA C 123 59.948 58.892 1.056 1
1 1373 . 1 1 1 A 123 123 GLN CB C 123 29.135 28.000 1.135 1
1 1375 . 1 1 1 A 123 123 GLN N N 123 120.324 117.333 2.991 1
1 1376 . 1 1 1 A 124 124 ILE H H 124 8.318 8.127 0.191 1
1 1377 . 1 1 1 A 124 124 ILE HA H 124 3.635 3.895 -0.260 1
1 1387 . 1 1 1 A 124 124 ILE C C 124 176.481 178.122 -1.641 1
1 1388 . 1 1 1 A 124 124 ILE CA C 124 66.432 64.000 2.432 1
1 1389 . 1 1 1 A 124 124 ILE CB C 124 39.168 37.659 1.509 1
1 1393 . 1 1 1 A 124 124 ILE N N 124 123.747 119.387 4.360 1
1 1394 . 1 1 1 A 125 125 GLN H H 125 8.474 8.227 0.247 1
1 1395 . 1 1 1 A 125 125 GLN HA H 125 4.264 3.994 0.270 1
1 1402 . 1 1 1 A 125 125 GLN C C 125 178.947 177.875 1.072 1
1 1403 . 1 1 1 A 125 125 GLN CA C 125 59.651 58.450 1.201 1
1 1404 . 1 1 1 A 125 125 GLN CB C 125 28.880 28.456 0.424 1
1 1406 . 1 1 1 A 125 125 GLN N N 125 120.368 121.337 -0.969 1
1 1408 . 1 1 1 A 126 126 ALA H H 126 8.002 7.972 0.030 1
1 1409 . 1 1 1 A 126 126 ALA HA H 126 4.144 4.005 0.139 1
1 1413 . 1 1 1 A 126 126 ALA C C 126 179.316 179.943 -0.627 1
1 1414 . 1 1 1 A 126 126 ALA CA C 126 55.036 54.934 0.102 1
1 1415 . 1 1 1 A 126 126 ALA CB C 126 18.087 17.808 0.279 1
1 1416 . 1 1 1 A 126 126 ALA N N 126 121.661 121.229 0.432 1
1 1417 . 1 1 1 A 127 127 ALA H H 127 7.823 7.911 -0.088 1
1 1418 . 1 1 1 A 127 127 ALA HA H 127 4.162 4.045 0.117 1
1 1422 . 1 1 1 A 127 127 ALA C C 127 180.707 179.479 1.228 1
1 1423 . 1 1 1 A 127 127 ALA CA C 127 55.080 54.836 0.244 1
1 1424 . 1 1 1 A 127 127 ALA CB C 127 19.354 18.242 1.112 1
1 1425 . 1 1 1 A 127 127 ALA N N 127 119.853 119.630 0.223 1
1 1426 . 1 1 1 A 128 128 ALA H H 128 8.936 8.020 0.916 1
1 1427 . 1 1 1 A 128 128 ALA HA H 128 3.928 3.840 0.088 1
1 1431 . 1 1 1 A 128 128 ALA C C 128 181.031 179.342 1.689 1
1 1432 . 1 1 1 A 128 128 ALA CA C 128 55.502 54.753 0.749 1
1 1433 . 1 1 1 A 128 128 ALA CB C 128 16.609 17.965 -1.356 1
1 1434 . 1 1 1 A 128 128 ALA N N 128 121.355 120.348 1.007 1
1 1435 . 1 1 1 A 129 129 THR H H 129 8.543 7.419 1.124 1
1 1436 . 1 1 1 A 129 129 THR HA H 129 4.015 3.647 0.368 1
1 1441 . 1 1 1 A 129 129 THR C C 129 177.332 176.145 1.187 1
1 1442 . 1 1 1 A 129 129 THR CA C 129 65.893 64.939 0.954 1
1 1443 . 1 1 1 A 129 129 THR CB C 129 68.566 68.462 0.104 1
1 1445 . 1 1 1 A 129 129 THR N N 129 112.709 112.299 0.410 1
1 1446 . 1 1 1 A 130 130 LYS H H 130 8.126 7.477 0.649 1
1 1447 . 1 1 1 A 130 130 LYS HA H 130 4.000 3.899 0.101 1
1 1456 . 1 1 1 A 130 130 LYS C C 130 179.082 178.264 0.818 1
1 1457 . 1 1 1 A 130 130 LYS CA C 130 60.299 59.318 0.981 1
1 1458 . 1 1 1 A 130 130 LYS CB C 130 32.767 32.505 0.262 1
1 1462 . 1 1 1 A 130 130 LYS N N 130 123.879 120.359 3.520 1
1 1463 . 1 1 1 A 131 131 ALA H H 131 7.184 7.923 -0.739 1
1 1464 . 1 1 1 A 131 131 ALA HA H 131 4.005 4.198 -0.193 1
1 1468 . 1 1 1 A 131 131 ALA C C 131 178.482 179.508 -1.026 1
1 1469 . 1 1 1 A 131 131 ALA CA C 131 55.027 55.257 -0.230 1
1 1470 . 1 1 1 A 131 131 ALA CB C 131 18.669 18.999 -0.330 1
1 1471 . 1 1 1 A 131 131 ALA N N 131 118.590 120.456 -1.866 1
1 1472 . 1 1 1 A 132 132 TRP H H 132 7.977 8.622 -0.645 1
1 1473 . 1 1 1 A 132 132 TRP HA H 132 4.001 4.213 -0.212 1
1 1480 . 1 1 1 A 132 132 TRP C C 132 177.332 175.819 1.513 1
1 1481 . 1 1 1 A 132 132 TRP CA C 132 60.431 57.381 3.050 1
1 1482 . 1 1 1 A 132 132 TRP CB C 132 27.786 27.576 0.210 1
1 1486 . 1 1 1 A 132 132 TRP N N 132 119.168 116.927 2.241 1
1 1488 . 1 1 1 A 133 133 ARG H H 133 8.006 8.136 -0.130 1
1 1489 . 1 1 1 A 133 133 ARG HA H 133 4.027 4.388 -0.361 1
1 1497 . 1 1 1 A 133 133 ARG C C 133 176.664 177.817 -1.153 1
1 1498 . 1 1 1 A 133 133 ARG CA C 133 59.355 57.285 2.070 1
1 1499 . 1 1 1 A 133 133 ARG CB C 133 30.451 32.359 -1.908 1
1 1502 . 1 1 1 A 133 133 ARG N N 133 113.062 120.668 -7.606 1
1 1504 . 1 1 1 A 134 134 LYS H H 134 7.322 7.753 -0.431 1
1 1505 . 1 1 1 A 134 134 LYS HA H 134 4.313 4.403 -0.090 1
1 1514 . 1 1 1 A 134 134 LYS C C 134 176.282 175.979 0.303 1
1 1515 . 1 1 1 A 134 134 LYS CA C 134 54.922 56.443 -1.521 1
1 1516 . 1 1 1 A 134 134 LYS CB C 134 32.633 31.611 1.022 1
1 1520 . 1 1 1 A 134 134 LYS N N 134 118.170 119.240 -1.070 1
1 1521 . 1 1 1 A 135 135 LEU H H 135 7.440 7.902 -0.462 1
1 1522 . 1 1 1 A 135 135 LEU HA H 135 4.174 4.530 -0.356 1
1 1532 . 1 1 1 A 135 135 LEU CA C 135 54.408 52.509 1.899 1
1 1533 . 1 1 1 A 135 135 LEU CB C 135 40.407 41.708 -1.301 1
1 1537 . 1 1 1 A 135 135 LEU N N 135 123.358 121.683 1.675 1
1 1538 . 1 1 1 A 136 136 PRO HA H 136 4.437 4.510 -0.073 1
1 1545 . 1 1 1 A 136 136 PRO C C 136 177.106 176.732 0.374 1
1 1546 . 1 1 1 A 136 136 PRO CA C 136 62.889 65.041 -2.152 1
1 1547 . 1 1 1 A 136 136 PRO CB C 136 32.192 32.151 0.041 1
1 1550 . 1 1 1 A 137 137 VAL H H 137 8.219 7.575 0.644 1
1 1551 . 1 1 1 A 137 137 VAL HA H 137 4.077 4.864 -0.787 1
1 1559 . 1 1 1 A 137 137 VAL C C 137 176.305 174.833 1.472 1
1 1560 . 1 1 1 A 137 137 VAL CA C 137 61.958 60.286 1.672 1
1 1561 . 1 1 1 A 137 137 VAL CB C 137 32.755 36.148 -3.393 1
1 1564 . 1 1 1 A 137 137 VAL N N 137 120.079 116.613 3.466 1
1 1565 . 1 1 1 A 138 138 LYS H H 138 8.444 8.754 -0.310 1
1 1566 . 1 1 1 A 138 138 LYS HA H 138 4.316 5.068 -0.752 1
1 1575 . 1 1 1 A 138 138 LYS C C 138 176.790 175.006 1.784 1
1 1576 . 1 1 1 A 138 138 LYS CA C 138 56.792 54.300 2.492 1
1 1577 . 1 1 1 A 138 138 LYS CB C 138 33.205 36.229 -3.024 1
1 1581 . 1 1 1 A 138 138 LYS N N 138 126.449 121.224 5.225 1
1 1582 . 1 1 1 A 139 139 GLY H H 139 8.518 8.522 -0.004 1
1 1583 . 1 1 1 A 139 139 GLY HA2 H 139 4.070 4.182 -0.112 1
1 1584 . 1 1 1 A 139 139 GLY HA3 H 139 3.897 4.184 -0.287 1
1 1585 . 1 1 1 A 139 139 GLY C C 139 172.874 172.987 -0.113 1
1 1586 . 1 1 1 A 139 139 GLY CA C 139 45.157 44.527 0.630 1
1 1587 . 1 1 1 A 139 139 GLY N N 139 112.617 107.846 4.771 1
1 6 . 2 1 1 A 2 2 VAL H H 2 8.992 9.512 -0.520 1
1 7 . 2 1 1 A 2 2 VAL HA H 2 5.370 4.759 0.611 1
1 15 . 2 1 1 A 2 2 VAL C C 2 174.325 174.843 -0.518 1
1 16 . 2 1 1 A 2 2 VAL CA C 2 61.267 61.397 -0.130 1
1 17 . 2 1 1 A 2 2 VAL CB C 2 33.890 33.903 -0.013 1
1 20 . 2 1 1 A 2 2 VAL N N 2 126.939 120.409 6.530 1
1 21 . 2 1 1 A 3 3 THR H H 3 8.912 8.713 0.199 1
1 22 . 2 1 1 A 3 3 THR HA H 3 4.505 5.607 -1.102 1
1 27 . 2 1 1 A 3 3 THR C C 3 172.710 172.592 0.118 1
1 28 . 2 1 1 A 3 3 THR CA C 3 59.689 59.693 -0.004 1
1 29 . 2 1 1 A 3 3 THR CB C 3 72.398 72.221 0.177 1
1 31 . 2 1 1 A 3 3 THR N N 3 118.091 122.193 -4.102 1
1 32 . 2 1 1 A 4 4 GLU H H 4 8.631 9.036 -0.405 1
1 33 . 2 1 1 A 4 4 GLU HA H 4 5.788 4.833 0.955 1
1 38 . 2 1 1 A 4 4 GLU C C 4 175.758 174.138 1.620 1
1 39 . 2 1 1 A 4 4 GLU CA C 4 54.902 54.301 0.601 1
1 40 . 2 1 1 A 4 4 GLU CB C 4 35.097 33.283 1.814 1
1 42 . 2 1 1 A 4 4 GLU N N 4 120.966 125.242 -4.276 1
1 43 . 2 1 1 A 5 5 THR H H 5 9.188 8.357 0.831 1
1 44 . 2 1 1 A 5 5 THR HA H 5 4.739 4.854 -0.115 1
1 49 . 2 1 1 A 5 5 THR C C 5 172.757 172.521 0.236 1
1 50 . 2 1 1 A 5 5 THR CA C 5 60.382 60.205 0.177 1
1 51 . 2 1 1 A 5 5 THR CB C 5 71.558 70.997 0.561 1
1 53 . 2 1 1 A 5 5 THR N N 5 119.366 114.798 4.568 1
1 54 . 2 1 1 A 6 6 VAL H H 6 8.476 8.825 -0.349 1
1 55 . 2 1 1 A 6 6 VAL HA H 6 5.026 5.551 -0.525 1
1 63 . 2 1 1 A 6 6 VAL C C 6 176.674 174.216 2.458 1
1 64 . 2 1 1 A 6 6 VAL CA C 6 61.008 60.175 0.833 1
1 65 . 2 1 1 A 6 6 VAL CB C 6 33.861 34.470 -0.609 1
1 68 . 2 1 1 A 6 6 VAL N N 6 121.384 120.193 1.191 1
1 69 . 2 1 1 A 7 7 ASP H H 7 8.848 8.698 0.150 1
1 70 . 2 1 1 A 7 7 ASP HA H 7 4.797 4.816 -0.019 1
1 73 . 2 1 1 A 7 7 ASP CA C 7 52.834 54.868 -2.034 1
1 74 . 2 1 1 A 7 7 ASP CB C 7 42.219 42.544 -0.325 1
1 75 . 2 1 1 A 7 7 ASP N N 7 127.061 127.193 -0.132 1
1 76 . 2 1 1 A 8 8 GLY C C 8 175.143 175.007 0.136 1
1 77 . 2 1 1 A 8 8 GLY CA C 8 46.553 47.013 -0.460 1
1 78 . 2 1 1 A 9 9 GLN H H 9 8.408 8.093 0.315 1
1 79 . 2 1 1 A 9 9 GLN HA H 9 4.541 4.223 0.318 1
1 86 . 2 1 1 A 9 9 GLN C C 9 176.463 176.664 -0.201 1
1 87 . 2 1 1 A 9 9 GLN CA C 9 55.167 55.341 -0.174 1
1 88 . 2 1 1 A 9 9 GLN CB C 9 29.376 27.803 1.573 1
1 90 . 2 1 1 A 9 9 GLN N N 9 118.300 116.866 1.434 1
1 92 . 2 1 1 A 10 10 GLY H H 10 8.162 8.341 -0.179 1
1 93 . 2 1 1 A 10 10 GLY HA2 H 10 4.174 3.885 0.289 1
1 94 . 2 1 1 A 10 10 GLY HA3 H 10 3.521 3.898 -0.377 1
1 95 . 2 1 1 A 10 10 GLY C C 10 174.092 173.994 0.098 1
1 96 . 2 1 1 A 10 10 GLY CA C 10 45.558 46.286 -0.728 1
1 97 . 2 1 1 A 10 10 GLY N N 10 108.747 111.049 -2.302 1
1 98 . 2 1 1 A 11 11 GLN H H 11 8.507 7.723 0.784 1
1 99 . 2 1 1 A 11 11 GLN HA H 11 4.202 4.858 -0.656 1
1 106 . 2 1 1 A 11 11 GLN C C 11 173.992 174.502 -0.510 1
1 107 . 2 1 1 A 11 11 GLN CA C 11 55.098 53.904 1.194 1
1 108 . 2 1 1 A 11 11 GLN CB C 11 29.097 31.672 -2.575 1
1 110 . 2 1 1 A 11 11 GLN N N 11 122.979 116.097 6.882 1
1 112 . 2 1 1 A 12 12 ALA H H 12 8.259 8.681 -0.422 1
1 113 . 2 1 1 A 12 12 ALA HA H 12 5.156 5.568 -0.412 1
1 117 . 2 1 1 A 12 12 ALA C C 12 177.284 176.340 0.944 1
1 118 . 2 1 1 A 12 12 ALA CA C 12 51.087 50.665 0.422 1
1 119 . 2 1 1 A 12 12 ALA CB C 12 20.500 21.744 -1.244 1
1 120 . 2 1 1 A 12 12 ALA N N 12 127.100 122.102 4.998 1
1 121 . 2 1 1 A 13 13 TRP H H 13 9.245 8.930 0.315 1
1 122 . 2 1 1 A 13 13 TRP HA H 13 4.717 5.370 -0.653 1
1 131 . 2 1 1 A 13 13 TRP C C 13 175.108 174.289 0.819 1
1 132 . 2 1 1 A 13 13 TRP CA C 13 55.966 55.489 0.477 1
1 133 . 2 1 1 A 13 13 TRP CB C 13 31.912 32.173 -0.261 1
1 139 . 2 1 1 A 13 13 TRP N N 13 123.088 119.614 3.474 1
1 141 . 2 1 1 A 14 14 ARG H H 14 8.575 8.687 -0.112 1
1 142 . 2 1 1 A 14 14 ARG HA H 14 5.335 4.325 1.010 1
1 150 . 2 1 1 A 14 14 ARG C C 14 175.191 173.990 1.201 1
1 151 . 2 1 1 A 14 14 ARG CA C 14 53.106 55.039 -1.933 1
1 152 . 2 1 1 A 14 14 ARG CB C 14 32.749 31.506 1.243 1
1 154 . 2 1 1 A 14 14 ARG N N 14 121.163 120.057 1.106 1
1 156 . 2 1 1 A 15 15 HIS H H 15 8.595 7.911 0.684 1
1 157 . 2 1 1 A 15 15 HIS HA H 15 4.790 5.044 -0.254 1
1 161 . 2 1 1 A 15 15 HIS C C 15 173.770 175.144 -1.374 1
1 162 . 2 1 1 A 15 15 HIS CA C 15 55.289 54.744 0.545 1
1 163 . 2 1 1 A 15 15 HIS CB C 15 33.208 33.265 -0.057 1
1 165 . 2 1 1 A 15 15 HIS N N 15 117.643 118.653 -1.010 1
1 166 . 2 1 1 A 16 16 HIS H H 16 8.993 8.945 0.048 1
1 167 . 2 1 1 A 16 16 HIS HA H 16 5.158 4.976 0.182 1
1 171 . 2 1 1 A 16 16 HIS C C 16 173.608 173.869 -0.261 1
1 172 . 2 1 1 A 16 16 HIS CA C 16 56.450 54.581 1.869 1
1 173 . 2 1 1 A 16 16 HIS CB C 16 34.171 31.232 2.939 1
1 175 . 2 1 1 A 16 16 HIS N N 16 123.520 120.140 3.380 1
1 176 . 2 1 1 A 17 17 ASN H H 17 7.829 9.315 -1.486 1
1 177 . 2 1 1 A 17 17 ASN HA H 17 4.713 5.164 -0.451 1
1 182 . 2 1 1 A 17 17 ASN C C 17 173.682 174.055 -0.373 1
1 183 . 2 1 1 A 17 17 ASN CA C 17 51.822 51.557 0.265 1
1 184 . 2 1 1 A 17 17 ASN CB C 17 43.176 42.788 0.388 1
1 185 . 2 1 1 A 17 17 ASN N N 17 122.213 118.037 4.176 1
1 187 . 2 1 1 A 18 18 GLY H H 18 8.423 8.497 -0.074 1
1 188 . 2 1 1 A 18 18 GLY HA2 H 18 3.931 3.890 0.041 1
1 189 . 2 1 1 A 18 18 GLY HA3 H 18 3.707 4.025 -0.318 1
1 190 . 2 1 1 A 18 18 GLY C C 18 173.985 172.943 1.042 1
1 191 . 2 1 1 A 18 18 GLY CA C 18 43.949 45.037 -1.088 1
1 192 . 2 1 1 A 18 18 GLY N N 18 106.991 110.609 -3.618 1
1 193 . 2 1 1 A 19 19 PHE H H 19 8.338 8.702 -0.364 1
1 194 . 2 1 1 A 19 19 PHE HA H 19 4.068 4.740 -0.672 1
1 197 . 2 1 1 A 19 19 PHE C C 19 176.568 175.678 0.890 1
1 198 . 2 1 1 A 19 19 PHE CA C 19 59.338 58.568 0.770 1
1 199 . 2 1 1 A 19 19 PHE CB C 19 40.201 39.859 0.342 1
1 200 . 2 1 1 A 19 19 PHE N N 19 116.857 118.912 -2.055 1
1 201 . 2 1 1 A 20 20 ASP H H 20 8.794 8.579 0.215 1
1 202 . 2 1 1 A 20 20 ASP HA H 20 4.485 4.818 -0.333 1
1 205 . 2 1 1 A 20 20 ASP C C 20 177.379 177.010 0.369 1
1 206 . 2 1 1 A 20 20 ASP CA C 20 54.140 54.252 -0.112 1
1 207 . 2 1 1 A 20 20 ASP CB C 20 41.915 42.014 -0.099 1
1 208 . 2 1 1 A 20 20 ASP N N 20 123.025 123.799 -0.774 1
1 209 . 2 1 1 A 21 21 PHE H H 21 8.862 9.148 -0.286 1
1 210 . 2 1 1 A 21 21 PHE HA H 21 4.087 4.065 0.022 1
1 218 . 2 1 1 A 21 21 PHE C C 21 176.952 177.211 -0.259 1
1 219 . 2 1 1 A 21 21 PHE CA C 21 61.095 62.360 -1.265 1
1 220 . 2 1 1 A 21 21 PHE CB C 21 38.678 39.427 -0.749 1
1 226 . 2 1 1 A 21 21 PHE N N 21 127.163 127.536 -0.373 1
1 227 . 2 1 1 A 22 22 ALA H H 22 8.561 8.263 0.298 1
1 228 . 2 1 1 A 22 22 ALA HA H 22 3.878 3.966 -0.088 1
1 232 . 2 1 1 A 22 22 ALA C C 22 180.710 180.034 0.676 1
1 233 . 2 1 1 A 22 22 ALA CA C 22 55.211 55.162 0.049 1
1 234 . 2 1 1 A 22 22 ALA CB C 22 18.321 18.378 -0.057 1
1 235 . 2 1 1 A 22 22 ALA N N 22 120.293 120.968 -0.675 1
1 236 . 2 1 1 A 23 23 VAL H H 23 7.241 7.937 -0.696 1
1 237 . 2 1 1 A 23 23 VAL HA H 23 3.684 3.466 0.218 1
1 245 . 2 1 1 A 23 23 VAL C C 23 177.101 178.050 -0.949 1
1 246 . 2 1 1 A 23 23 VAL CA C 23 65.237 66.900 -1.663 1
1 247 . 2 1 1 A 23 23 VAL CB C 23 31.780 31.570 0.210 1
1 250 . 2 1 1 A 23 23 VAL N N 23 118.775 117.663 1.112 1
1 251 . 2 1 1 A 24 24 ILE H H 24 6.761 7.967 -1.206 1
1 252 . 2 1 1 A 24 24 ILE HA H 24 3.196 3.390 -0.194 1
1 262 . 2 1 1 A 24 24 ILE C C 24 177.287 177.893 -0.606 1
1 263 . 2 1 1 A 24 24 ILE CA C 24 63.404 65.729 -2.325 1
1 264 . 2 1 1 A 24 24 ILE CB C 24 36.294 37.647 -1.353 1
1 268 . 2 1 1 A 24 24 ILE N N 24 119.036 119.278 -0.242 1
1 269 . 2 1 1 A 25 25 LYS H H 25 8.032 8.134 -0.102 1
1 270 . 2 1 1 A 25 25 LYS HA H 25 3.809 3.582 0.227 1
1 279 . 2 1 1 A 25 25 LYS C C 25 179.450 179.109 0.341 1
1 280 . 2 1 1 A 25 25 LYS CA C 25 59.621 59.428 0.193 1
1 281 . 2 1 1 A 25 25 LYS CB C 25 32.259 32.011 0.248 1
1 285 . 2 1 1 A 25 25 LYS N N 25 118.368 120.404 -2.036 1
1 286 . 2 1 1 A 26 26 GLU H H 26 7.845 7.985 -0.140 1
1 287 . 2 1 1 A 26 26 GLU HA H 26 4.021 4.091 -0.070 1
1 292 . 2 1 1 A 26 26 GLU C C 26 179.191 179.442 -0.251 1
1 293 . 2 1 1 A 26 26 GLU CA C 26 59.530 59.355 0.175 1
1 294 . 2 1 1 A 26 26 GLU CB C 26 29.449 29.049 0.400 1
1 296 . 2 1 1 A 26 26 GLU N N 26 120.522 119.036 1.486 1
1 297 . 2 1 1 A 27 27 LEU H H 27 8.165 7.869 0.296 1
1 298 . 2 1 1 A 27 27 LEU HA H 27 4.163 4.104 0.059 1
1 308 . 2 1 1 A 27 27 LEU C C 27 177.256 178.303 -1.047 1
1 309 . 2 1 1 A 27 27 LEU CA C 27 58.049 57.633 0.416 1
1 310 . 2 1 1 A 27 27 LEU CB C 27 41.365 41.576 -0.211 1
1 314 . 2 1 1 A 27 27 LEU N N 27 120.879 122.440 -1.561 1
1 315 . 2 1 1 A 28 28 LYS H H 28 8.902 8.250 0.652 1
1 316 . 2 1 1 A 28 28 LYS HA H 28 4.199 4.612 -0.413 1
1 317 . 2 1 1 A 28 28 LYS C C 28 179.707 179.243 0.464 1
1 318 . 2 1 1 A 28 28 LYS CA C 28 60.097 59.085 1.012 1
1 319 . 2 1 1 A 28 28 LYS CB C 28 33.420 31.924 1.496 1
1 320 . 2 1 1 A 28 28 LYS N N 28 120.050 119.510 0.540 1
1 321 . 2 1 1 A 29 29 THR H H 29 8.294 8.275 0.019 1
1 322 . 2 1 1 A 29 29 THR HA H 29 3.892 3.953 -0.061 1
1 327 . 2 1 1 A 29 29 THR C C 29 175.711 176.829 -1.118 1
1 328 . 2 1 1 A 29 29 THR CA C 29 66.846 66.555 0.291 1
1 329 . 2 1 1 A 29 29 THR CB C 29 68.794 68.731 0.063 1
1 331 . 2 1 1 A 29 29 THR N N 29 115.933 116.716 -0.783 1
1 332 . 2 1 1 A 30 30 ALA H H 30 8.244 8.740 -0.496 1
1 333 . 2 1 1 A 30 30 ALA HA H 30 4.241 4.225 0.016 1
1 337 . 2 1 1 A 30 30 ALA C C 30 179.128 179.609 -0.481 1
1 338 . 2 1 1 A 30 30 ALA CA C 30 55.714 55.371 0.343 1
1 339 . 2 1 1 A 30 30 ALA CB C 30 18.955 18.448 0.507 1
1 340 . 2 1 1 A 30 30 ALA N N 30 124.617 123.245 1.372 1
1 341 . 2 1 1 A 31 31 ALA H H 31 8.968 8.531 0.437 1
1 342 . 2 1 1 A 31 31 ALA HA H 31 3.890 4.103 -0.213 1
1 346 . 2 1 1 A 31 31 ALA C C 31 180.352 179.659 0.693 1
1 347 . 2 1 1 A 31 31 ALA CA C 31 55.454 55.382 0.072 1
1 348 . 2 1 1 A 31 31 ALA CB C 31 17.124 18.541 -1.417 1
1 349 . 2 1 1 A 31 31 ALA N N 31 119.327 120.799 -1.472 1
1 350 . 2 1 1 A 32 32 SER H H 32 7.995 7.993 0.002 1
1 351 . 2 1 1 A 32 32 SER HA H 32 4.238 4.149 0.089 1
1 354 . 2 1 1 A 32 32 SER C C 32 175.612 177.132 -1.520 1
1 355 . 2 1 1 A 32 32 SER CA C 32 61.203 61.419 -0.216 1
1 356 . 2 1 1 A 32 32 SER CB C 32 63.406 62.824 0.582 1
1 357 . 2 1 1 A 32 32 SER N N 32 111.962 112.915 -0.953 1
1 358 . 2 1 1 A 33 33 GLN H H 33 8.333 7.955 0.378 1
1 359 . 2 1 1 A 33 33 GLN HA H 33 3.992 4.213 -0.221 1
1 366 . 2 1 1 A 33 33 GLN C C 33 177.486 177.549 -0.063 1
1 367 . 2 1 1 A 33 33 GLN CA C 33 58.277 58.181 0.096 1
1 368 . 2 1 1 A 33 33 GLN CB C 33 29.140 29.668 -0.528 1
1 370 . 2 1 1 A 33 33 GLN N N 33 119.527 120.925 -1.398 1
1 372 . 2 1 1 A 34 34 TYR H H 34 8.587 8.201 0.386 1
1 373 . 2 1 1 A 34 34 TYR HA H 34 4.792 4.625 0.167 1
1 380 . 2 1 1 A 34 34 TYR C C 34 176.499 176.776 -0.277 1
1 381 . 2 1 1 A 34 34 TYR CA C 34 57.711 58.594 -0.883 1
1 382 . 2 1 1 A 34 34 TYR CB C 34 39.561 39.257 0.304 1
1 387 . 2 1 1 A 34 34 TYR N N 34 114.610 114.792 -0.182 1
1 388 . 2 1 1 A 35 35 GLY H H 35 7.346 8.085 -0.739 1
1 389 . 2 1 1 A 35 35 GLY HA2 H 35 4.785 4.108 0.677 1
1 390 . 2 1 1 A 35 35 GLY HA3 H 35 4.007 4.110 -0.103 1
1 391 . 2 1 1 A 35 35 GLY C C 35 175.796 173.291 2.505 1
1 392 . 2 1 1 A 35 35 GLY CA C 35 44.355 44.894 -0.539 1
1 393 . 2 1 1 A 35 35 GLY N N 35 108.501 106.781 1.720 1
1 394 . 2 1 1 A 36 36 ALA H H 36 9.363 8.269 1.094 1
1 395 . 2 1 1 A 36 36 ALA HA H 36 4.217 4.608 -0.391 1
1 399 . 2 1 1 A 36 36 ALA C C 36 178.039 177.591 0.448 1
1 400 . 2 1 1 A 36 36 ALA CA C 36 56.114 51.634 4.480 1
1 401 . 2 1 1 A 36 36 ALA CB C 36 19.179 18.788 0.391 1
1 402 . 2 1 1 A 36 36 ALA N N 36 125.811 123.282 2.529 1
1 403 . 2 1 1 A 37 37 THR H H 37 8.070 8.447 -0.377 1
1 404 . 2 1 1 A 37 37 THR HA H 37 4.570 4.568 0.002 1
1 409 . 2 1 1 A 37 37 THR C C 37 173.685 174.240 -0.555 1
1 410 . 2 1 1 A 37 37 THR CA C 37 59.822 62.801 -2.979 1
1 411 . 2 1 1 A 37 37 THR CB C 37 68.267 71.340 -3.073 1
1 413 . 2 1 1 A 37 37 THR N N 37 129.410 118.006 11.404 1
1 414 . 2 1 1 A 38 38 ALA H H 38 6.853 7.421 -0.568 1
1 415 . 2 1 1 A 38 38 ALA HA H 38 4.601 4.586 0.015 1
1 419 . 2 1 1 A 38 38 ALA CA C 38 50.758 50.774 -0.016 1
1 420 . 2 1 1 A 38 38 ALA CB C 38 18.325 19.288 -0.963 1
1 421 . 2 1 1 A 38 38 ALA N N 38 124.674 123.349 1.325 1
1 422 . 2 1 1 A 40 40 TYR HA H 40 4.032 4.004 0.028 1
1 429 . 2 1 1 A 40 40 TYR C C 40 176.456 177.289 -0.833 1
1 430 . 2 1 1 A 40 40 TYR CA C 40 61.010 61.869 -0.859 1
1 431 . 2 1 1 A 40 40 TYR CB C 40 39.286 38.654 0.632 1
1 436 . 2 1 1 A 41 41 THR H H 41 6.874 8.304 -1.430 1
1 437 . 2 1 1 A 41 41 THR HA H 41 3.616 3.780 -0.164 1
1 442 . 2 1 1 A 41 41 THR C C 41 176.930 176.545 0.385 1
1 443 . 2 1 1 A 41 41 THR CA C 41 65.557 65.625 -0.068 1
1 444 . 2 1 1 A 41 41 THR CB C 41 68.228 69.306 -1.078 1
1 446 . 2 1 1 A 41 41 THR N N 41 115.143 113.815 1.328 1
1 447 . 2 1 1 A 42 42 LEU H H 42 8.623 7.869 0.754 1
1 448 . 2 1 1 A 42 42 LEU HA H 42 3.708 3.987 -0.279 1
1 458 . 2 1 1 A 42 42 LEU C C 42 178.206 178.994 -0.788 1
1 459 . 2 1 1 A 42 42 LEU CA C 42 57.417 57.838 -0.421 1
1 460 . 2 1 1 A 42 42 LEU CB C 42 41.342 41.154 0.188 1
1 464 . 2 1 1 A 42 42 LEU N N 42 120.418 118.225 2.193 1
1 465 . 2 1 1 A 43 43 ALA H H 43 7.735 7.776 -0.041 1
1 466 . 2 1 1 A 43 43 ALA HA H 43 4.020 3.999 0.021 1
1 470 . 2 1 1 A 43 43 ALA C C 43 180.826 180.330 0.496 1
1 471 . 2 1 1 A 43 43 ALA CA C 43 54.925 54.827 0.098 1
1 472 . 2 1 1 A 43 43 ALA CB C 43 17.506 18.229 -0.723 1
1 473 . 2 1 1 A 43 43 ALA N N 43 120.203 121.691 -1.488 1
1 474 . 2 1 1 A 44 44 ILE H H 44 7.149 7.397 -0.248 1
1 475 . 2 1 1 A 44 44 ILE HA H 44 3.603 3.569 0.034 1
1 485 . 2 1 1 A 44 44 ILE C C 44 178.594 178.316 0.278 1
1 486 . 2 1 1 A 44 44 ILE CA C 44 64.782 64.101 0.681 1
1 487 . 2 1 1 A 44 44 ILE CB C 44 37.472 37.005 0.467 1
1 491 . 2 1 1 A 44 44 ILE N N 44 118.881 119.401 -0.520 1
1 492 . 2 1 1 A 45 45 VAL H H 45 7.968 7.903 0.065 1
1 493 . 2 1 1 A 45 45 VAL HA H 45 2.925 3.326 -0.401 1
1 501 . 2 1 1 A 45 45 VAL C C 45 177.023 177.385 -0.362 1
1 502 . 2 1 1 A 45 45 VAL CA C 45 67.081 66.854 0.227 1
1 503 . 2 1 1 A 45 45 VAL CB C 45 30.854 30.946 -0.092 1
1 506 . 2 1 1 A 45 45 VAL N N 45 120.764 119.936 0.828 1
1 507 . 2 1 1 A 46 46 GLU H H 46 8.399 8.097 0.302 1
1 508 . 2 1 1 A 46 46 GLU HA H 46 3.848 3.961 -0.113 1
1 513 . 2 1 1 A 46 46 GLU C C 46 178.656 179.148 -0.492 1
1 514 . 2 1 1 A 46 46 GLU CA C 46 59.491 59.085 0.406 1
1 515 . 2 1 1 A 46 46 GLU CB C 46 28.991 28.573 0.418 1
1 517 . 2 1 1 A 46 46 GLU N N 46 116.599 119.743 -3.144 1
1 518 . 2 1 1 A 47 47 SER H H 47 7.273 7.489 -0.216 1
1 519 . 2 1 1 A 47 47 SER HA H 47 4.287 4.144 0.143 1
1 521 . 2 1 1 A 47 47 SER CA C 47 61.047 61.381 -0.334 1
1 522 . 2 1 1 A 47 47 SER CB C 47 63.016 62.750 0.266 1
1 523 . 2 1 1 A 47 47 SER N N 47 113.609 115.911 -2.302 1
1 524 . 2 1 1 A 48 48 VAL H H 48 8.006 7.826 0.180 1
1 525 . 2 1 1 A 48 48 VAL HA H 48 3.556 3.425 0.131 1
1 533 . 2 1 1 A 48 48 VAL C C 48 177.257 178.188 -0.931 1
1 534 . 2 1 1 A 48 48 VAL CA C 48 65.025 66.176 -1.151 1
1 535 . 2 1 1 A 48 48 VAL CB C 48 31.841 31.210 0.631 1
1 538 . 2 1 1 A 48 48 VAL N N 48 122.327 121.086 1.241 1
1 539 . 2 1 1 A 49 49 ALA H H 49 8.369 7.564 0.805 1
1 540 . 2 1 1 A 49 49 ALA HA H 49 4.115 3.895 0.220 1
1 544 . 2 1 1 A 49 49 ALA C C 49 177.307 178.196 -0.889 1
1 545 . 2 1 1 A 49 49 ALA CA C 49 53.253 54.098 -0.845 1
1 546 . 2 1 1 A 49 49 ALA CB C 49 20.131 18.279 1.852 1
1 547 . 2 1 1 A 49 49 ALA N N 49 118.050 120.988 -2.938 1
1 548 . 2 1 1 A 50 50 ASP H H 50 7.052 7.680 -0.628 1
1 549 . 2 1 1 A 50 50 ASP HA H 50 4.788 4.588 0.200 1
1 552 . 2 1 1 A 50 50 ASP C C 50 175.481 175.484 -0.003 1
1 553 . 2 1 1 A 50 50 ASP CA C 50 53.681 54.354 -0.673 1
1 554 . 2 1 1 A 50 50 ASP CB C 50 39.333 41.043 -1.710 1
1 555 . 2 1 1 A 50 50 ASP N N 50 116.997 117.120 -0.123 1
1 556 . 2 1 1 A 51 51 ASN H H 51 8.535 7.541 0.994 1
1 557 . 2 1 1 A 51 51 ASN HA H 51 4.628 4.689 -0.061 1
1 562 . 2 1 1 A 51 51 ASN C C 51 174.077 174.690 -0.613 1
1 563 . 2 1 1 A 51 51 ASN CA C 51 52.315 51.922 0.393 1
1 564 . 2 1 1 A 51 51 ASN CB C 51 41.928 41.996 -0.068 1
1 565 . 2 1 1 A 51 51 ASN N N 51 118.626 116.835 1.791 1
1 567 . 2 1 1 A 52 52 TRP H H 52 8.555 8.637 -0.082 1
1 574 . 2 1 1 A 52 52 TRP C C 52 173.269 176.694 -3.425 1
1 575 . 2 1 1 A 52 52 TRP CA C 52 55.031 56.748 -1.717 1
1 576 . 2 1 1 A 52 52 TRP CB C 52 26.801 30.916 -4.115 1
1 582 . 2 1 1 A 52 52 TRP N N 52 120.693 120.924 -0.231 1
1 584 . 2 1 1 A 53 53 LEU H H 53 7.847 9.174 -1.327 1
1 585 . 2 1 1 A 53 53 LEU HA H 53 4.859 5.091 -0.232 1
1 595 . 2 1 1 A 53 53 LEU C C 53 177.397 177.039 0.358 1
1 596 . 2 1 1 A 53 53 LEU CA C 53 53.619 53.735 -0.116 1
1 597 . 2 1 1 A 53 53 LEU CB C 53 41.812 45.822 -4.010 1
1 601 . 2 1 1 A 53 53 LEU N N 53 124.741 125.028 -0.287 1
1 602 . 2 1 1 A 54 54 THR H H 54 8.850 9.089 -0.239 1
1 603 . 2 1 1 A 54 54 THR HA H 54 4.598 5.401 -0.803 1
1 608 . 2 1 1 A 54 54 THR CA C 54 60.531 60.329 0.202 1
1 609 . 2 1 1 A 54 54 THR CB C 54 67.183 68.907 -1.724 1
1 611 . 2 1 1 A 54 54 THR N N 54 113.407 116.455 -3.048 1
1 612 . 2 1 1 A 55 55 PRO HA H 55 4.511 4.331 0.180 1
1 619 . 2 1 1 A 55 55 PRO C C 55 179.383 178.994 0.389 1
1 620 . 2 1 1 A 55 55 PRO CA C 55 67.159 65.573 1.586 1
1 621 . 2 1 1 A 55 55 PRO CB C 55 32.095 31.644 0.451 1
1 622 . 2 1 1 A 56 56 THR H H 56 8.575 8.059 0.516 1
1 623 . 2 1 1 A 56 56 THR HA H 56 4.229 4.082 0.147 1
1 628 . 2 1 1 A 56 56 THR C C 56 176.668 176.127 0.541 1
1 629 . 2 1 1 A 56 56 THR CA C 56 66.943 65.941 1.002 1
1 630 . 2 1 1 A 56 56 THR CB C 56 68.129 68.139 -0.010 1
1 632 . 2 1 1 A 56 56 THR N N 56 114.855 113.760 1.095 1
1 633 . 2 1 1 A 57 57 ASP H H 57 8.730 8.345 0.385 1
1 634 . 2 1 1 A 57 57 ASP HA H 57 4.425 4.776 -0.351 1
1 637 . 2 1 1 A 57 57 ASP C C 57 178.351 179.320 -0.969 1
1 638 . 2 1 1 A 57 57 ASP CA C 57 57.963 57.767 0.196 1
1 639 . 2 1 1 A 57 57 ASP CB C 57 40.134 40.693 -0.559 1
1 640 . 2 1 1 A 57 57 ASP N N 57 126.239 120.652 5.587 1
1 641 . 2 1 1 A 58 58 TRP H H 58 8.244 8.785 -0.541 1
1 642 . 2 1 1 A 58 58 TRP HA H 58 4.030 4.545 -0.515 1
1 650 . 2 1 1 A 58 58 TRP C C 58 177.432 179.405 -1.973 1
1 651 . 2 1 1 A 58 58 TRP CA C 58 62.731 59.955 2.776 1
1 652 . 2 1 1 A 58 58 TRP CB C 58 29.122 29.249 -0.127 1
1 657 . 2 1 1 A 58 58 TRP N N 58 119.241 120.443 -1.202 1
1 659 . 2 1 1 A 59 59 ASN H H 59 8.098 8.773 -0.675 1
1 660 . 2 1 1 A 59 59 ASN HA H 59 4.424 4.425 -0.001 1
1 663 . 2 1 1 A 59 59 ASN C C 59 176.952 178.092 -1.140 1
1 664 . 2 1 1 A 59 59 ASN CA C 59 58.135 56.578 1.557 1
1 665 . 2 1 1 A 59 59 ASN CB C 59 40.168 38.181 1.987 1
1 666 . 2 1 1 A 59 59 ASN N N 59 115.747 117.835 -2.088 1
1 667 . 2 1 1 A 60 60 THR H H 60 8.712 7.931 0.781 1
1 668 . 2 1 1 A 60 60 THR HA H 60 3.717 4.011 -0.294 1
1 673 . 2 1 1 A 60 60 THR C C 60 176.044 176.587 -0.543 1
1 674 . 2 1 1 A 60 60 THR CA C 60 66.576 66.774 -0.198 1
1 675 . 2 1 1 A 60 60 THR CB C 60 69.251 68.158 1.093 1
1 677 . 2 1 1 A 60 60 THR N N 60 114.896 118.204 -3.308 1
1 678 . 2 1 1 A 61 61 LEU H H 61 8.485 8.177 0.308 1
1 679 . 2 1 1 A 61 61 LEU HA H 61 3.391 3.878 -0.487 1
1 689 . 2 1 1 A 61 61 LEU C C 61 177.433 178.705 -1.272 1
1 690 . 2 1 1 A 61 61 LEU CA C 61 58.354 58.268 0.086 1
1 691 . 2 1 1 A 61 61 LEU CB C 61 41.761 41.909 -0.148 1
1 695 . 2 1 1 A 61 61 LEU N N 61 123.433 122.233 1.200 1
1 696 . 2 1 1 A 62 62 VAL H H 62 8.073 8.453 -0.380 1
1 697 . 2 1 1 A 62 62 VAL HA H 62 3.207 3.860 -0.653 1
1 705 . 2 1 1 A 62 62 VAL C C 62 177.585 177.477 0.108 1
1 706 . 2 1 1 A 62 62 VAL CA C 62 67.345 65.371 1.974 1
1 707 . 2 1 1 A 62 62 VAL CB C 62 30.905 30.698 0.207 1
1 710 . 2 1 1 A 62 62 VAL N N 62 116.018 118.606 -2.588 1
1 711 . 2 1 1 A 63 63 ARG H H 63 7.765 8.046 -0.281 1
1 712 . 2 1 1 A 63 63 ARG HA H 63 3.602 4.012 -0.410 1
1 719 . 2 1 1 A 63 63 ARG C C 63 177.818 178.225 -0.407 1
1 720 . 2 1 1 A 63 63 ARG CA C 63 58.049 57.914 0.135 1
1 721 . 2 1 1 A 63 63 ARG CB C 63 29.955 29.154 0.801 1
1 724 . 2 1 1 A 63 63 ARG N N 63 116.700 120.661 -3.961 1
1 725 . 2 1 1 A 64 64 ALA H H 64 7.574 7.428 0.146 1
1 726 . 2 1 1 A 64 64 ALA HA H 64 4.158 4.313 -0.155 1
1 730 . 2 1 1 A 64 64 ALA C C 64 179.886 179.278 0.608 1
1 731 . 2 1 1 A 64 64 ALA CA C 64 54.007 54.021 -0.014 1
1 732 . 2 1 1 A 64 64 ALA CB C 64 19.147 19.595 -0.448 1
1 733 . 2 1 1 A 64 64 ALA N N 64 117.555 122.056 -4.501 1
1 734 . 2 1 1 A 65 65 VAL H H 65 7.554 7.946 -0.392 1
1 735 . 2 1 1 A 65 65 VAL HA H 65 4.253 3.835 0.418 1
1 743 . 2 1 1 A 65 65 VAL C C 65 174.180 176.071 -1.891 1
1 744 . 2 1 1 A 65 65 VAL CA C 65 62.683 65.455 -2.772 1
1 745 . 2 1 1 A 65 65 VAL CB C 65 33.458 31.146 2.312 1
1 748 . 2 1 1 A 65 65 VAL N N 65 110.013 115.733 -5.720 1
1 749 . 2 1 1 A 66 66 LEU H H 66 7.792 7.253 0.539 1
1 750 . 2 1 1 A 66 66 LEU HA H 66 4.790 4.675 0.115 1
1 760 . 2 1 1 A 66 66 LEU C C 66 177.537 174.920 2.617 1
1 761 . 2 1 1 A 66 66 LEU CA C 66 52.823 52.724 0.099 1
1 762 . 2 1 1 A 66 66 LEU CB C 66 44.071 45.299 -1.228 1
1 766 . 2 1 1 A 66 66 LEU N N 66 118.967 121.293 -2.326 1
1 767 . 2 1 1 A 67 67 SER H H 67 9.208 8.385 0.823 1
1 768 . 2 1 1 A 67 67 SER HA H 67 4.414 4.746 -0.332 1
1 771 . 2 1 1 A 67 67 SER CA C 67 57.943 57.530 0.413 1
1 772 . 2 1 1 A 67 67 SER CB C 67 64.743 65.738 -0.995 1
1 773 . 2 1 1 A 67 67 SER N N 67 116.378 116.036 0.342 1
1 774 . 2 1 1 A 69 69 GLY HA2 H 69 3.916 3.739 0.177 1
1 775 . 2 1 1 A 69 69 GLY HA3 H 69 3.867 3.771 0.096 1
1 776 . 2 1 1 A 69 69 GLY C C 69 176.783 175.412 1.371 1
1 777 . 2 1 1 A 69 69 GLY CA C 69 46.977 46.989 -0.012 1
1 778 . 2 1 1 A 70 70 ASP H H 70 7.674 8.083 -0.409 1
1 779 . 2 1 1 A 70 70 ASP HA H 70 4.511 3.695 0.816 1
1 782 . 2 1 1 A 70 70 ASP C C 70 178.096 177.966 0.130 1
1 783 . 2 1 1 A 70 70 ASP CA C 70 57.262 56.419 0.843 1
1 784 . 2 1 1 A 70 70 ASP CB C 70 40.594 39.590 1.004 1
1 785 . 2 1 1 A 70 70 ASP N N 70 123.930 122.138 1.792 1
1 786 . 2 1 1 A 71 71 HIS H H 71 8.729 7.982 0.747 1
1 787 . 2 1 1 A 71 71 HIS HA H 71 4.235 4.131 0.104 1
1 790 . 2 1 1 A 71 71 HIS C C 71 176.769 176.663 0.106 1
1 791 . 2 1 1 A 71 71 HIS CA C 71 60.041 59.908 0.133 1
1 792 . 2 1 1 A 71 71 HIS CB C 71 30.682 29.672 1.010 1
1 793 . 2 1 1 A 71 71 HIS N N 71 121.003 119.852 1.151 1
1 794 . 2 1 1 A 72 72 LEU H H 72 7.620 7.885 -0.265 1
1 795 . 2 1 1 A 72 72 LEU HA H 72 3.769 3.746 0.023 1
1 805 . 2 1 1 A 72 72 LEU C C 72 180.275 179.175 1.100 1
1 806 . 2 1 1 A 72 72 LEU CA C 72 58.192 57.923 0.269 1
1 807 . 2 1 1 A 72 72 LEU CB C 72 41.381 41.167 0.214 1
1 811 . 2 1 1 A 72 72 LEU N N 72 118.569 117.760 0.809 1
1 812 . 2 1 1 A 73 73 LEU H H 73 7.542 7.450 0.092 1
1 813 . 2 1 1 A 73 73 LEU HA H 73 4.107 4.205 -0.098 1
1 823 . 2 1 1 A 73 73 LEU C C 73 179.436 179.216 0.220 1
1 824 . 2 1 1 A 73 73 LEU CA C 73 58.026 57.231 0.795 1
1 825 . 2 1 1 A 73 73 LEU CB C 73 41.638 42.101 -0.463 1
1 829 . 2 1 1 A 73 73 LEU N N 73 121.418 120.373 1.045 1
1 830 . 2 1 1 A 74 74 TRP H H 74 8.786 8.059 0.727 1
1 831 . 2 1 1 A 74 74 TRP HA H 74 3.589 5.326 -1.737 1
1 840 . 2 1 1 A 74 74 TRP C C 74 176.816 178.775 -1.959 1
1 841 . 2 1 1 A 74 74 TRP CA C 74 63.046 60.026 3.020 1
1 842 . 2 1 1 A 74 74 TRP CB C 74 28.065 28.990 -0.925 1
1 848 . 2 1 1 A 74 74 TRP N N 74 121.111 118.117 2.994 1
1 850 . 2 1 1 A 75 75 LYS H H 75 8.939 7.712 1.227 1
1 851 . 2 1 1 A 75 75 LYS HA H 75 3.055 4.271 -1.216 1
1 860 . 2 1 1 A 75 75 LYS C C 75 177.967 179.309 -1.342 1
1 861 . 2 1 1 A 75 75 LYS CA C 75 60.029 58.775 1.254 1
1 862 . 2 1 1 A 75 75 LYS CB C 75 32.533 33.115 -0.582 1
1 866 . 2 1 1 A 75 75 LYS N N 75 119.783 118.659 1.124 1
1 867 . 2 1 1 A 76 76 SER H H 76 7.832 7.926 -0.094 1
1 868 . 2 1 1 A 76 76 SER HA H 76 4.040 4.292 -0.252 1
1 871 . 2 1 1 A 76 76 SER C C 76 177.816 176.865 0.951 1
1 872 . 2 1 1 A 76 76 SER CA C 76 62.105 62.355 -0.250 1
1 873 . 2 1 1 A 76 76 SER CB C 76 62.679 62.933 -0.254 1
1 874 . 2 1 1 A 76 76 SER N N 76 113.395 117.396 -4.001 1
1 875 . 2 1 1 A 77 77 GLU H H 77 7.590 7.724 -0.134 1
1 876 . 2 1 1 A 77 77 GLU HA H 77 4.042 4.355 -0.313 1
1 881 . 2 1 1 A 77 77 GLU C C 77 177.809 178.553 -0.744 1
1 882 . 2 1 1 A 77 77 GLU CA C 77 58.270 58.483 -0.213 1
1 883 . 2 1 1 A 77 77 GLU CB C 77 29.208 29.413 -0.205 1
1 885 . 2 1 1 A 77 77 GLU N N 77 121.574 122.383 -0.809 1
1 886 . 2 1 1 A 78 78 PHE H H 78 9.081 7.903 1.178 1
1 887 . 2 1 1 A 78 78 PHE HA H 78 3.778 4.254 -0.476 1
1 895 . 2 1 1 A 78 78 PHE C C 78 178.114 177.311 0.803 1
1 896 . 2 1 1 A 78 78 PHE CA C 78 60.629 61.308 -0.679 1
1 897 . 2 1 1 A 78 78 PHE CB C 78 38.295 38.787 -0.492 1
1 902 . 2 1 1 A 78 78 PHE N N 78 122.682 122.405 0.277 1
1 903 . 2 1 1 A 79 79 PHE H H 79 8.890 8.113 0.777 1
1 904 . 2 1 1 A 79 79 PHE HA H 79 3.800 3.914 -0.114 1
1 912 . 2 1 1 A 79 79 PHE C C 79 178.354 178.235 0.119 1
1 913 . 2 1 1 A 79 79 PHE CA C 79 60.704 62.016 -1.312 1
1 914 . 2 1 1 A 79 79 PHE CB C 79 37.184 38.340 -1.156 1
1 920 . 2 1 1 A 79 79 PHE N N 79 121.056 117.885 3.171 1
1 921 . 2 1 1 A 80 80 GLU H H 80 7.793 8.319 -0.526 1
1 922 . 2 1 1 A 80 80 GLU HA H 80 4.082 3.945 0.137 1
1 927 . 2 1 1 A 80 80 GLU C C 80 179.068 179.230 -0.162 1
1 928 . 2 1 1 A 80 80 GLU CA C 80 59.735 59.848 -0.113 1
1 929 . 2 1 1 A 80 80 GLU CB C 80 28.722 29.239 -0.517 1
1 931 . 2 1 1 A 80 80 GLU N N 80 120.312 118.611 1.701 1
1 932 . 2 1 1 A 81 81 ASN H H 81 8.624 8.567 0.057 1
1 933 . 2 1 1 A 81 81 ASN HA H 81 4.521 4.509 0.012 1
1 938 . 2 1 1 A 81 81 ASN C C 81 179.262 177.950 1.312 1
1 939 . 2 1 1 A 81 81 ASN CA C 81 55.504 56.326 -0.822 1
1 940 . 2 1 1 A 81 81 ASN CB C 81 37.517 38.227 -0.710 1
1 941 . 2 1 1 A 81 81 ASN N N 81 119.338 118.716 0.622 1
1 943 . 2 1 1 A 82 82 CYS H H 82 8.554 7.831 0.723 1
1 944 . 2 1 1 A 82 82 CYS HA H 82 3.792 3.887 -0.095 1
1 947 . 2 1 1 A 82 82 CYS C C 82 176.478 177.339 -0.861 1
1 948 . 2 1 1 A 82 82 CYS CA C 82 65.232 63.328 1.904 1
1 949 . 2 1 1 A 82 82 CYS CB C 82 26.762 26.027 0.735 1
1 950 . 2 1 1 A 82 82 CYS N N 82 120.576 117.721 2.855 1
1 951 . 2 1 1 A 83 83 ARG H H 83 8.522 7.890 0.632 1
1 952 . 2 1 1 A 83 83 ARG HA H 83 3.932 4.132 -0.200 1
1 960 . 2 1 1 A 83 83 ARG C C 83 179.138 178.723 0.415 1
1 961 . 2 1 1 A 83 83 ARG CA C 83 60.443 58.776 1.667 1
1 962 . 2 1 1 A 83 83 ARG CB C 83 29.550 29.686 -0.136 1
1 965 . 2 1 1 A 83 83 ARG N N 83 123.035 119.576 3.459 1
1 967 . 2 1 1 A 84 84 ASP H H 84 7.791 8.243 -0.452 1
1 968 . 2 1 1 A 84 84 ASP HA H 84 4.353 4.486 -0.133 1
1 971 . 2 1 1 A 84 84 ASP C C 84 178.649 178.658 -0.009 1
1 972 . 2 1 1 A 84 84 ASP CA C 84 57.767 57.383 0.384 1
1 973 . 2 1 1 A 84 84 ASP CB C 84 41.305 41.420 -0.115 1
1 974 . 2 1 1 A 84 84 ASP N N 84 120.332 119.721 0.611 1
1 975 . 2 1 1 A 85 85 THR H H 85 8.370 8.126 0.244 1
1 976 . 2 1 1 A 85 85 THR HA H 85 3.730 3.896 -0.166 1
1 981 . 2 1 1 A 85 85 THR C C 85 175.198 176.262 -1.064 1
1 982 . 2 1 1 A 85 85 THR CA C 85 66.830 66.088 0.742 1
1 983 . 2 1 1 A 85 85 THR CB C 85 68.533 68.347 0.186 1
1 985 . 2 1 1 A 85 85 THR N N 85 117.360 115.774 1.586 1
1 986 . 2 1 1 A 86 86 ALA H H 86 8.845 8.325 0.520 1
1 987 . 2 1 1 A 86 86 ALA HA H 86 3.991 4.047 -0.056 1
1 991 . 2 1 1 A 86 86 ALA C C 86 179.980 179.457 0.523 1
1 992 . 2 1 1 A 86 86 ALA CA C 86 55.769 55.362 0.407 1
1 993 . 2 1 1 A 86 86 ALA CB C 86 17.881 18.137 -0.256 1
1 994 . 2 1 1 A 86 86 ALA N N 86 123.613 123.778 -0.165 1
1 995 . 2 1 1 A 87 87 LYS H H 87 7.686 8.512 -0.826 1
1 996 . 2 1 1 A 87 87 LYS HA H 87 4.099 4.073 0.026 1
1 1005 . 2 1 1 A 87 87 LYS C C 87 179.592 178.909 0.683 1
1 1006 . 2 1 1 A 87 87 LYS CA C 87 59.708 59.437 0.271 1
1 1007 . 2 1 1 A 87 87 LYS CB C 87 32.054 32.048 0.006 1
1 1011 . 2 1 1 A 87 87 LYS N N 87 119.623 116.564 3.059 1
1 1012 . 2 1 1 A 88 88 ARG H H 88 7.683 8.049 -0.366 1
1 1013 . 2 1 1 A 88 88 ARG HA H 88 4.051 4.182 -0.131 1
1 1020 . 2 1 1 A 88 88 ARG C C 88 180.053 179.472 0.581 1
1 1021 . 2 1 1 A 88 88 ARG CA C 88 59.558 59.238 0.320 1
1 1022 . 2 1 1 A 88 88 ARG CB C 88 29.684 29.977 -0.293 1
1 1025 . 2 1 1 A 88 88 ARG N N 88 120.788 119.818 0.970 1
1 1026 . 2 1 1 A 89 89 ASN H H 89 8.973 8.545 0.428 1
1 1027 . 2 1 1 A 89 89 ASN HA H 89 4.354 4.675 -0.321 1
1 1032 . 2 1 1 A 89 89 ASN C C 89 178.382 178.596 -0.214 1
1 1033 . 2 1 1 A 89 89 ASN CA C 89 55.334 55.697 -0.363 1
1 1034 . 2 1 1 A 89 89 ASN CB C 89 37.864 38.056 -0.192 1
1 1035 . 2 1 1 A 89 89 ASN N N 89 121.012 118.012 3.000 1
1 1037 . 2 1 1 A 90 90 GLN H H 90 8.152 7.911 0.241 1
1 1038 . 2 1 1 A 90 90 GLN HA H 90 4.020 4.191 -0.171 1
1 1045 . 2 1 1 A 90 90 GLN C C 90 179.075 178.567 0.508 1
1 1046 . 2 1 1 A 90 90 GLN CA C 90 59.318 58.671 0.647 1
1 1047 . 2 1 1 A 90 90 GLN CB C 90 28.049 28.763 -0.714 1
1 1049 . 2 1 1 A 90 90 GLN N N 90 122.122 120.828 1.294 1
1 1051 . 2 1 1 A 91 91 GLN H H 91 7.514 8.460 -0.946 1
1 1052 . 2 1 1 A 91 91 GLN HA H 91 4.053 4.088 -0.035 1
1 1059 . 2 1 1 A 91 91 GLN C C 91 177.081 177.543 -0.462 1
1 1060 . 2 1 1 A 91 91 GLN CA C 91 58.031 58.786 -0.755 1
1 1061 . 2 1 1 A 91 91 GLN CB C 91 28.365 27.889 0.476 1
1 1063 . 2 1 1 A 91 91 GLN N N 91 118.124 118.224 -0.100 1
1 1065 . 2 1 1 A 92 92 ALA H H 92 7.704 7.758 -0.054 1
1 1066 . 2 1 1 A 92 92 ALA HA H 92 4.246 4.352 -0.106 1
1 1070 . 2 1 1 A 92 92 ALA C C 92 178.450 177.788 0.662 1
1 1071 . 2 1 1 A 92 92 ALA CA C 92 52.671 52.189 0.482 1
1 1072 . 2 1 1 A 92 92 ALA CB C 92 19.316 19.665 -0.349 1
1 1073 . 2 1 1 A 92 92 ALA N N 92 119.880 119.812 0.068 1
1 1074 . 2 1 1 A 93 93 GLY H H 93 7.693 8.018 -0.325 1
1 1075 . 2 1 1 A 93 93 GLY HA2 H 93 3.941 3.934 0.007 1
1 1076 . 2 1 1 A 93 93 GLY HA3 H 93 3.744 3.945 -0.201 1
1 1077 . 2 1 1 A 93 93 GLY C C 93 174.344 174.883 -0.539 1
1 1078 . 2 1 1 A 93 93 GLY CA C 93 45.949 46.676 -0.727 1
1 1079 . 2 1 1 A 93 93 GLY N N 93 105.347 108.092 -2.745 1
1 1080 . 2 1 1 A 94 94 ASN H H 94 7.076 8.643 -1.567 1
1 1081 . 2 1 1 A 94 94 ASN HA H 94 4.115 4.827 -0.712 1
1 1085 . 2 1 1 A 94 94 ASN C C 94 175.410 175.798 -0.388 1
1 1086 . 2 1 1 A 94 94 ASN CA C 94 52.651 52.701 -0.050 1
1 1087 . 2 1 1 A 94 94 ASN CB C 94 38.330 40.017 -1.687 1
1 1088 . 2 1 1 A 94 94 ASN N N 94 115.747 117.704 -1.957 1
1 1090 . 2 1 1 A 95 95 GLY H H 95 8.236 8.104 0.132 1
1 1091 . 2 1 1 A 95 95 GLY HA2 H 95 3.633 3.354 0.279 1
1 1092 . 2 1 1 A 95 95 GLY HA3 H 95 3.633 3.555 0.078 1
1 1093 . 2 1 1 A 95 95 GLY C C 95 174.450 172.944 1.506 1
1 1094 . 2 1 1 A 95 95 GLY CA C 95 45.522 46.292 -0.770 1
1 1095 . 2 1 1 A 95 95 GLY N N 95 109.166 108.089 1.077 1
1 1096 . 2 1 1 A 96 96 TRP H H 96 7.899 7.622 0.277 1
1 1097 . 2 1 1 A 96 96 TRP HA H 96 5.241 5.299 -0.058 1
1 1106 . 2 1 1 A 96 96 TRP C C 96 175.661 174.549 1.112 1
1 1107 . 2 1 1 A 96 96 TRP CA C 96 55.090 55.699 -0.609 1
1 1108 . 2 1 1 A 96 96 TRP CB C 96 27.138 34.593 -7.455 1
1 1114 . 2 1 1 A 96 96 TRP N N 96 122.840 119.118 3.722 1
1 1116 . 2 1 1 A 97 97 ASP H H 97 7.344 9.023 -1.679 1
1 1117 . 2 1 1 A 97 97 ASP HA H 97 4.829 5.229 -0.400 1
1 1120 . 2 1 1 A 97 97 ASP C C 97 175.019 176.280 -1.261 1
1 1121 . 2 1 1 A 97 97 ASP CA C 97 52.149 53.844 -1.695 1
1 1122 . 2 1 1 A 97 97 ASP CB C 97 42.697 43.930 -1.233 1
1 1123 . 2 1 1 A 97 97 ASP N N 97 126.861 120.730 6.131 1
1 1124 . 2 1 1 A 98 98 PHE H H 98 8.566 9.301 -0.735 1
1 1125 . 2 1 1 A 98 98 PHE HA H 98 3.727 4.090 -0.363 1
1 1133 . 2 1 1 A 98 98 PHE C C 98 177.443 177.339 0.104 1
1 1134 . 2 1 1 A 98 98 PHE CA C 98 62.471 61.922 0.549 1
1 1135 . 2 1 1 A 98 98 PHE CB C 98 39.919 39.539 0.380 1
1 1141 . 2 1 1 A 98 98 PHE N N 98 117.781 126.317 -8.536 1
1 1142 . 2 1 1 A 99 99 ASP H H 99 8.259 8.746 -0.487 1
1 1143 . 2 1 1 A 99 99 ASP HA H 99 3.960 4.314 -0.354 1
1 1146 . 2 1 1 A 99 99 ASP C C 99 178.132 178.252 -0.120 1
1 1147 . 2 1 1 A 99 99 ASP CA C 99 57.658 56.384 1.274 1
1 1148 . 2 1 1 A 99 99 ASP CB C 99 38.572 40.442 -1.870 1
1 1149 . 2 1 1 A 99 99 ASP N N 99 121.709 119.171 2.538 1
1 1150 . 2 1 1 A 100 100 MET H H 100 8.008 7.752 0.256 1
1 1151 . 2 1 1 A 100 100 MET HA H 100 3.644 4.477 -0.833 1
1 1156 . 2 1 1 A 100 100 MET C C 100 180.008 177.004 3.004 1
1 1157 . 2 1 1 A 100 100 MET CA C 100 58.598 58.008 0.590 1
1 1158 . 2 1 1 A 100 100 MET CB C 100 33.423 33.633 -0.210 1
1 1160 . 2 1 1 A 100 100 MET N N 100 119.668 116.497 3.171 1
1 1161 . 2 1 1 A 101 101 LEU H H 101 7.961 7.862 0.099 1
1 1162 . 2 1 1 A 101 101 LEU HA H 101 3.523 4.367 -0.844 1
1 1172 . 2 1 1 A 101 101 LEU C C 101 173.873 174.975 -1.102 1
1 1173 . 2 1 1 A 101 101 LEU CA C 101 58.743 54.062 4.681 1
1 1174 . 2 1 1 A 101 101 LEU CB C 101 42.632 41.277 1.355 1
1 1178 . 2 1 1 A 101 101 LEU N N 101 119.752 119.524 0.228 1
1 1179 . 2 1 1 A 102 102 THR H H 102 6.955 7.772 -0.817 1
1 1180 . 2 1 1 A 102 102 THR HA H 102 4.134 4.329 -0.195 1
1 1185 . 2 1 1 A 102 102 THR C C 102 176.513 174.896 1.617 1
1 1186 . 2 1 1 A 102 102 THR CA C 102 61.125 60.906 0.219 1
1 1187 . 2 1 1 A 102 102 THR CB C 102 71.415 70.375 1.040 1
1 1189 . 2 1 1 A 102 102 THR N N 102 124.665 116.629 8.036 1
1 1190 . 2 1 1 A 103 103 GLY H H 103 7.816 8.804 -0.988 1
1 1191 . 2 1 1 A 103 103 GLY HA2 H 103 3.824 3.952 -0.128 1
1 1192 . 2 1 1 A 103 103 GLY HA3 H 103 3.824 4.010 -0.186 1
1 1193 . 2 1 1 A 103 103 GLY C C 103 174.126 174.734 -0.608 1
1 1194 . 2 1 1 A 103 103 GLY CA C 103 47.805 46.139 1.666 1
1 1195 . 2 1 1 A 103 103 GLY N N 103 114.191 110.144 4.047 1
1 1196 . 2 1 1 A 104 104 SER H H 104 8.860 7.639 1.221 1
1 1197 . 2 1 1 A 104 104 SER HA H 104 4.758 4.278 0.480 1
1 1200 . 2 1 1 A 104 104 SER C C 104 174.591 174.386 0.205 1
1 1201 . 2 1 1 A 104 104 SER CA C 104 56.755 60.168 -3.413 1
1 1202 . 2 1 1 A 104 104 SER CB C 104 65.050 63.755 1.295 1
1 1203 . 2 1 1 A 104 104 SER N N 104 114.771 116.330 -1.559 1
1 1204 . 2 1 1 A 105 105 GLY H H 105 8.788 8.447 0.341 1
1 1205 . 2 1 1 A 105 105 GLY HA2 H 105 3.733 4.124 -0.391 1
1 1206 . 2 1 1 A 105 105 GLY HA3 H 105 3.733 4.174 -0.441 1
1 1207 . 2 1 1 A 105 105 GLY CA C 105 47.247 45.705 1.542 1
1 1208 . 2 1 1 A 105 105 GLY N N 105 110.394 112.112 -1.718 1
1 1209 . 2 1 1 A 106 106 ASN HA H 106 4.454 4.769 -0.315 1
1 1212 . 2 1 1 A 106 106 ASN C C 106 175.180 175.837 -0.657 1
1 1213 . 2 1 1 A 106 106 ASN CA C 106 54.492 54.665 -0.173 1
1 1214 . 2 1 1 A 106 106 ASN CB C 106 37.282 39.896 -2.614 1
1 1215 . 2 1 1 A 107 107 TYR H H 107 8.241 7.716 0.525 1
1 1216 . 2 1 1 A 107 107 TYR HA H 107 4.335 4.883 -0.548 1
1 1223 . 2 1 1 A 107 107 TYR C C 107 173.954 176.367 -2.413 1
1 1224 . 2 1 1 A 107 107 TYR CA C 107 57.727 57.061 0.666 1
1 1225 . 2 1 1 A 107 107 TYR CB C 107 37.063 40.052 -2.989 1
1 1230 . 2 1 1 A 107 107 TYR N N 107 120.708 114.078 6.630 1
1 1231 . 2 1 1 A 108 108 SER H H 108 7.117 7.912 -0.795 1
1 1232 . 2 1 1 A 108 108 SER HA H 108 4.221 4.682 -0.461 1
1 1235 . 2 1 1 A 108 108 SER C C 108 174.834 175.075 -0.241 1
1 1236 . 2 1 1 A 108 108 SER CA C 108 59.859 59.320 0.539 1
1 1237 . 2 1 1 A 108 108 SER CB C 108 63.846 64.656 -0.810 1
1 1238 . 2 1 1 A 108 108 SER N N 108 113.362 114.969 -1.607 1
1 1239 . 2 1 1 A 109 109 SER H H 109 8.053 7.892 0.161 1
1 1240 . 2 1 1 A 109 109 SER HA H 109 4.560 4.405 0.155 1
1 1243 . 2 1 1 A 109 109 SER CA C 109 57.141 60.828 -3.687 1
1 1244 . 2 1 1 A 109 109 SER CB C 109 64.874 61.893 2.981 1
1 1245 . 2 1 1 A 109 109 SER N N 109 116.657 115.344 1.313 1
1 1246 . 2 1 1 A 110 110 THR HA H 110 3.541 3.948 -0.407 1
1 1251 . 2 1 1 A 110 110 THR C C 110 175.477 176.208 -0.731 1
1 1252 . 2 1 1 A 110 110 THR CA C 110 66.443 65.499 0.944 1
1 1253 . 2 1 1 A 110 110 THR CB C 110 68.091 68.427 -0.336 1
1 1255 . 2 1 1 A 111 111 ASP H H 111 8.224 8.101 0.123 1
1 1256 . 2 1 1 A 111 111 ASP HA H 111 4.237 4.313 -0.076 1
1 1259 . 2 1 1 A 111 111 ASP C C 111 177.520 178.848 -1.328 1
1 1260 . 2 1 1 A 111 111 ASP CA C 111 57.559 57.164 0.395 1
1 1261 . 2 1 1 A 111 111 ASP CB C 111 40.292 40.627 -0.335 1
1 1262 . 2 1 1 A 111 111 ASP N N 111 119.490 120.750 -1.260 1
1 1263 . 2 1 1 A 112 112 ALA H H 112 7.431 7.961 -0.530 1
1 1264 . 2 1 1 A 112 112 ALA HA H 112 4.191 4.051 0.140 1
1 1268 . 2 1 1 A 112 112 ALA C C 112 180.646 179.766 0.880 1
1 1269 . 2 1 1 A 112 112 ALA CA C 112 54.534 54.391 0.143 1
1 1270 . 2 1 1 A 112 112 ALA CB C 112 18.992 18.180 0.812 1
1 1271 . 2 1 1 A 112 112 ALA N N 112 119.710 121.742 -2.032 1
1 1272 . 2 1 1 A 113 113 GLN H H 113 7.576 7.197 0.379 1
1 1273 . 2 1 1 A 113 113 GLN HA H 113 3.562 3.972 -0.410 1
1 1278 . 2 1 1 A 113 113 GLN C C 113 176.756 177.719 -0.963 1
1 1279 . 2 1 1 A 113 113 GLN CA C 113 57.736 58.397 -0.661 1
1 1280 . 2 1 1 A 113 113 GLN CB C 113 29.110 28.196 0.914 1
1 1281 . 2 1 1 A 113 113 GLN N N 113 117.518 118.197 -0.679 1
1 1283 . 2 1 1 A 114 114 MET H H 114 8.192 8.032 0.160 1
1 1284 . 2 1 1 A 114 114 MET HA H 114 4.231 4.000 0.231 1
1 1289 . 2 1 1 A 114 114 MET C C 114 175.648 177.221 -1.573 1
1 1290 . 2 1 1 A 114 114 MET CA C 114 57.446 57.647 -0.201 1
1 1291 . 2 1 1 A 114 114 MET CB C 114 33.570 32.561 1.009 1
1 1293 . 2 1 1 A 114 114 MET N N 114 111.509 119.250 -7.741 1
1 1294 . 2 1 1 A 115 115 GLN H H 115 6.940 7.351 -0.411 1
1 1295 . 2 1 1 A 115 115 GLN HA H 115 4.307 4.533 -0.226 1
1 1302 . 2 1 1 A 115 115 GLN C C 115 176.270 174.702 1.568 1
1 1303 . 2 1 1 A 115 115 GLN CA C 115 54.680 55.133 -0.453 1
1 1304 . 2 1 1 A 115 115 GLN CB C 115 28.233 28.804 -0.571 1
1 1306 . 2 1 1 A 115 115 GLN N N 115 114.300 116.456 -2.156 1
1 1308 . 2 1 1 A 116 116 TYR H H 116 6.677 7.071 -0.394 1
1 1309 . 2 1 1 A 116 116 TYR HA H 116 4.193 4.576 -0.383 1
1 1312 . 2 1 1 A 116 116 TYR C C 116 175.268 175.558 -0.290 1
1 1313 . 2 1 1 A 116 116 TYR CA C 116 54.357 59.225 -4.868 1
1 1314 . 2 1 1 A 116 116 TYR CB C 116 35.498 39.340 -3.842 1
1 1315 . 2 1 1 A 116 116 TYR N N 116 117.919 120.950 -3.031 1
1 1316 . 2 1 1 A 117 117 ASP H H 117 8.081 8.730 -0.649 1
1 1317 . 2 1 1 A 117 117 ASP HA H 117 4.665 5.206 -0.541 1
1 1320 . 2 1 1 A 117 117 ASP CA C 117 52.422 51.479 0.943 1
1 1321 . 2 1 1 A 117 117 ASP CB C 117 42.416 42.638 -0.222 1
1 1322 . 2 1 1 A 117 117 ASP N N 117 120.887 124.106 -3.219 1
1 1323 . 2 1 1 A 118 118 PRO C C 118 179.180 178.751 0.429 1
1 1324 . 2 1 1 A 118 118 PRO CA C 118 65.942 65.066 0.876 1
1 1325 . 2 1 1 A 118 118 PRO CB C 118 32.197 31.927 0.270 1
1 1326 . 2 1 1 A 119 119 GLY H H 119 9.742 8.924 0.818 1
1 1327 . 2 1 1 A 119 119 GLY C C 119 175.622 175.171 0.451 1
1 1328 . 2 1 1 A 119 119 GLY CA C 119 46.785 46.641 0.144 1
1 1329 . 2 1 1 A 119 119 GLY N N 119 106.412 106.703 -0.291 1
1 1330 . 2 1 1 A 120 120 LEU H H 120 6.666 8.109 -1.443 1
1 1331 . 2 1 1 A 120 120 LEU HA H 120 3.365 3.240 0.125 1
1 1341 . 2 1 1 A 120 120 LEU C C 120 179.262 178.623 0.639 1
1 1342 . 2 1 1 A 120 120 LEU CA C 120 56.605 57.801 -1.196 1
1 1343 . 2 1 1 A 120 120 LEU CB C 120 39.262 41.675 -2.413 1
1 1347 . 2 1 1 A 120 120 LEU N N 120 126.226 122.358 3.868 1
1 1348 . 2 1 1 A 121 121 PHE H H 121 7.356 8.756 -1.400 1
1 1349 . 2 1 1 A 121 121 PHE HA H 121 4.459 3.888 0.571 1
1 1352 . 2 1 1 A 121 121 PHE C C 121 179.716 176.380 3.336 1
1 1353 . 2 1 1 A 121 121 PHE CA C 121 62.838 61.799 1.039 1
1 1354 . 2 1 1 A 121 121 PHE CB C 121 37.603 38.609 -1.006 1
1 1355 . 2 1 1 A 121 121 PHE N N 121 117.437 119.410 -1.973 1
1 1356 . 2 1 1 A 122 122 ALA H H 122 7.926 7.889 0.037 1
1 1357 . 2 1 1 A 122 122 ALA HA H 122 4.523 3.715 0.808 1
1 1361 . 2 1 1 A 122 122 ALA C C 122 180.435 179.716 0.719 1
1 1362 . 2 1 1 A 122 122 ALA CA C 122 55.527 55.184 0.343 1
1 1363 . 2 1 1 A 122 122 ALA CB C 122 17.814 17.951 -0.137 1
1 1364 . 2 1 1 A 122 122 ALA N N 122 121.068 120.916 0.152 1
1 1365 . 2 1 1 A 123 123 GLN H H 123 7.507 8.090 -0.583 1
1 1366 . 2 1 1 A 123 123 GLN HA H 123 4.153 3.861 0.292 1
1 1371 . 2 1 1 A 123 123 GLN C C 123 180.561 178.504 2.057 1
1 1372 . 2 1 1 A 123 123 GLN CA C 123 59.948 58.889 1.059 1
1 1373 . 2 1 1 A 123 123 GLN CB C 123 29.135 28.149 0.986 1
1 1375 . 2 1 1 A 123 123 GLN N N 123 120.324 117.174 3.150 1
1 1376 . 2 1 1 A 124 124 ILE H H 124 8.318 7.936 0.382 1
1 1377 . 2 1 1 A 124 124 ILE HA H 124 3.635 3.333 0.302 1
1 1387 . 2 1 1 A 124 124 ILE C C 124 176.481 177.496 -1.015 1
1 1388 . 2 1 1 A 124 124 ILE CA C 124 66.432 64.942 1.490 1
1 1389 . 2 1 1 A 124 124 ILE CB C 124 39.168 37.977 1.191 1
1 1393 . 2 1 1 A 124 124 ILE N N 124 123.747 120.903 2.844 1
1 1394 . 2 1 1 A 125 125 GLN H H 125 8.474 8.093 0.381 1
1 1395 . 2 1 1 A 125 125 GLN HA H 125 4.264 3.778 0.486 1
1 1402 . 2 1 1 A 125 125 GLN C C 125 178.947 177.745 1.202 1
1 1403 . 2 1 1 A 125 125 GLN CA C 125 59.651 58.236 1.415 1
1 1404 . 2 1 1 A 125 125 GLN CB C 125 28.880 27.881 0.999 1
1 1406 . 2 1 1 A 125 125 GLN N N 125 120.368 119.547 0.821 1
1 1408 . 2 1 1 A 126 126 ALA H H 126 8.002 7.584 0.418 1
1 1409 . 2 1 1 A 126 126 ALA HA H 126 4.144 4.049 0.095 1
1 1413 . 2 1 1 A 126 126 ALA C C 126 179.316 179.543 -0.227 1
1 1414 . 2 1 1 A 126 126 ALA CA C 126 55.036 54.708 0.328 1
1 1415 . 2 1 1 A 126 126 ALA CB C 126 18.087 18.128 -0.041 1
1 1416 . 2 1 1 A 126 126 ALA N N 126 121.661 121.728 -0.067 1
1 1417 . 2 1 1 A 127 127 ALA H H 127 7.823 7.851 -0.028 1
1 1418 . 2 1 1 A 127 127 ALA HA H 127 4.162 4.090 0.072 1
1 1422 . 2 1 1 A 127 127 ALA C C 127 180.707 179.342 1.365 1
1 1423 . 2 1 1 A 127 127 ALA CA C 127 55.080 54.615 0.465 1
1 1424 . 2 1 1 A 127 127 ALA CB C 127 19.354 18.148 1.206 1
1 1425 . 2 1 1 A 127 127 ALA N N 127 119.853 119.844 0.009 1
1 1426 . 2 1 1 A 128 128 ALA H H 128 8.936 8.021 0.915 1
1 1427 . 2 1 1 A 128 128 ALA HA H 128 3.928 4.167 -0.239 1
1 1431 . 2 1 1 A 128 128 ALA C C 128 181.031 179.470 1.561 1
1 1432 . 2 1 1 A 128 128 ALA CA C 128 55.502 55.037 0.465 1
1 1433 . 2 1 1 A 128 128 ALA CB C 128 16.609 17.930 -1.321 1
1 1434 . 2 1 1 A 128 128 ALA N N 128 121.355 120.668 0.687 1
1 1435 . 2 1 1 A 129 129 THR H H 129 8.543 7.899 0.644 1
1 1436 . 2 1 1 A 129 129 THR HA H 129 4.015 3.842 0.173 1
1 1441 . 2 1 1 A 129 129 THR C C 129 177.332 177.100 0.232 1
1 1442 . 2 1 1 A 129 129 THR CA C 129 65.893 65.477 0.416 1
1 1443 . 2 1 1 A 129 129 THR CB C 129 68.566 68.331 0.235 1
1 1445 . 2 1 1 A 129 129 THR N N 129 112.709 110.732 1.977 1
1 1446 . 2 1 1 A 130 130 LYS H H 130 8.126 7.606 0.520 1
1 1447 . 2 1 1 A 130 130 LYS HA H 130 4.000 4.147 -0.147 1
1 1456 . 2 1 1 A 130 130 LYS C C 130 179.082 178.595 0.487 1
1 1457 . 2 1 1 A 130 130 LYS CA C 130 60.299 58.727 1.572 1
1 1458 . 2 1 1 A 130 130 LYS CB C 130 32.767 32.120 0.647 1
1 1462 . 2 1 1 A 130 130 LYS N N 130 123.879 121.799 2.080 1
1 1463 . 2 1 1 A 131 131 ALA H H 131 7.184 7.813 -0.629 1
1 1464 . 2 1 1 A 131 131 ALA HA H 131 4.005 4.311 -0.306 1
1 1468 . 2 1 1 A 131 131 ALA C C 131 178.482 179.620 -1.138 1
1 1469 . 2 1 1 A 131 131 ALA CA C 131 55.027 55.169 -0.142 1
1 1470 . 2 1 1 A 131 131 ALA CB C 131 18.669 19.624 -0.955 1
1 1471 . 2 1 1 A 131 131 ALA N N 131 118.590 121.917 -3.327 1
1 1472 . 2 1 1 A 132 132 TRP H H 132 7.977 8.817 -0.840 1
1 1473 . 2 1 1 A 132 132 TRP HA H 132 4.001 4.393 -0.392 1
1 1480 . 2 1 1 A 132 132 TRP C C 132 177.332 175.863 1.469 1
1 1481 . 2 1 1 A 132 132 TRP CA C 132 60.431 57.550 2.881 1
1 1482 . 2 1 1 A 132 132 TRP CB C 132 27.786 27.799 -0.013 1
1 1486 . 2 1 1 A 132 132 TRP N N 132 119.168 117.155 2.013 1
1 1488 . 2 1 1 A 133 133 ARG H H 133 8.006 8.036 -0.030 1
1 1489 . 2 1 1 A 133 133 ARG HA H 133 4.027 4.479 -0.452 1
1 1497 . 2 1 1 A 133 133 ARG C C 133 176.664 177.767 -1.103 1
1 1498 . 2 1 1 A 133 133 ARG CA C 133 59.355 57.306 2.049 1
1 1499 . 2 1 1 A 133 133 ARG CB C 133 30.451 32.256 -1.805 1
1 1502 . 2 1 1 A 133 133 ARG N N 133 113.062 120.658 -7.596 1
1 1504 . 2 1 1 A 134 134 LYS H H 134 7.322 7.880 -0.558 1
1 1505 . 2 1 1 A 134 134 LYS HA H 134 4.313 4.430 -0.117 1
1 1514 . 2 1 1 A 134 134 LYS C C 134 176.282 175.451 0.831 1
1 1515 . 2 1 1 A 134 134 LYS CA C 134 54.922 56.689 -1.767 1
1 1516 . 2 1 1 A 134 134 LYS CB C 134 32.633 31.384 1.249 1
1 1520 . 2 1 1 A 134 134 LYS N N 134 118.170 119.040 -0.870 1
1 1521 . 2 1 1 A 135 135 LEU H H 135 7.440 8.029 -0.589 1
1 1522 . 2 1 1 A 135 135 LEU HA H 135 4.174 4.861 -0.687 1
1 1532 . 2 1 1 A 135 135 LEU CA C 135 54.408 51.419 2.989 1
1 1533 . 2 1 1 A 135 135 LEU CB C 135 40.407 41.838 -1.431 1
1 1537 . 2 1 1 A 135 135 LEU N N 135 123.358 121.572 1.786 1
1 1538 . 2 1 1 A 136 136 PRO HA H 136 4.437 4.698 -0.261 1
1 1545 . 2 1 1 A 136 136 PRO C C 136 177.106 176.192 0.914 1
1 1546 . 2 1 1 A 136 136 PRO CA C 136 62.889 64.134 -1.245 1
1 1547 . 2 1 1 A 136 136 PRO CB C 136 32.192 31.970 0.222 1
1 1550 . 2 1 1 A 137 137 VAL H H 137 8.219 7.606 0.613 1
1 1551 . 2 1 1 A 137 137 VAL HA H 137 4.077 4.542 -0.465 1
1 1559 . 2 1 1 A 137 137 VAL C C 137 176.305 173.163 3.142 1
1 1560 . 2 1 1 A 137 137 VAL CA C 137 61.958 59.735 2.223 1
1 1561 . 2 1 1 A 137 137 VAL CB C 137 32.755 35.609 -2.854 1
1 1564 . 2 1 1 A 137 137 VAL N N 137 120.079 116.952 3.127 1
1 1565 . 2 1 1 A 138 138 LYS H H 138 8.444 8.699 -0.255 1
1 1566 . 2 1 1 A 138 138 LYS HA H 138 4.316 4.715 -0.399 1
1 1575 . 2 1 1 A 138 138 LYS C C 138 176.790 175.680 1.110 1
1 1576 . 2 1 1 A 138 138 LYS CA C 138 56.792 55.074 1.718 1
1 1577 . 2 1 1 A 138 138 LYS CB C 138 33.205 34.040 -0.835 1
1 1581 . 2 1 1 A 138 138 LYS N N 138 126.449 129.311 -2.862 1
1 1582 . 2 1 1 A 139 139 GLY H H 139 8.518 8.626 -0.108 1
1 1583 . 2 1 1 A 139 139 GLY HA2 H 139 4.070 3.833 0.237 1
1 1584 . 2 1 1 A 139 139 GLY HA3 H 139 3.897 3.835 0.062 1
1 1585 . 2 1 1 A 139 139 GLY C C 139 172.874 173.858 -0.984 1
1 1586 . 2 1 1 A 139 139 GLY CA C 139 45.157 46.698 -1.541 1
1 1587 . 2 1 1 A 139 139 GLY N N 139 112.617 113.620 -1.003 1
1 6 . 3 1 1 A 2 2 VAL H H 2 8.992 8.464 0.528 1
1 7 . 3 1 1 A 2 2 VAL HA H 2 5.370 4.114 1.256 1
1 15 . 3 1 1 A 2 2 VAL C C 2 174.325 175.145 -0.820 1
1 16 . 3 1 1 A 2 2 VAL CA C 2 61.267 61.872 -0.605 1
1 17 . 3 1 1 A 2 2 VAL CB C 2 33.890 31.735 2.155 1
1 20 . 3 1 1 A 2 2 VAL N N 2 126.939 120.230 6.709 1
1 21 . 3 1 1 A 3 3 THR H H 3 8.912 8.655 0.257 1
1 22 . 3 1 1 A 3 3 THR HA H 3 4.505 4.928 -0.423 1
1 27 . 3 1 1 A 3 3 THR C C 3 172.710 174.359 -1.649 1
1 28 . 3 1 1 A 3 3 THR CA C 3 59.689 61.154 -1.465 1
1 29 . 3 1 1 A 3 3 THR CB C 3 72.398 70.350 2.048 1
1 31 . 3 1 1 A 3 3 THR N N 3 118.091 123.357 -5.266 1
1 32 . 3 1 1 A 4 4 GLU H H 4 8.631 8.736 -0.105 1
1 33 . 3 1 1 A 4 4 GLU HA H 4 5.788 4.926 0.862 1
1 38 . 3 1 1 A 4 4 GLU C C 4 175.758 174.680 1.078 1
1 39 . 3 1 1 A 4 4 GLU CA C 4 54.902 54.332 0.570 1
1 40 . 3 1 1 A 4 4 GLU CB C 4 35.097 31.856 3.241 1
1 42 . 3 1 1 A 4 4 GLU N N 4 120.966 125.845 -4.879 1
1 43 . 3 1 1 A 5 5 THR H H 5 9.188 8.742 0.446 1
1 44 . 3 1 1 A 5 5 THR HA H 5 4.739 4.536 0.203 1
1 49 . 3 1 1 A 5 5 THR C C 5 172.757 171.935 0.822 1
1 50 . 3 1 1 A 5 5 THR CA C 5 60.382 60.226 0.156 1
1 51 . 3 1 1 A 5 5 THR CB C 5 71.558 69.736 1.822 1
1 53 . 3 1 1 A 5 5 THR N N 5 119.366 114.541 4.825 1
1 54 . 3 1 1 A 6 6 VAL H H 6 8.476 8.548 -0.072 1
1 55 . 3 1 1 A 6 6 VAL HA H 6 5.026 5.491 -0.465 1
1 63 . 3 1 1 A 6 6 VAL C C 6 176.674 173.353 3.321 1
1 64 . 3 1 1 A 6 6 VAL CA C 6 61.008 59.488 1.520 1
1 65 . 3 1 1 A 6 6 VAL CB C 6 33.861 36.157 -2.296 1
1 68 . 3 1 1 A 6 6 VAL N N 6 121.384 119.838 1.546 1
1 69 . 3 1 1 A 7 7 ASP H H 7 8.848 9.191 -0.343 1
1 70 . 3 1 1 A 7 7 ASP HA H 7 4.797 5.171 -0.374 1
1 73 . 3 1 1 A 7 7 ASP CA C 7 52.834 53.339 -0.505 1
1 74 . 3 1 1 A 7 7 ASP CB C 7 42.219 43.022 -0.803 1
1 75 . 3 1 1 A 7 7 ASP N N 7 127.061 125.131 1.930 1
1 76 . 3 1 1 A 8 8 GLY C C 8 175.143 174.848 0.295 1
1 77 . 3 1 1 A 8 8 GLY CA C 8 46.553 46.924 -0.371 1
1 78 . 3 1 1 A 9 9 GLN H H 9 8.408 7.951 0.457 1
1 79 . 3 1 1 A 9 9 GLN HA H 9 4.541 4.247 0.294 1
1 86 . 3 1 1 A 9 9 GLN C C 9 176.463 176.789 -0.326 1
1 87 . 3 1 1 A 9 9 GLN CA C 9 55.167 55.350 -0.183 1
1 88 . 3 1 1 A 9 9 GLN CB C 9 29.376 27.902 1.474 1
1 90 . 3 1 1 A 9 9 GLN N N 9 118.300 116.574 1.726 1
1 92 . 3 1 1 A 10 10 GLY H H 10 8.162 8.712 -0.550 1
1 93 . 3 1 1 A 10 10 GLY HA2 H 10 4.174 3.974 0.200 1
1 94 . 3 1 1 A 10 10 GLY HA3 H 10 3.521 3.989 -0.468 1
1 95 . 3 1 1 A 10 10 GLY C C 10 174.092 173.634 0.458 1
1 96 . 3 1 1 A 10 10 GLY CA C 10 45.558 46.442 -0.884 1
1 97 . 3 1 1 A 10 10 GLY N N 10 108.747 111.134 -2.387 1
1 98 . 3 1 1 A 11 11 GLN H H 11 8.507 7.159 1.348 1
1 99 . 3 1 1 A 11 11 GLN HA H 11 4.202 5.035 -0.833 1
1 106 . 3 1 1 A 11 11 GLN C C 11 173.992 173.885 0.107 1
1 107 . 3 1 1 A 11 11 GLN CA C 11 55.098 53.847 1.251 1
1 108 . 3 1 1 A 11 11 GLN CB C 11 29.097 31.905 -2.808 1
1 110 . 3 1 1 A 11 11 GLN N N 11 122.979 114.496 8.483 1
1 112 . 3 1 1 A 12 12 ALA H H 12 8.259 8.728 -0.469 1
1 113 . 3 1 1 A 12 12 ALA HA H 12 5.156 5.848 -0.692 1
1 117 . 3 1 1 A 12 12 ALA C C 12 177.284 176.385 0.899 1
1 118 . 3 1 1 A 12 12 ALA CA C 12 51.087 50.294 0.793 1
1 119 . 3 1 1 A 12 12 ALA CB C 12 20.500 22.744 -2.244 1
1 120 . 3 1 1 A 12 12 ALA N N 12 127.100 123.149 3.951 1
1 121 . 3 1 1 A 13 13 TRP H H 13 9.245 9.107 0.138 1
1 122 . 3 1 1 A 13 13 TRP HA H 13 4.717 5.495 -0.778 1
1 131 . 3 1 1 A 13 13 TRP C C 13 175.108 173.798 1.310 1
1 132 . 3 1 1 A 13 13 TRP CA C 13 55.966 55.234 0.732 1
1 133 . 3 1 1 A 13 13 TRP CB C 13 31.912 32.444 -0.532 1
1 139 . 3 1 1 A 13 13 TRP N N 13 123.088 118.169 4.919 1
1 141 . 3 1 1 A 14 14 ARG H H 14 8.575 8.996 -0.421 1
1 142 . 3 1 1 A 14 14 ARG HA H 14 5.335 4.825 0.510 1
1 150 . 3 1 1 A 14 14 ARG C C 14 175.191 173.694 1.497 1
1 151 . 3 1 1 A 14 14 ARG CA C 14 53.106 55.344 -2.238 1
1 152 . 3 1 1 A 14 14 ARG CB C 14 32.749 33.741 -0.992 1
1 154 . 3 1 1 A 14 14 ARG N N 14 121.163 118.225 2.938 1
1 156 . 3 1 1 A 15 15 HIS H H 15 8.595 9.005 -0.410 1
1 157 . 3 1 1 A 15 15 HIS HA H 15 4.790 5.028 -0.238 1
1 161 . 3 1 1 A 15 15 HIS C C 15 173.770 174.031 -0.261 1
1 162 . 3 1 1 A 15 15 HIS CA C 15 55.289 54.571 0.718 1
1 163 . 3 1 1 A 15 15 HIS CB C 15 33.208 33.878 -0.670 1
1 165 . 3 1 1 A 15 15 HIS N N 15 117.643 116.134 1.509 1
1 166 . 3 1 1 A 16 16 HIS H H 16 8.993 9.169 -0.176 1
1 167 . 3 1 1 A 16 16 HIS HA H 16 5.158 4.946 0.212 1
1 171 . 3 1 1 A 16 16 HIS C C 16 173.608 175.418 -1.810 1
1 172 . 3 1 1 A 16 16 HIS CA C 16 56.450 55.394 1.056 1
1 173 . 3 1 1 A 16 16 HIS CB C 16 34.171 30.994 3.177 1
1 175 . 3 1 1 A 16 16 HIS N N 16 123.520 118.816 4.704 1
1 176 . 3 1 1 A 17 17 ASN H H 17 7.829 8.853 -1.024 1
1 177 . 3 1 1 A 17 17 ASN HA H 17 4.713 5.268 -0.555 1
1 182 . 3 1 1 A 17 17 ASN C C 17 173.682 175.255 -1.573 1
1 183 . 3 1 1 A 17 17 ASN CA C 17 51.822 51.577 0.245 1
1 184 . 3 1 1 A 17 17 ASN CB C 17 43.176 42.088 1.088 1
1 185 . 3 1 1 A 17 17 ASN N N 17 122.213 121.298 0.915 1
1 187 . 3 1 1 A 18 18 GLY H H 18 8.423 8.384 0.039 1
1 188 . 3 1 1 A 18 18 GLY HA2 H 18 3.931 4.014 -0.083 1
1 189 . 3 1 1 A 18 18 GLY HA3 H 18 3.707 4.064 -0.357 1
1 190 . 3 1 1 A 18 18 GLY C C 18 173.985 172.664 1.321 1
1 191 . 3 1 1 A 18 18 GLY CA C 18 43.949 44.611 -0.662 1
1 192 . 3 1 1 A 18 18 GLY N N 18 106.991 107.891 -0.900 1
1 193 . 3 1 1 A 19 19 PHE H H 19 8.338 8.758 -0.420 1
1 194 . 3 1 1 A 19 19 PHE HA H 19 4.068 4.921 -0.853 1
1 197 . 3 1 1 A 19 19 PHE C C 19 176.568 175.638 0.930 1
1 198 . 3 1 1 A 19 19 PHE CA C 19 59.338 57.615 1.723 1
1 199 . 3 1 1 A 19 19 PHE CB C 19 40.201 41.273 -1.072 1
1 200 . 3 1 1 A 19 19 PHE N N 19 116.857 119.071 -2.214 1
1 201 . 3 1 1 A 20 20 ASP H H 20 8.794 9.051 -0.257 1
1 202 . 3 1 1 A 20 20 ASP HA H 20 4.485 4.733 -0.248 1
1 205 . 3 1 1 A 20 20 ASP C C 20 177.379 177.052 0.327 1
1 206 . 3 1 1 A 20 20 ASP CA C 20 54.140 55.110 -0.970 1
1 207 . 3 1 1 A 20 20 ASP CB C 20 41.915 40.668 1.247 1
1 208 . 3 1 1 A 20 20 ASP N N 20 123.025 124.368 -1.343 1
1 209 . 3 1 1 A 21 21 PHE H H 21 8.862 9.144 -0.282 1
1 210 . 3 1 1 A 21 21 PHE HA H 21 4.087 4.092 -0.005 1
1 218 . 3 1 1 A 21 21 PHE C C 21 176.952 177.117 -0.165 1
1 219 . 3 1 1 A 21 21 PHE CA C 21 61.095 61.958 -0.863 1
1 220 . 3 1 1 A 21 21 PHE CB C 21 38.678 39.298 -0.620 1
1 226 . 3 1 1 A 21 21 PHE N N 21 127.163 126.146 1.017 1
1 227 . 3 1 1 A 22 22 ALA H H 22 8.561 8.382 0.179 1
1 228 . 3 1 1 A 22 22 ALA HA H 22 3.878 3.991 -0.113 1
1 232 . 3 1 1 A 22 22 ALA C C 22 180.710 180.130 0.580 1
1 233 . 3 1 1 A 22 22 ALA CA C 22 55.211 55.260 -0.049 1
1 234 . 3 1 1 A 22 22 ALA CB C 22 18.321 18.427 -0.106 1
1 235 . 3 1 1 A 22 22 ALA N N 22 120.293 121.261 -0.968 1
1 236 . 3 1 1 A 23 23 VAL H H 23 7.241 7.715 -0.474 1
1 237 . 3 1 1 A 23 23 VAL HA H 23 3.684 3.533 0.151 1
1 245 . 3 1 1 A 23 23 VAL C C 23 177.101 178.324 -1.223 1
1 246 . 3 1 1 A 23 23 VAL CA C 23 65.237 66.856 -1.619 1
1 247 . 3 1 1 A 23 23 VAL CB C 23 31.780 31.408 0.372 1
1 250 . 3 1 1 A 23 23 VAL N N 23 118.775 117.461 1.314 1
1 251 . 3 1 1 A 24 24 ILE H H 24 6.761 7.708 -0.947 1
1 252 . 3 1 1 A 24 24 ILE HA H 24 3.196 3.534 -0.338 1
1 262 . 3 1 1 A 24 24 ILE C C 24 177.287 177.975 -0.688 1
1 263 . 3 1 1 A 24 24 ILE CA C 24 63.404 65.378 -1.974 1
1 264 . 3 1 1 A 24 24 ILE CB C 24 36.294 37.463 -1.169 1
1 268 . 3 1 1 A 24 24 ILE N N 24 119.036 120.813 -1.777 1
1 269 . 3 1 1 A 25 25 LYS H H 25 8.032 8.077 -0.045 1
1 270 . 3 1 1 A 25 25 LYS HA H 25 3.809 3.681 0.128 1
1 279 . 3 1 1 A 25 25 LYS C C 25 179.450 177.940 1.510 1
1 280 . 3 1 1 A 25 25 LYS CA C 25 59.621 58.916 0.705 1
1 281 . 3 1 1 A 25 25 LYS CB C 25 32.259 31.735 0.524 1
1 285 . 3 1 1 A 25 25 LYS N N 25 118.368 120.199 -1.831 1
1 286 . 3 1 1 A 26 26 GLU H H 26 7.845 7.889 -0.044 1
1 287 . 3 1 1 A 26 26 GLU HA H 26 4.021 4.158 -0.137 1
1 292 . 3 1 1 A 26 26 GLU C C 26 179.191 178.846 0.345 1
1 293 . 3 1 1 A 26 26 GLU CA C 26 59.530 58.933 0.597 1
1 294 . 3 1 1 A 26 26 GLU CB C 26 29.449 29.479 -0.030 1
1 296 . 3 1 1 A 26 26 GLU N N 26 120.522 119.159 1.363 1
1 297 . 3 1 1 A 27 27 LEU H H 27 8.165 7.917 0.248 1
1 298 . 3 1 1 A 27 27 LEU HA H 27 4.163 4.074 0.089 1
1 308 . 3 1 1 A 27 27 LEU C C 27 177.256 178.369 -1.113 1
1 309 . 3 1 1 A 27 27 LEU CA C 27 58.049 57.462 0.587 1
1 310 . 3 1 1 A 27 27 LEU CB C 27 41.365 41.194 0.171 1
1 314 . 3 1 1 A 27 27 LEU N N 27 120.879 121.045 -0.166 1
1 315 . 3 1 1 A 28 28 LYS H H 28 8.902 8.010 0.892 1
1 316 . 3 1 1 A 28 28 LYS HA H 28 4.199 4.292 -0.093 1
1 317 . 3 1 1 A 28 28 LYS C C 28 179.707 179.404 0.303 1
1 318 . 3 1 1 A 28 28 LYS CA C 28 60.097 59.074 1.023 1
1 319 . 3 1 1 A 28 28 LYS CB C 28 33.420 31.757 1.663 1
1 320 . 3 1 1 A 28 28 LYS N N 28 120.050 119.491 0.559 1
1 321 . 3 1 1 A 29 29 THR H H 29 8.294 7.861 0.433 1
1 322 . 3 1 1 A 29 29 THR HA H 29 3.892 3.917 -0.025 1
1 327 . 3 1 1 A 29 29 THR C C 29 175.711 175.975 -0.264 1
1 328 . 3 1 1 A 29 29 THR CA C 29 66.846 66.291 0.555 1
1 329 . 3 1 1 A 29 29 THR CB C 29 68.794 68.730 0.064 1
1 331 . 3 1 1 A 29 29 THR N N 29 115.933 116.146 -0.213 1
1 332 . 3 1 1 A 30 30 ALA H H 30 8.244 8.903 -0.659 1
1 333 . 3 1 1 A 30 30 ALA HA H 30 4.241 4.329 -0.088 1
1 337 . 3 1 1 A 30 30 ALA C C 30 179.128 179.782 -0.654 1
1 338 . 3 1 1 A 30 30 ALA CA C 30 55.714 55.780 -0.066 1
1 339 . 3 1 1 A 30 30 ALA CB C 30 18.955 18.307 0.648 1
1 340 . 3 1 1 A 30 30 ALA N N 30 124.617 123.369 1.248 1
1 341 . 3 1 1 A 31 31 ALA H H 31 8.968 8.610 0.358 1
1 342 . 3 1 1 A 31 31 ALA HA H 31 3.890 4.058 -0.168 1
1 346 . 3 1 1 A 31 31 ALA C C 31 180.352 179.768 0.584 1
1 347 . 3 1 1 A 31 31 ALA CA C 31 55.454 55.550 -0.096 1
1 348 . 3 1 1 A 31 31 ALA CB C 31 17.124 18.563 -1.439 1
1 349 . 3 1 1 A 31 31 ALA N N 31 119.327 120.027 -0.700 1
1 350 . 3 1 1 A 32 32 SER H H 32 7.995 7.810 0.185 1
1 351 . 3 1 1 A 32 32 SER HA H 32 4.238 4.207 0.031 1
1 354 . 3 1 1 A 32 32 SER C C 32 175.612 175.602 0.010 1
1 355 . 3 1 1 A 32 32 SER CA C 32 61.203 61.367 -0.164 1
1 356 . 3 1 1 A 32 32 SER CB C 32 63.406 63.395 0.011 1
1 357 . 3 1 1 A 32 32 SER N N 32 111.962 113.558 -1.596 1
1 358 . 3 1 1 A 33 33 GLN H H 33 8.333 8.100 0.233 1
1 359 . 3 1 1 A 33 33 GLN HA H 33 3.992 4.302 -0.310 1
1 366 . 3 1 1 A 33 33 GLN C C 33 177.486 177.083 0.403 1
1 367 . 3 1 1 A 33 33 GLN CA C 33 58.277 57.592 0.685 1
1 368 . 3 1 1 A 33 33 GLN CB C 33 29.140 30.265 -1.125 1
1 370 . 3 1 1 A 33 33 GLN N N 33 119.527 118.761 0.766 1
1 372 . 3 1 1 A 34 34 TYR H H 34 8.587 8.319 0.268 1
1 373 . 3 1 1 A 34 34 TYR HA H 34 4.792 4.696 0.096 1
1 380 . 3 1 1 A 34 34 TYR C C 34 176.499 176.639 -0.140 1
1 381 . 3 1 1 A 34 34 TYR CA C 34 57.711 58.729 -1.018 1
1 382 . 3 1 1 A 34 34 TYR CB C 34 39.561 39.787 -0.226 1
1 387 . 3 1 1 A 34 34 TYR N N 34 114.610 114.036 0.574 1
1 388 . 3 1 1 A 35 35 GLY H H 35 7.346 8.582 -1.236 1
1 389 . 3 1 1 A 35 35 GLY HA2 H 35 4.785 4.116 0.669 1
1 390 . 3 1 1 A 35 35 GLY HA3 H 35 4.007 4.125 -0.118 1
1 391 . 3 1 1 A 35 35 GLY C C 35 175.796 173.613 2.183 1
1 392 . 3 1 1 A 35 35 GLY CA C 35 44.355 45.103 -0.748 1
1 393 . 3 1 1 A 35 35 GLY N N 35 108.501 107.303 1.198 1
1 394 . 3 1 1 A 36 36 ALA H H 36 9.363 8.312 1.051 1
1 395 . 3 1 1 A 36 36 ALA HA H 36 4.217 4.479 -0.262 1
1 399 . 3 1 1 A 36 36 ALA C C 36 178.039 178.352 -0.313 1
1 400 . 3 1 1 A 36 36 ALA CA C 36 56.114 51.847 4.267 1
1 401 . 3 1 1 A 36 36 ALA CB C 36 19.179 19.877 -0.698 1
1 402 . 3 1 1 A 36 36 ALA N N 36 125.811 125.039 0.772 1
1 403 . 3 1 1 A 37 37 THR H H 37 8.070 8.758 -0.688 1
1 404 . 3 1 1 A 37 37 THR HA H 37 4.570 4.145 0.425 1
1 409 . 3 1 1 A 37 37 THR C C 37 173.685 173.358 0.327 1
1 410 . 3 1 1 A 37 37 THR CA C 37 59.822 63.597 -3.775 1
1 411 . 3 1 1 A 37 37 THR CB C 37 68.267 66.771 1.496 1
1 413 . 3 1 1 A 37 37 THR N N 37 129.410 115.898 13.512 1
1 414 . 3 1 1 A 38 38 ALA H H 38 6.853 7.734 -0.881 1
1 415 . 3 1 1 A 38 38 ALA HA H 38 4.601 4.648 -0.047 1
1 419 . 3 1 1 A 38 38 ALA CA C 38 50.758 49.857 0.901 1
1 420 . 3 1 1 A 38 38 ALA CB C 38 18.325 20.172 -1.847 1
1 421 . 3 1 1 A 38 38 ALA N N 38 124.674 124.766 -0.092 1
1 422 . 3 1 1 A 40 40 TYR HA H 40 4.032 4.014 0.018 1
1 429 . 3 1 1 A 40 40 TYR C C 40 176.456 177.158 -0.702 1
1 430 . 3 1 1 A 40 40 TYR CA C 40 61.010 61.723 -0.713 1
1 431 . 3 1 1 A 40 40 TYR CB C 40 39.286 38.591 0.695 1
1 436 . 3 1 1 A 41 41 THR H H 41 6.874 8.162 -1.288 1
1 437 . 3 1 1 A 41 41 THR HA H 41 3.616 3.763 -0.147 1
1 442 . 3 1 1 A 41 41 THR C C 41 176.930 177.410 -0.480 1
1 443 . 3 1 1 A 41 41 THR CA C 41 65.557 66.785 -1.228 1
1 444 . 3 1 1 A 41 41 THR CB C 41 68.228 68.744 -0.516 1
1 446 . 3 1 1 A 41 41 THR N N 41 115.143 113.742 1.401 1
1 447 . 3 1 1 A 42 42 LEU H H 42 8.623 7.454 1.169 1
1 448 . 3 1 1 A 42 42 LEU HA H 42 3.708 3.970 -0.262 1
1 458 . 3 1 1 A 42 42 LEU C C 42 178.206 178.883 -0.677 1
1 459 . 3 1 1 A 42 42 LEU CA C 42 57.417 57.809 -0.392 1
1 460 . 3 1 1 A 42 42 LEU CB C 42 41.342 41.200 0.142 1
1 464 . 3 1 1 A 42 42 LEU N N 42 120.418 117.762 2.656 1
1 465 . 3 1 1 A 43 43 ALA H H 43 7.735 7.852 -0.117 1
1 466 . 3 1 1 A 43 43 ALA HA H 43 4.020 3.975 0.045 1
1 470 . 3 1 1 A 43 43 ALA C C 43 180.826 180.593 0.233 1
1 471 . 3 1 1 A 43 43 ALA CA C 43 54.925 54.974 -0.049 1
1 472 . 3 1 1 A 43 43 ALA CB C 43 17.506 18.331 -0.825 1
1 473 . 3 1 1 A 43 43 ALA N N 43 120.203 121.704 -1.501 1
1 474 . 3 1 1 A 44 44 ILE H H 44 7.149 7.382 -0.233 1
1 475 . 3 1 1 A 44 44 ILE HA H 44 3.603 3.626 -0.023 1
1 485 . 3 1 1 A 44 44 ILE C C 44 178.594 178.422 0.172 1
1 486 . 3 1 1 A 44 44 ILE CA C 44 64.782 63.926 0.856 1
1 487 . 3 1 1 A 44 44 ILE CB C 44 37.472 36.414 1.058 1
1 491 . 3 1 1 A 44 44 ILE N N 44 118.881 119.236 -0.355 1
1 492 . 3 1 1 A 45 45 VAL H H 45 7.968 7.809 0.159 1
1 493 . 3 1 1 A 45 45 VAL HA H 45 2.925 3.289 -0.364 1
1 501 . 3 1 1 A 45 45 VAL C C 45 177.023 177.652 -0.629 1
1 502 . 3 1 1 A 45 45 VAL CA C 45 67.081 66.801 0.280 1
1 503 . 3 1 1 A 45 45 VAL CB C 45 30.854 31.087 -0.233 1
1 506 . 3 1 1 A 45 45 VAL N N 45 120.764 120.511 0.253 1
1 507 . 3 1 1 A 46 46 GLU H H 46 8.399 8.256 0.143 1
1 508 . 3 1 1 A 46 46 GLU HA H 46 3.848 3.936 -0.088 1
1 513 . 3 1 1 A 46 46 GLU C C 46 178.656 178.419 0.237 1
1 514 . 3 1 1 A 46 46 GLU CA C 46 59.491 58.588 0.903 1
1 515 . 3 1 1 A 46 46 GLU CB C 46 28.991 27.965 1.026 1
1 517 . 3 1 1 A 46 46 GLU N N 46 116.599 119.616 -3.017 1
1 518 . 3 1 1 A 47 47 SER H H 47 7.273 7.646 -0.373 1
1 519 . 3 1 1 A 47 47 SER HA H 47 4.287 4.087 0.200 1
1 521 . 3 1 1 A 47 47 SER CA C 47 61.047 62.477 -1.430 1
1 522 . 3 1 1 A 47 47 SER CB C 47 63.016 62.984 0.032 1
1 523 . 3 1 1 A 47 47 SER N N 47 113.609 117.639 -4.030 1
1 524 . 3 1 1 A 48 48 VAL H H 48 8.006 8.081 -0.075 1
1 525 . 3 1 1 A 48 48 VAL HA H 48 3.556 3.832 -0.276 1
1 533 . 3 1 1 A 48 48 VAL C C 48 177.257 176.871 0.386 1
1 534 . 3 1 1 A 48 48 VAL CA C 48 65.025 64.641 0.384 1
1 535 . 3 1 1 A 48 48 VAL CB C 48 31.841 31.694 0.147 1
1 538 . 3 1 1 A 48 48 VAL N N 48 122.327 118.818 3.509 1
1 539 . 3 1 1 A 49 49 ALA H H 49 8.369 7.687 0.682 1
1 540 . 3 1 1 A 49 49 ALA HA H 49 4.115 4.279 -0.164 1
1 544 . 3 1 1 A 49 49 ALA C C 49 177.307 177.234 0.073 1
1 545 . 3 1 1 A 49 49 ALA CA C 49 53.253 52.229 1.024 1
1 546 . 3 1 1 A 49 49 ALA CB C 49 20.131 18.307 1.824 1
1 547 . 3 1 1 A 49 49 ALA N N 49 118.050 123.691 -5.641 1
1 548 . 3 1 1 A 50 50 ASP H H 50 7.052 7.767 -0.715 1
1 549 . 3 1 1 A 50 50 ASP HA H 50 4.788 4.589 0.199 1
1 552 . 3 1 1 A 50 50 ASP C C 50 175.481 176.071 -0.590 1
1 553 . 3 1 1 A 50 50 ASP CA C 50 53.681 53.664 0.017 1
1 554 . 3 1 1 A 50 50 ASP CB C 50 39.333 40.988 -1.655 1
1 555 . 3 1 1 A 50 50 ASP N N 50 116.997 117.074 -0.077 1
1 556 . 3 1 1 A 51 51 ASN H H 51 8.535 7.751 0.784 1
1 557 . 3 1 1 A 51 51 ASN HA H 51 4.628 4.839 -0.211 1
1 562 . 3 1 1 A 51 51 ASN C C 51 174.077 174.750 -0.673 1
1 563 . 3 1 1 A 51 51 ASN CA C 51 52.315 51.797 0.518 1
1 564 . 3 1 1 A 51 51 ASN CB C 51 41.928 40.813 1.115 1
1 565 . 3 1 1 A 51 51 ASN N N 51 118.626 117.438 1.188 1
1 567 . 3 1 1 A 52 52 TRP H H 52 8.555 8.565 -0.010 1
1 574 . 3 1 1 A 52 52 TRP C C 52 173.269 176.489 -3.220 1
1 575 . 3 1 1 A 52 52 TRP CA C 52 55.031 56.442 -1.411 1
1 576 . 3 1 1 A 52 52 TRP CB C 52 26.801 30.299 -3.498 1
1 582 . 3 1 1 A 52 52 TRP N N 52 120.693 119.882 0.811 1
1 584 . 3 1 1 A 53 53 LEU H H 53 7.847 8.943 -1.096 1
1 585 . 3 1 1 A 53 53 LEU HA H 53 4.859 5.233 -0.374 1
1 595 . 3 1 1 A 53 53 LEU C C 53 177.397 175.396 2.001 1
1 596 . 3 1 1 A 53 53 LEU CA C 53 53.619 53.562 0.057 1
1 597 . 3 1 1 A 53 53 LEU CB C 53 41.812 45.668 -3.856 1
1 601 . 3 1 1 A 53 53 LEU N N 53 124.741 120.735 4.006 1
1 602 . 3 1 1 A 54 54 THR H H 54 8.850 7.979 0.871 1
1 603 . 3 1 1 A 54 54 THR HA H 54 4.598 4.752 -0.154 1
1 608 . 3 1 1 A 54 54 THR CA C 54 60.531 59.358 1.173 1
1 609 . 3 1 1 A 54 54 THR CB C 54 67.183 69.184 -2.001 1
1 611 . 3 1 1 A 54 54 THR N N 54 113.407 110.641 2.766 1
1 612 . 3 1 1 A 55 55 PRO HA H 55 4.511 4.090 0.421 1
1 619 . 3 1 1 A 55 55 PRO C C 55 179.383 178.638 0.745 1
1 620 . 3 1 1 A 55 55 PRO CA C 55 67.159 64.617 2.542 1
1 621 . 3 1 1 A 55 55 PRO CB C 55 32.095 31.631 0.464 1
1 622 . 3 1 1 A 56 56 THR H H 56 8.575 7.703 0.872 1
1 623 . 3 1 1 A 56 56 THR HA H 56 4.229 4.003 0.226 1
1 628 . 3 1 1 A 56 56 THR C C 56 176.668 176.175 0.493 1
1 629 . 3 1 1 A 56 56 THR CA C 56 66.943 65.835 1.108 1
1 630 . 3 1 1 A 56 56 THR CB C 56 68.129 68.045 0.084 1
1 632 . 3 1 1 A 56 56 THR N N 56 114.855 112.075 2.780 1
1 633 . 3 1 1 A 57 57 ASP H H 57 8.730 8.259 0.471 1
1 634 . 3 1 1 A 57 57 ASP HA H 57 4.425 4.341 0.084 1
1 637 . 3 1 1 A 57 57 ASP C C 57 178.351 179.408 -1.057 1
1 638 . 3 1 1 A 57 57 ASP CA C 57 57.963 57.152 0.811 1
1 639 . 3 1 1 A 57 57 ASP CB C 57 40.134 39.596 0.538 1
1 640 . 3 1 1 A 57 57 ASP N N 57 126.239 120.184 6.055 1
1 641 . 3 1 1 A 58 58 TRP H H 58 8.244 8.430 -0.186 1
1 642 . 3 1 1 A 58 58 TRP HA H 58 4.030 4.428 -0.398 1
1 650 . 3 1 1 A 58 58 TRP C C 58 177.432 179.318 -1.886 1
1 651 . 3 1 1 A 58 58 TRP CA C 58 62.731 59.846 2.885 1
1 652 . 3 1 1 A 58 58 TRP CB C 58 29.122 29.211 -0.089 1
1 657 . 3 1 1 A 58 58 TRP N N 58 119.241 120.271 -1.030 1
1 659 . 3 1 1 A 59 59 ASN H H 59 8.098 8.563 -0.465 1
1 660 . 3 1 1 A 59 59 ASN HA H 59 4.424 4.416 0.008 1
1 663 . 3 1 1 A 59 59 ASN C C 59 176.952 177.962 -1.010 1
1 664 . 3 1 1 A 59 59 ASN CA C 59 58.135 56.450 1.685 1
1 665 . 3 1 1 A 59 59 ASN CB C 59 40.168 38.135 2.033 1
1 666 . 3 1 1 A 59 59 ASN N N 59 115.747 117.935 -2.188 1
1 667 . 3 1 1 A 60 60 THR H H 60 8.712 7.852 0.860 1
1 668 . 3 1 1 A 60 60 THR HA H 60 3.717 4.075 -0.358 1
1 673 . 3 1 1 A 60 60 THR C C 60 176.044 176.619 -0.575 1
1 674 . 3 1 1 A 60 60 THR CA C 60 66.576 67.118 -0.542 1
1 675 . 3 1 1 A 60 60 THR CB C 60 69.251 67.972 1.279 1
1 677 . 3 1 1 A 60 60 THR N N 60 114.896 118.459 -3.563 1
1 678 . 3 1 1 A 61 61 LEU H H 61 8.485 8.462 0.023 1
1 679 . 3 1 1 A 61 61 LEU HA H 61 3.391 4.044 -0.653 1
1 689 . 3 1 1 A 61 61 LEU C C 61 177.433 178.751 -1.318 1
1 690 . 3 1 1 A 61 61 LEU CA C 61 58.354 58.708 -0.354 1
1 691 . 3 1 1 A 61 61 LEU CB C 61 41.761 42.257 -0.496 1
1 695 . 3 1 1 A 61 61 LEU N N 61 123.433 122.057 1.376 1
1 696 . 3 1 1 A 62 62 VAL H H 62 8.073 8.436 -0.363 1
1 697 . 3 1 1 A 62 62 VAL HA H 62 3.207 3.801 -0.594 1
1 705 . 3 1 1 A 62 62 VAL C C 62 177.585 177.331 0.254 1
1 706 . 3 1 1 A 62 62 VAL CA C 62 67.345 65.333 2.012 1
1 707 . 3 1 1 A 62 62 VAL CB C 62 30.905 30.648 0.257 1
1 710 . 3 1 1 A 62 62 VAL N N 62 116.018 118.509 -2.491 1
1 711 . 3 1 1 A 63 63 ARG H H 63 7.765 8.015 -0.250 1
1 712 . 3 1 1 A 63 63 ARG HA H 63 3.602 4.025 -0.423 1
1 719 . 3 1 1 A 63 63 ARG C C 63 177.818 178.183 -0.365 1
1 720 . 3 1 1 A 63 63 ARG CA C 63 58.049 58.220 -0.171 1
1 721 . 3 1 1 A 63 63 ARG CB C 63 29.955 29.362 0.593 1
1 724 . 3 1 1 A 63 63 ARG N N 63 116.700 120.699 -3.999 1
1 725 . 3 1 1 A 64 64 ALA H H 64 7.574 7.560 0.014 1
1 726 . 3 1 1 A 64 64 ALA HA H 64 4.158 4.387 -0.229 1
1 730 . 3 1 1 A 64 64 ALA C C 64 179.886 179.398 0.488 1
1 731 . 3 1 1 A 64 64 ALA CA C 64 54.007 54.104 -0.097 1
1 732 . 3 1 1 A 64 64 ALA CB C 64 19.147 19.646 -0.499 1
1 733 . 3 1 1 A 64 64 ALA N N 64 117.555 121.535 -3.980 1
1 734 . 3 1 1 A 65 65 VAL H H 65 7.554 8.070 -0.516 1
1 735 . 3 1 1 A 65 65 VAL HA H 65 4.253 3.578 0.675 1
1 743 . 3 1 1 A 65 65 VAL C C 65 174.180 175.956 -1.776 1
1 744 . 3 1 1 A 65 65 VAL CA C 65 62.683 66.867 -4.184 1
1 745 . 3 1 1 A 65 65 VAL CB C 65 33.458 32.077 1.381 1
1 748 . 3 1 1 A 65 65 VAL N N 65 110.013 118.421 -8.408 1
1 749 . 3 1 1 A 66 66 LEU H H 66 7.792 7.575 0.217 1
1 750 . 3 1 1 A 66 66 LEU HA H 66 4.790 4.756 0.034 1
1 760 . 3 1 1 A 66 66 LEU C C 66 177.537 175.614 1.923 1
1 761 . 3 1 1 A 66 66 LEU CA C 66 52.823 52.626 0.197 1
1 762 . 3 1 1 A 66 66 LEU CB C 66 44.071 45.495 -1.424 1
1 766 . 3 1 1 A 66 66 LEU N N 66 118.967 118.267 0.700 1
1 767 . 3 1 1 A 67 67 SER H H 67 9.208 8.308 0.900 1
1 768 . 3 1 1 A 67 67 SER HA H 67 4.414 4.944 -0.530 1
1 771 . 3 1 1 A 67 67 SER CA C 67 57.943 57.643 0.300 1
1 772 . 3 1 1 A 67 67 SER CB C 67 64.743 66.116 -1.373 1
1 773 . 3 1 1 A 67 67 SER N N 67 116.378 115.580 0.798 1
1 774 . 3 1 1 A 69 69 GLY HA2 H 69 3.916 3.794 0.122 1
1 775 . 3 1 1 A 69 69 GLY HA3 H 69 3.867 3.812 0.055 1
1 776 . 3 1 1 A 69 69 GLY C C 69 176.783 175.516 1.267 1
1 777 . 3 1 1 A 69 69 GLY CA C 69 46.977 46.553 0.424 1
1 778 . 3 1 1 A 70 70 ASP H H 70 7.674 8.150 -0.476 1
1 779 . 3 1 1 A 70 70 ASP HA H 70 4.511 3.740 0.771 1
1 782 . 3 1 1 A 70 70 ASP C C 70 178.096 178.163 -0.067 1
1 783 . 3 1 1 A 70 70 ASP CA C 70 57.262 56.434 0.828 1
1 784 . 3 1 1 A 70 70 ASP CB C 70 40.594 39.634 0.960 1
1 785 . 3 1 1 A 70 70 ASP N N 70 123.930 121.448 2.482 1
1 786 . 3 1 1 A 71 71 HIS H H 71 8.729 7.784 0.945 1
1 787 . 3 1 1 A 71 71 HIS HA H 71 4.235 4.225 0.010 1
1 790 . 3 1 1 A 71 71 HIS C C 71 176.769 176.905 -0.136 1
1 791 . 3 1 1 A 71 71 HIS CA C 71 60.041 59.724 0.317 1
1 792 . 3 1 1 A 71 71 HIS CB C 71 30.682 30.425 0.257 1
1 793 . 3 1 1 A 71 71 HIS N N 71 121.003 119.583 1.420 1
1 794 . 3 1 1 A 72 72 LEU H H 72 7.620 7.998 -0.378 1
1 795 . 3 1 1 A 72 72 LEU HA H 72 3.769 3.992 -0.223 1
1 805 . 3 1 1 A 72 72 LEU C C 72 180.275 179.060 1.215 1
1 806 . 3 1 1 A 72 72 LEU CA C 72 58.192 57.985 0.207 1
1 807 . 3 1 1 A 72 72 LEU CB C 72 41.381 41.463 -0.082 1
1 811 . 3 1 1 A 72 72 LEU N N 72 118.569 118.736 -0.167 1
1 812 . 3 1 1 A 73 73 LEU H H 73 7.542 7.591 -0.049 1
1 813 . 3 1 1 A 73 73 LEU HA H 73 4.107 4.243 -0.136 1
1 823 . 3 1 1 A 73 73 LEU C C 73 179.436 179.081 0.355 1
1 824 . 3 1 1 A 73 73 LEU CA C 73 58.026 57.241 0.785 1
1 825 . 3 1 1 A 73 73 LEU CB C 73 41.638 42.158 -0.520 1
1 829 . 3 1 1 A 73 73 LEU N N 73 121.418 120.114 1.304 1
1 830 . 3 1 1 A 74 74 TRP H H 74 8.786 7.997 0.789 1
1 831 . 3 1 1 A 74 74 TRP HA H 74 3.589 5.306 -1.717 1
1 840 . 3 1 1 A 74 74 TRP C C 74 176.816 178.667 -1.851 1
1 841 . 3 1 1 A 74 74 TRP CA C 74 63.046 59.866 3.180 1
1 842 . 3 1 1 A 74 74 TRP CB C 74 28.065 28.985 -0.920 1
1 848 . 3 1 1 A 74 74 TRP N N 74 121.111 118.129 2.982 1
1 850 . 3 1 1 A 75 75 LYS H H 75 8.939 7.497 1.442 1
1 851 . 3 1 1 A 75 75 LYS HA H 75 3.055 4.067 -1.012 1
1 860 . 3 1 1 A 75 75 LYS C C 75 177.967 179.295 -1.328 1
1 861 . 3 1 1 A 75 75 LYS CA C 75 60.029 58.446 1.583 1
1 862 . 3 1 1 A 75 75 LYS CB C 75 32.533 32.669 -0.136 1
1 866 . 3 1 1 A 75 75 LYS N N 75 119.783 118.622 1.161 1
1 867 . 3 1 1 A 76 76 SER H H 76 7.832 8.204 -0.372 1
1 868 . 3 1 1 A 76 76 SER HA H 76 4.040 4.524 -0.484 1
1 871 . 3 1 1 A 76 76 SER C C 76 177.816 177.048 0.768 1
1 872 . 3 1 1 A 76 76 SER CA C 76 62.105 61.946 0.159 1
1 873 . 3 1 1 A 76 76 SER CB C 76 62.679 62.965 -0.286 1
1 874 . 3 1 1 A 76 76 SER N N 76 113.395 117.136 -3.741 1
1 875 . 3 1 1 A 77 77 GLU H H 77 7.590 7.540 0.050 1
1 876 . 3 1 1 A 77 77 GLU HA H 77 4.042 4.303 -0.261 1
1 881 . 3 1 1 A 77 77 GLU C C 77 177.809 178.618 -0.809 1
1 882 . 3 1 1 A 77 77 GLU CA C 77 58.270 58.563 -0.293 1
1 883 . 3 1 1 A 77 77 GLU CB C 77 29.208 29.448 -0.240 1
1 885 . 3 1 1 A 77 77 GLU N N 77 121.574 122.638 -1.064 1
1 886 . 3 1 1 A 78 78 PHE H H 78 9.081 7.844 1.237 1
1 887 . 3 1 1 A 78 78 PHE HA H 78 3.778 4.221 -0.443 1
1 895 . 3 1 1 A 78 78 PHE C C 78 178.114 177.546 0.568 1
1 896 . 3 1 1 A 78 78 PHE CA C 78 60.629 61.288 -0.659 1
1 897 . 3 1 1 A 78 78 PHE CB C 78 38.295 38.714 -0.419 1
1 902 . 3 1 1 A 78 78 PHE N N 78 122.682 122.217 0.465 1
1 903 . 3 1 1 A 79 79 PHE H H 79 8.890 8.042 0.848 1
1 904 . 3 1 1 A 79 79 PHE HA H 79 3.800 4.034 -0.234 1
1 912 . 3 1 1 A 79 79 PHE C C 79 178.354 178.258 0.096 1
1 913 . 3 1 1 A 79 79 PHE CA C 79 60.704 62.142 -1.438 1
1 914 . 3 1 1 A 79 79 PHE CB C 79 37.184 38.558 -1.374 1
1 920 . 3 1 1 A 79 79 PHE N N 79 121.056 118.099 2.957 1
1 921 . 3 1 1 A 80 80 GLU H H 80 7.793 8.210 -0.417 1
1 922 . 3 1 1 A 80 80 GLU HA H 80 4.082 3.969 0.113 1
1 927 . 3 1 1 A 80 80 GLU C C 80 179.068 179.355 -0.287 1
1 928 . 3 1 1 A 80 80 GLU CA C 80 59.735 59.551 0.184 1
1 929 . 3 1 1 A 80 80 GLU CB C 80 28.722 29.129 -0.407 1
1 931 . 3 1 1 A 80 80 GLU N N 80 120.312 118.308 2.004 1
1 932 . 3 1 1 A 81 81 ASN H H 81 8.624 8.673 -0.049 1
1 933 . 3 1 1 A 81 81 ASN HA H 81 4.521 4.447 0.074 1
1 938 . 3 1 1 A 81 81 ASN C C 81 179.262 178.029 1.233 1
1 939 . 3 1 1 A 81 81 ASN CA C 81 55.504 56.778 -1.274 1
1 940 . 3 1 1 A 81 81 ASN CB C 81 37.517 38.066 -0.549 1
1 941 . 3 1 1 A 81 81 ASN N N 81 119.338 118.519 0.819 1
1 943 . 3 1 1 A 82 82 CYS H H 82 8.554 8.187 0.367 1
1 944 . 3 1 1 A 82 82 CYS HA H 82 3.792 3.993 -0.201 1
1 947 . 3 1 1 A 82 82 CYS C C 82 176.478 176.691 -0.213 1
1 948 . 3 1 1 A 82 82 CYS CA C 82 65.232 61.873 3.359 1
1 949 . 3 1 1 A 82 82 CYS CB C 82 26.762 26.769 -0.007 1
1 950 . 3 1 1 A 82 82 CYS N N 82 120.576 118.502 2.074 1
1 951 . 3 1 1 A 83 83 ARG H H 83 8.522 7.769 0.753 1
1 952 . 3 1 1 A 83 83 ARG HA H 83 3.932 4.165 -0.233 1
1 960 . 3 1 1 A 83 83 ARG C C 83 179.138 178.758 0.380 1
1 961 . 3 1 1 A 83 83 ARG CA C 83 60.443 59.019 1.424 1
1 962 . 3 1 1 A 83 83 ARG CB C 83 29.550 29.725 -0.175 1
1 965 . 3 1 1 A 83 83 ARG N N 83 123.035 120.419 2.616 1
1 967 . 3 1 1 A 84 84 ASP H H 84 7.791 8.352 -0.561 1
1 968 . 3 1 1 A 84 84 ASP HA H 84 4.353 4.421 -0.068 1
1 971 . 3 1 1 A 84 84 ASP C C 84 178.649 178.703 -0.054 1
1 972 . 3 1 1 A 84 84 ASP CA C 84 57.767 57.589 0.178 1
1 973 . 3 1 1 A 84 84 ASP CB C 84 41.305 41.659 -0.354 1
1 974 . 3 1 1 A 84 84 ASP N N 84 120.332 119.473 0.859 1
1 975 . 3 1 1 A 85 85 THR H H 85 8.370 7.935 0.435 1
1 976 . 3 1 1 A 85 85 THR HA H 85 3.730 3.910 -0.180 1
1 981 . 3 1 1 A 85 85 THR C C 85 175.198 176.269 -1.071 1
1 982 . 3 1 1 A 85 85 THR CA C 85 66.830 66.372 0.458 1
1 983 . 3 1 1 A 85 85 THR CB C 85 68.533 68.299 0.234 1
1 985 . 3 1 1 A 85 85 THR N N 85 117.360 115.758 1.602 1
1 986 . 3 1 1 A 86 86 ALA H H 86 8.845 8.022 0.823 1
1 987 . 3 1 1 A 86 86 ALA HA H 86 3.991 4.159 -0.168 1
1 991 . 3 1 1 A 86 86 ALA C C 86 179.980 179.644 0.336 1
1 992 . 3 1 1 A 86 86 ALA CA C 86 55.769 55.241 0.528 1
1 993 . 3 1 1 A 86 86 ALA CB C 86 17.881 18.369 -0.488 1
1 994 . 3 1 1 A 86 86 ALA N N 86 123.613 123.810 -0.197 1
1 995 . 3 1 1 A 87 87 LYS H H 87 7.686 8.090 -0.404 1
1 996 . 3 1 1 A 87 87 LYS HA H 87 4.099 4.096 0.003 1
1 1005 . 3 1 1 A 87 87 LYS C C 87 179.592 179.467 0.125 1
1 1006 . 3 1 1 A 87 87 LYS CA C 87 59.708 59.542 0.166 1
1 1007 . 3 1 1 A 87 87 LYS CB C 87 32.054 32.187 -0.133 1
1 1011 . 3 1 1 A 87 87 LYS N N 87 119.623 118.003 1.620 1
1 1012 . 3 1 1 A 88 88 ARG H H 88 7.683 7.601 0.082 1
1 1013 . 3 1 1 A 88 88 ARG HA H 88 4.051 4.162 -0.111 1
1 1020 . 3 1 1 A 88 88 ARG C C 88 180.053 178.865 1.188 1
1 1021 . 3 1 1 A 88 88 ARG CA C 88 59.558 59.074 0.484 1
1 1022 . 3 1 1 A 88 88 ARG CB C 88 29.684 30.073 -0.389 1
1 1025 . 3 1 1 A 88 88 ARG N N 88 120.788 119.761 1.027 1
1 1026 . 3 1 1 A 89 89 ASN H H 89 8.973 8.257 0.716 1
1 1027 . 3 1 1 A 89 89 ASN HA H 89 4.354 4.664 -0.310 1
1 1032 . 3 1 1 A 89 89 ASN C C 89 178.382 178.492 -0.110 1
1 1033 . 3 1 1 A 89 89 ASN CA C 89 55.334 55.945 -0.611 1
1 1034 . 3 1 1 A 89 89 ASN CB C 89 37.864 38.015 -0.151 1
1 1035 . 3 1 1 A 89 89 ASN N N 89 121.012 118.207 2.805 1
1 1037 . 3 1 1 A 90 90 GLN H H 90 8.152 7.925 0.227 1
1 1038 . 3 1 1 A 90 90 GLN HA H 90 4.020 4.196 -0.176 1
1 1045 . 3 1 1 A 90 90 GLN C C 90 179.075 178.718 0.357 1
1 1046 . 3 1 1 A 90 90 GLN CA C 90 59.318 58.848 0.470 1
1 1047 . 3 1 1 A 90 90 GLN CB C 90 28.049 28.558 -0.509 1
1 1049 . 3 1 1 A 90 90 GLN N N 90 122.122 120.718 1.404 1
1 1051 . 3 1 1 A 91 91 GLN H H 91 7.514 8.471 -0.957 1
1 1052 . 3 1 1 A 91 91 GLN HA H 91 4.053 4.071 -0.018 1
1 1059 . 3 1 1 A 91 91 GLN C C 91 177.081 177.946 -0.865 1
1 1060 . 3 1 1 A 91 91 GLN CA C 91 58.031 58.498 -0.467 1
1 1061 . 3 1 1 A 91 91 GLN CB C 91 28.365 28.179 0.186 1
1 1063 . 3 1 1 A 91 91 GLN N N 91 118.124 118.136 -0.012 1
1 1065 . 3 1 1 A 92 92 ALA H H 92 7.704 7.491 0.213 1
1 1066 . 3 1 1 A 92 92 ALA HA H 92 4.246 4.327 -0.081 1
1 1070 . 3 1 1 A 92 92 ALA C C 92 178.450 178.093 0.357 1
1 1071 . 3 1 1 A 92 92 ALA CA C 92 52.671 52.428 0.243 1
1 1072 . 3 1 1 A 92 92 ALA CB C 92 19.316 19.621 -0.305 1
1 1073 . 3 1 1 A 92 92 ALA N N 92 119.880 119.236 0.644 1
1 1074 . 3 1 1 A 93 93 GLY H H 93 7.693 7.890 -0.197 1
1 1075 . 3 1 1 A 93 93 GLY HA2 H 93 3.941 3.955 -0.014 1
1 1076 . 3 1 1 A 93 93 GLY HA3 H 93 3.744 3.964 -0.220 1
1 1077 . 3 1 1 A 93 93 GLY C C 93 174.344 174.633 -0.289 1
1 1078 . 3 1 1 A 93 93 GLY CA C 93 45.949 46.507 -0.558 1
1 1079 . 3 1 1 A 93 93 GLY N N 93 105.347 107.722 -2.375 1
1 1080 . 3 1 1 A 94 94 ASN H H 94 7.076 8.430 -1.354 1
1 1081 . 3 1 1 A 94 94 ASN HA H 94 4.115 4.995 -0.880 1
1 1085 . 3 1 1 A 94 94 ASN C C 94 175.410 175.702 -0.292 1
1 1086 . 3 1 1 A 94 94 ASN CA C 94 52.651 52.271 0.380 1
1 1087 . 3 1 1 A 94 94 ASN CB C 94 38.330 40.304 -1.974 1
1 1088 . 3 1 1 A 94 94 ASN N N 94 115.747 117.946 -2.199 1
1 1090 . 3 1 1 A 95 95 GLY H H 95 8.236 8.185 0.051 1
1 1091 . 3 1 1 A 95 95 GLY HA2 H 95 3.633 3.396 0.237 1
1 1092 . 3 1 1 A 95 95 GLY HA3 H 95 3.633 3.593 0.040 1
1 1093 . 3 1 1 A 95 95 GLY C C 95 174.450 173.049 1.401 1
1 1094 . 3 1 1 A 95 95 GLY CA C 95 45.522 46.390 -0.868 1
1 1095 . 3 1 1 A 95 95 GLY N N 95 109.166 108.249 0.917 1
1 1096 . 3 1 1 A 96 96 TRP H H 96 7.899 7.616 0.283 1
1 1097 . 3 1 1 A 96 96 TRP HA H 96 5.241 5.279 -0.038 1
1 1106 . 3 1 1 A 96 96 TRP C C 96 175.661 174.384 1.277 1
1 1107 . 3 1 1 A 96 96 TRP CA C 96 55.090 55.790 -0.700 1
1 1108 . 3 1 1 A 96 96 TRP CB C 96 27.138 34.254 -7.116 1
1 1114 . 3 1 1 A 96 96 TRP N N 96 122.840 118.934 3.906 1
1 1116 . 3 1 1 A 97 97 ASP H H 97 7.344 9.075 -1.731 1
1 1117 . 3 1 1 A 97 97 ASP HA H 97 4.829 5.305 -0.476 1
1 1120 . 3 1 1 A 97 97 ASP C C 97 175.019 176.362 -1.343 1
1 1121 . 3 1 1 A 97 97 ASP CA C 97 52.149 53.217 -1.068 1
1 1122 . 3 1 1 A 97 97 ASP CB C 97 42.697 44.110 -1.413 1
1 1123 . 3 1 1 A 97 97 ASP N N 97 126.861 121.306 5.555 1
1 1124 . 3 1 1 A 98 98 PHE H H 98 8.566 9.243 -0.677 1
1 1125 . 3 1 1 A 98 98 PHE HA H 98 3.727 4.115 -0.388 1
1 1133 . 3 1 1 A 98 98 PHE C C 98 177.443 177.403 0.040 1
1 1134 . 3 1 1 A 98 98 PHE CA C 98 62.471 61.723 0.748 1
1 1135 . 3 1 1 A 98 98 PHE CB C 98 39.919 39.521 0.398 1
1 1141 . 3 1 1 A 98 98 PHE N N 98 117.781 126.562 -8.781 1
1 1142 . 3 1 1 A 99 99 ASP H H 99 8.259 9.023 -0.764 1
1 1143 . 3 1 1 A 99 99 ASP HA H 99 3.960 4.234 -0.274 1
1 1146 . 3 1 1 A 99 99 ASP C C 99 178.132 178.648 -0.516 1
1 1147 . 3 1 1 A 99 99 ASP CA C 99 57.658 57.116 0.542 1
1 1148 . 3 1 1 A 99 99 ASP CB C 99 38.572 40.709 -2.137 1
1 1149 . 3 1 1 A 99 99 ASP N N 99 121.709 119.138 2.571 1
1 1150 . 3 1 1 A 100 100 MET H H 100 8.008 8.219 -0.211 1
1 1151 . 3 1 1 A 100 100 MET HA H 100 3.644 4.403 -0.759 1
1 1156 . 3 1 1 A 100 100 MET C C 100 180.008 177.569 2.439 1
1 1157 . 3 1 1 A 100 100 MET CA C 100 58.598 58.392 0.206 1
1 1158 . 3 1 1 A 100 100 MET CB C 100 33.423 33.474 -0.051 1
1 1160 . 3 1 1 A 100 100 MET N N 100 119.668 118.272 1.396 1
1 1161 . 3 1 1 A 101 101 LEU H H 101 7.961 8.259 -0.298 1
1 1162 . 3 1 1 A 101 101 LEU HA H 101 3.523 4.300 -0.777 1
1 1172 . 3 1 1 A 101 101 LEU C C 101 173.873 176.474 -2.601 1
1 1173 . 3 1 1 A 101 101 LEU CA C 101 58.743 54.269 4.474 1
1 1174 . 3 1 1 A 101 101 LEU CB C 101 42.632 41.096 1.536 1
1 1178 . 3 1 1 A 101 101 LEU N N 101 119.752 119.404 0.348 1
1 1179 . 3 1 1 A 102 102 THR H H 102 6.955 8.285 -1.330 1
1 1180 . 3 1 1 A 102 102 THR HA H 102 4.134 4.383 -0.249 1
1 1185 . 3 1 1 A 102 102 THR C C 102 176.513 175.280 1.233 1
1 1186 . 3 1 1 A 102 102 THR CA C 102 61.125 62.973 -1.848 1
1 1187 . 3 1 1 A 102 102 THR CB C 102 71.415 71.097 0.318 1
1 1189 . 3 1 1 A 102 102 THR N N 102 124.665 118.366 6.299 1
1 1190 . 3 1 1 A 103 103 GLY H H 103 7.816 7.563 0.253 1
1 1191 . 3 1 1 A 103 103 GLY HA2 H 103 3.824 4.043 -0.219 1
1 1192 . 3 1 1 A 103 103 GLY HA3 H 103 3.824 4.120 -0.296 1
1 1193 . 3 1 1 A 103 103 GLY C C 103 174.126 174.733 -0.607 1
1 1194 . 3 1 1 A 103 103 GLY CA C 103 47.805 45.369 2.436 1
1 1195 . 3 1 1 A 103 103 GLY N N 103 114.191 109.711 4.480 1
1 1196 . 3 1 1 A 104 104 SER H H 104 8.860 8.796 0.064 1
1 1197 . 3 1 1 A 104 104 SER HA H 104 4.758 4.779 -0.021 1
1 1200 . 3 1 1 A 104 104 SER C C 104 174.591 175.270 -0.679 1
1 1201 . 3 1 1 A 104 104 SER CA C 104 56.755 58.901 -2.146 1
1 1202 . 3 1 1 A 104 104 SER CB C 104 65.050 60.778 4.272 1
1 1203 . 3 1 1 A 104 104 SER N N 104 114.771 113.793 0.978 1
1 1204 . 3 1 1 A 105 105 GLY H H 105 8.788 8.207 0.581 1
1 1205 . 3 1 1 A 105 105 GLY HA2 H 105 3.733 3.898 -0.165 1
1 1206 . 3 1 1 A 105 105 GLY HA3 H 105 3.733 3.933 -0.200 1
1 1207 . 3 1 1 A 105 105 GLY CA C 105 47.247 45.836 1.411 1
1 1208 . 3 1 1 A 105 105 GLY N N 105 110.394 110.762 -0.368 1
1 1209 . 3 1 1 A 106 106 ASN HA H 106 4.454 4.893 -0.439 1
1 1212 . 3 1 1 A 106 106 ASN C C 106 175.180 176.343 -1.163 1
1 1213 . 3 1 1 A 106 106 ASN CA C 106 54.492 54.127 0.365 1
1 1214 . 3 1 1 A 106 106 ASN CB C 106 37.282 41.060 -3.778 1
1 1215 . 3 1 1 A 107 107 TYR H H 107 8.241 7.950 0.291 1
1 1216 . 3 1 1 A 107 107 TYR HA H 107 4.335 4.774 -0.439 1
1 1223 . 3 1 1 A 107 107 TYR C C 107 173.954 176.880 -2.926 1
1 1224 . 3 1 1 A 107 107 TYR CA C 107 57.727 57.702 0.025 1
1 1225 . 3 1 1 A 107 107 TYR CB C 107 37.063 40.517 -3.454 1
1 1230 . 3 1 1 A 107 107 TYR N N 107 120.708 113.832 6.876 1
1 1231 . 3 1 1 A 108 108 SER H H 108 7.117 9.094 -1.977 1
1 1232 . 3 1 1 A 108 108 SER HA H 108 4.221 4.405 -0.184 1
1 1235 . 3 1 1 A 108 108 SER C C 108 174.834 174.186 0.648 1
1 1236 . 3 1 1 A 108 108 SER CA C 108 59.859 61.344 -1.485 1
1 1237 . 3 1 1 A 108 108 SER CB C 108 63.846 62.751 1.095 1
1 1238 . 3 1 1 A 108 108 SER N N 108 113.362 116.816 -3.454 1
1 1239 . 3 1 1 A 109 109 SER H H 109 8.053 7.703 0.350 1
1 1240 . 3 1 1 A 109 109 SER HA H 109 4.560 4.377 0.183 1
1 1243 . 3 1 1 A 109 109 SER CA C 109 57.141 60.779 -3.638 1
1 1244 . 3 1 1 A 109 109 SER CB C 109 64.874 61.896 2.978 1
1 1245 . 3 1 1 A 109 109 SER N N 109 116.657 113.720 2.937 1
1 1246 . 3 1 1 A 110 110 THR HA H 110 3.541 3.932 -0.391 1
1 1251 . 3 1 1 A 110 110 THR C C 110 175.477 176.406 -0.929 1
1 1252 . 3 1 1 A 110 110 THR CA C 110 66.443 66.311 0.132 1
1 1253 . 3 1 1 A 110 110 THR CB C 110 68.091 69.149 -1.058 1
1 1255 . 3 1 1 A 111 111 ASP H H 111 8.224 8.116 0.108 1
1 1256 . 3 1 1 A 111 111 ASP HA H 111 4.237 4.396 -0.159 1
1 1259 . 3 1 1 A 111 111 ASP C C 111 177.520 178.185 -0.665 1
1 1260 . 3 1 1 A 111 111 ASP CA C 111 57.559 57.220 0.339 1
1 1261 . 3 1 1 A 111 111 ASP CB C 111 40.292 40.357 -0.065 1
1 1262 . 3 1 1 A 111 111 ASP N N 111 119.490 120.606 -1.116 1
1 1263 . 3 1 1 A 112 112 ALA H H 112 7.431 7.851 -0.420 1
1 1264 . 3 1 1 A 112 112 ALA HA H 112 4.191 4.159 0.032 1
1 1268 . 3 1 1 A 112 112 ALA C C 112 180.646 179.858 0.788 1
1 1269 . 3 1 1 A 112 112 ALA CA C 112 54.534 54.171 0.363 1
1 1270 . 3 1 1 A 112 112 ALA CB C 112 18.992 18.271 0.721 1
1 1271 . 3 1 1 A 112 112 ALA N N 112 119.710 122.072 -2.362 1
1 1272 . 3 1 1 A 113 113 GLN H H 113 7.576 7.547 0.029 1
1 1273 . 3 1 1 A 113 113 GLN HA H 113 3.562 4.311 -0.749 1
1 1278 . 3 1 1 A 113 113 GLN C C 113 176.756 177.820 -1.064 1
1 1279 . 3 1 1 A 113 113 GLN CA C 113 57.736 58.387 -0.651 1
1 1280 . 3 1 1 A 113 113 GLN CB C 113 29.110 28.977 0.133 1
1 1281 . 3 1 1 A 113 113 GLN N N 113 117.518 118.359 -0.841 1
1 1283 . 3 1 1 A 114 114 MET H H 114 8.192 8.206 -0.014 1
1 1284 . 3 1 1 A 114 114 MET HA H 114 4.231 4.239 -0.008 1
1 1289 . 3 1 1 A 114 114 MET C C 114 175.648 177.187 -1.539 1
1 1290 . 3 1 1 A 114 114 MET CA C 114 57.446 57.605 -0.159 1
1 1291 . 3 1 1 A 114 114 MET CB C 114 33.570 32.752 0.818 1
1 1293 . 3 1 1 A 114 114 MET N N 114 111.509 119.398 -7.889 1
1 1294 . 3 1 1 A 115 115 GLN H H 115 6.940 7.487 -0.547 1
1 1295 . 3 1 1 A 115 115 GLN HA H 115 4.307 4.469 -0.162 1
1 1302 . 3 1 1 A 115 115 GLN C C 115 176.270 174.645 1.625 1
1 1303 . 3 1 1 A 115 115 GLN CA C 115 54.680 54.906 -0.226 1
1 1304 . 3 1 1 A 115 115 GLN CB C 115 28.233 28.865 -0.632 1
1 1306 . 3 1 1 A 115 115 GLN N N 115 114.300 116.547 -2.247 1
1 1308 . 3 1 1 A 116 116 TYR H H 116 6.677 7.558 -0.881 1
1 1309 . 3 1 1 A 116 116 TYR HA H 116 4.193 5.144 -0.951 1
1 1312 . 3 1 1 A 116 116 TYR C C 116 175.268 174.612 0.656 1
1 1313 . 3 1 1 A 116 116 TYR CA C 116 54.357 57.873 -3.516 1
1 1314 . 3 1 1 A 116 116 TYR CB C 116 35.498 39.090 -3.592 1
1 1315 . 3 1 1 A 116 116 TYR N N 116 117.919 118.894 -0.975 1
1 1316 . 3 1 1 A 117 117 ASP H H 117 8.081 8.704 -0.623 1
1 1317 . 3 1 1 A 117 117 ASP HA H 117 4.665 5.076 -0.411 1
1 1320 . 3 1 1 A 117 117 ASP CA C 117 52.422 50.896 1.526 1
1 1321 . 3 1 1 A 117 117 ASP CB C 117 42.416 43.208 -0.792 1
1 1322 . 3 1 1 A 117 117 ASP N N 117 120.887 123.446 -2.559 1
1 1323 . 3 1 1 A 118 118 PRO C C 118 179.180 178.294 0.886 1
1 1324 . 3 1 1 A 118 118 PRO CA C 118 65.942 65.520 0.422 1
1 1325 . 3 1 1 A 118 118 PRO CB C 118 32.197 31.971 0.226 1
1 1326 . 3 1 1 A 119 119 GLY H H 119 9.742 8.976 0.766 1
1 1327 . 3 1 1 A 119 119 GLY C C 119 175.622 175.316 0.306 1
1 1328 . 3 1 1 A 119 119 GLY CA C 119 46.785 46.411 0.374 1
1 1329 . 3 1 1 A 119 119 GLY N N 119 106.412 106.840 -0.428 1
1 1330 . 3 1 1 A 120 120 LEU H H 120 6.666 8.062 -1.396 1
1 1331 . 3 1 1 A 120 120 LEU HA H 120 3.365 3.633 -0.268 1
1 1341 . 3 1 1 A 120 120 LEU C C 120 179.262 178.481 0.781 1
1 1342 . 3 1 1 A 120 120 LEU CA C 120 56.605 56.975 -0.370 1
1 1343 . 3 1 1 A 120 120 LEU CB C 120 39.262 41.809 -2.547 1
1 1347 . 3 1 1 A 120 120 LEU N N 120 126.226 122.840 3.386 1
1 1348 . 3 1 1 A 121 121 PHE H H 121 7.356 9.010 -1.654 1
1 1349 . 3 1 1 A 121 121 PHE HA H 121 4.459 3.984 0.475 1
1 1352 . 3 1 1 A 121 121 PHE C C 121 179.716 177.461 2.255 1
1 1353 . 3 1 1 A 121 121 PHE CA C 121 62.838 62.211 0.627 1
1 1354 . 3 1 1 A 121 121 PHE CB C 121 37.603 39.333 -1.730 1
1 1355 . 3 1 1 A 121 121 PHE N N 121 117.437 119.475 -2.038 1
1 1356 . 3 1 1 A 122 122 ALA H H 122 7.926 7.973 -0.047 1
1 1357 . 3 1 1 A 122 122 ALA HA H 122 4.523 3.747 0.776 1
1 1361 . 3 1 1 A 122 122 ALA C C 122 180.435 179.276 1.159 1
1 1362 . 3 1 1 A 122 122 ALA CA C 122 55.527 55.247 0.280 1
1 1363 . 3 1 1 A 122 122 ALA CB C 122 17.814 17.806 0.008 1
1 1364 . 3 1 1 A 122 122 ALA N N 122 121.068 121.384 -0.316 1
1 1365 . 3 1 1 A 123 123 GLN H H 123 7.507 7.918 -0.411 1
1 1366 . 3 1 1 A 123 123 GLN HA H 123 4.153 3.948 0.205 1
1 1371 . 3 1 1 A 123 123 GLN C C 123 180.561 177.776 2.785 1
1 1372 . 3 1 1 A 123 123 GLN CA C 123 59.948 58.353 1.595 1
1 1373 . 3 1 1 A 123 123 GLN CB C 123 29.135 27.790 1.345 1
1 1375 . 3 1 1 A 123 123 GLN N N 123 120.324 115.993 4.331 1
1 1376 . 3 1 1 A 124 124 ILE H H 124 8.318 7.850 0.468 1
1 1377 . 3 1 1 A 124 124 ILE HA H 124 3.635 3.849 -0.214 1
1 1387 . 3 1 1 A 124 124 ILE C C 124 176.481 177.998 -1.517 1
1 1388 . 3 1 1 A 124 124 ILE CA C 124 66.432 63.987 2.445 1
1 1389 . 3 1 1 A 124 124 ILE CB C 124 39.168 37.623 1.545 1
1 1393 . 3 1 1 A 124 124 ILE N N 124 123.747 116.573 7.174 1
1 1394 . 3 1 1 A 125 125 GLN H H 125 8.474 8.090 0.384 1
1 1395 . 3 1 1 A 125 125 GLN HA H 125 4.264 3.808 0.456 1
1 1402 . 3 1 1 A 125 125 GLN C C 125 178.947 177.872 1.075 1
1 1403 . 3 1 1 A 125 125 GLN CA C 125 59.651 58.378 1.273 1
1 1404 . 3 1 1 A 125 125 GLN CB C 125 28.880 28.537 0.343 1
1 1406 . 3 1 1 A 125 125 GLN N N 125 120.368 121.276 -0.908 1
1 1408 . 3 1 1 A 126 126 ALA H H 126 8.002 7.578 0.424 1
1 1409 . 3 1 1 A 126 126 ALA HA H 126 4.144 3.982 0.162 1
1 1413 . 3 1 1 A 126 126 ALA C C 126 179.316 179.903 -0.587 1
1 1414 . 3 1 1 A 126 126 ALA CA C 126 55.036 54.988 0.048 1
1 1415 . 3 1 1 A 126 126 ALA CB C 126 18.087 18.116 -0.029 1
1 1416 . 3 1 1 A 126 126 ALA N N 126 121.661 121.001 0.660 1
1 1417 . 3 1 1 A 127 127 ALA H H 127 7.823 8.219 -0.396 1
1 1418 . 3 1 1 A 127 127 ALA HA H 127 4.162 3.962 0.200 1
1 1422 . 3 1 1 A 127 127 ALA C C 127 180.707 179.344 1.363 1
1 1423 . 3 1 1 A 127 127 ALA CA C 127 55.080 54.883 0.197 1
1 1424 . 3 1 1 A 127 127 ALA CB C 127 19.354 18.237 1.117 1
1 1425 . 3 1 1 A 127 127 ALA N N 127 119.853 119.974 -0.121 1
1 1426 . 3 1 1 A 128 128 ALA H H 128 8.936 7.728 1.208 1
1 1427 . 3 1 1 A 128 128 ALA HA H 128 3.928 3.800 0.128 1
1 1431 . 3 1 1 A 128 128 ALA C C 128 181.031 179.321 1.710 1
1 1432 . 3 1 1 A 128 128 ALA CA C 128 55.502 54.660 0.842 1
1 1433 . 3 1 1 A 128 128 ALA CB C 128 16.609 17.733 -1.124 1
1 1434 . 3 1 1 A 128 128 ALA N N 128 121.355 120.014 1.341 1
1 1435 . 3 1 1 A 129 129 THR H H 129 8.543 7.410 1.133 1
1 1436 . 3 1 1 A 129 129 THR HA H 129 4.015 3.565 0.450 1
1 1441 . 3 1 1 A 129 129 THR C C 129 177.332 176.319 1.013 1
1 1442 . 3 1 1 A 129 129 THR CA C 129 65.893 64.919 0.974 1
1 1443 . 3 1 1 A 129 129 THR CB C 129 68.566 68.538 0.028 1
1 1445 . 3 1 1 A 129 129 THR N N 129 112.709 112.172 0.537 1
1 1446 . 3 1 1 A 130 130 LYS H H 130 8.126 7.535 0.591 1
1 1447 . 3 1 1 A 130 130 LYS HA H 130 4.000 3.994 0.006 1
1 1456 . 3 1 1 A 130 130 LYS C C 130 179.082 178.528 0.554 1
1 1457 . 3 1 1 A 130 130 LYS CA C 130 60.299 58.475 1.824 1
1 1458 . 3 1 1 A 130 130 LYS CB C 130 32.767 31.931 0.836 1
1 1462 . 3 1 1 A 130 130 LYS N N 130 123.879 120.501 3.378 1
1 1463 . 3 1 1 A 131 131 ALA H H 131 7.184 7.684 -0.500 1
1 1464 . 3 1 1 A 131 131 ALA HA H 131 4.005 4.223 -0.218 1
1 1468 . 3 1 1 A 131 131 ALA C C 131 178.482 179.561 -1.079 1
1 1469 . 3 1 1 A 131 131 ALA CA C 131 55.027 55.185 -0.158 1
1 1470 . 3 1 1 A 131 131 ALA CB C 131 18.669 19.494 -0.825 1
1 1471 . 3 1 1 A 131 131 ALA N N 131 118.590 121.197 -2.607 1
1 1472 . 3 1 1 A 132 132 TRP H H 132 7.977 8.551 -0.574 1
1 1473 . 3 1 1 A 132 132 TRP HA H 132 4.001 4.307 -0.306 1
1 1480 . 3 1 1 A 132 132 TRP C C 132 177.332 175.695 1.637 1
1 1481 . 3 1 1 A 132 132 TRP CA C 132 60.431 57.434 2.997 1
1 1482 . 3 1 1 A 132 132 TRP CB C 132 27.786 27.614 0.172 1
1 1486 . 3 1 1 A 132 132 TRP N N 132 119.168 117.107 2.061 1
1 1488 . 3 1 1 A 133 133 ARG H H 133 8.006 7.966 0.040 1
1 1489 . 3 1 1 A 133 133 ARG HA H 133 4.027 4.336 -0.309 1
1 1497 . 3 1 1 A 133 133 ARG C C 133 176.664 177.857 -1.193 1
1 1498 . 3 1 1 A 133 133 ARG CA C 133 59.355 57.112 2.243 1
1 1499 . 3 1 1 A 133 133 ARG CB C 133 30.451 32.246 -1.795 1
1 1502 . 3 1 1 A 133 133 ARG N N 133 113.062 120.522 -7.460 1
1 1504 . 3 1 1 A 134 134 LYS H H 134 7.322 7.643 -0.321 1
1 1505 . 3 1 1 A 134 134 LYS HA H 134 4.313 4.367 -0.054 1
1 1514 . 3 1 1 A 134 134 LYS C C 134 176.282 175.535 0.747 1
1 1515 . 3 1 1 A 134 134 LYS CA C 134 54.922 56.421 -1.499 1
1 1516 . 3 1 1 A 134 134 LYS CB C 134 32.633 31.327 1.306 1
1 1520 . 3 1 1 A 134 134 LYS N N 134 118.170 118.138 0.032 1
1 1521 . 3 1 1 A 135 135 LEU H H 135 7.440 7.983 -0.543 1
1 1522 . 3 1 1 A 135 135 LEU HA H 135 4.174 4.678 -0.504 1
1 1532 . 3 1 1 A 135 135 LEU CA C 135 54.408 51.605 2.803 1
1 1533 . 3 1 1 A 135 135 LEU CB C 135 40.407 43.097 -2.690 1
1 1537 . 3 1 1 A 135 135 LEU N N 135 123.358 121.732 1.626 1
1 1538 . 3 1 1 A 136 136 PRO HA H 136 4.437 4.618 -0.181 1
1 1545 . 3 1 1 A 136 136 PRO C C 136 177.106 176.162 0.944 1
1 1546 . 3 1 1 A 136 136 PRO CA C 136 62.889 62.202 0.687 1
1 1547 . 3 1 1 A 136 136 PRO CB C 136 32.192 33.213 -1.021 1
1 1550 . 3 1 1 A 137 137 VAL H H 137 8.219 8.422 -0.203 1
1 1551 . 3 1 1 A 137 137 VAL HA H 137 4.077 4.001 0.076 1
1 1559 . 3 1 1 A 137 137 VAL C C 137 176.305 176.662 -0.357 1
1 1560 . 3 1 1 A 137 137 VAL CA C 137 61.958 62.910 -0.952 1
1 1561 . 3 1 1 A 137 137 VAL CB C 137 32.755 31.845 0.910 1
1 1564 . 3 1 1 A 137 137 VAL N N 137 120.079 121.036 -0.957 1
1 1565 . 3 1 1 A 138 138 LYS H H 138 8.444 8.939 -0.495 1
1 1566 . 3 1 1 A 138 138 LYS HA H 138 4.316 4.026 0.290 1
1 1575 . 3 1 1 A 138 138 LYS C C 138 176.790 176.569 0.221 1
1 1576 . 3 1 1 A 138 138 LYS CA C 138 56.792 57.676 -0.884 1
1 1577 . 3 1 1 A 138 138 LYS CB C 138 33.205 33.613 -0.408 1
1 1581 . 3 1 1 A 138 138 LYS N N 138 126.449 129.402 -2.953 1
1 1582 . 3 1 1 A 139 139 GLY H H 139 8.518 7.830 0.688 1
1 1583 . 3 1 1 A 139 139 GLY HA2 H 139 4.070 4.023 0.047 1
1 1584 . 3 1 1 A 139 139 GLY HA3 H 139 3.897 4.026 -0.129 1
1 1585 . 3 1 1 A 139 139 GLY C C 139 172.874 174.145 -1.271 1
1 1586 . 3 1 1 A 139 139 GLY CA C 139 45.157 45.532 -0.375 1
1 1587 . 3 1 1 A 139 139 GLY N N 139 112.617 107.933 4.684 1
1 6 . 4 1 1 A 2 2 VAL H H 2 8.992 8.285 0.707 1
1 7 . 4 1 1 A 2 2 VAL HA H 2 5.370 5.177 0.193 1
1 15 . 4 1 1 A 2 2 VAL C C 2 174.325 174.660 -0.335 1
1 16 . 4 1 1 A 2 2 VAL CA C 2 61.267 60.434 0.833 1
1 17 . 4 1 1 A 2 2 VAL CB C 2 33.890 35.898 -2.008 1
1 20 . 4 1 1 A 2 2 VAL N N 2 126.939 120.021 6.918 1
1 21 . 4 1 1 A 3 3 THR H H 3 8.912 9.136 -0.224 1
1 22 . 4 1 1 A 3 3 THR HA H 3 4.505 5.256 -0.751 1
1 27 . 4 1 1 A 3 3 THR C C 3 172.710 173.077 -0.367 1
1 28 . 4 1 1 A 3 3 THR CA C 3 59.689 59.755 -0.066 1
1 29 . 4 1 1 A 3 3 THR CB C 3 72.398 72.207 0.191 1
1 31 . 4 1 1 A 3 3 THR N N 3 118.091 122.365 -4.274 1
1 32 . 4 1 1 A 4 4 GLU H H 4 8.631 8.870 -0.239 1
1 33 . 4 1 1 A 4 4 GLU HA H 4 5.788 5.145 0.643 1
1 38 . 4 1 1 A 4 4 GLU C C 4 175.758 174.818 0.940 1
1 39 . 4 1 1 A 4 4 GLU CA C 4 54.902 55.164 -0.262 1
1 40 . 4 1 1 A 4 4 GLU CB C 4 35.097 32.369 2.728 1
1 42 . 4 1 1 A 4 4 GLU N N 4 120.966 124.699 -3.733 1
1 43 . 4 1 1 A 5 5 THR H H 5 9.188 9.132 0.056 1
1 44 . 4 1 1 A 5 5 THR HA H 5 4.739 5.098 -0.359 1
1 49 . 4 1 1 A 5 5 THR C C 5 172.757 172.738 0.019 1
1 50 . 4 1 1 A 5 5 THR CA C 5 60.382 60.072 0.310 1
1 51 . 4 1 1 A 5 5 THR CB C 5 71.558 71.159 0.399 1
1 53 . 4 1 1 A 5 5 THR N N 5 119.366 116.839 2.527 1
1 54 . 4 1 1 A 6 6 VAL H H 6 8.476 9.055 -0.579 1
1 55 . 4 1 1 A 6 6 VAL HA H 6 5.026 6.025 -0.999 1
1 63 . 4 1 1 A 6 6 VAL C C 6 176.674 173.904 2.770 1
1 64 . 4 1 1 A 6 6 VAL CA C 6 61.008 60.473 0.535 1
1 65 . 4 1 1 A 6 6 VAL CB C 6 33.861 33.984 -0.123 1
1 68 . 4 1 1 A 6 6 VAL N N 6 121.384 122.487 -1.103 1
1 69 . 4 1 1 A 7 7 ASP H H 7 8.848 9.016 -0.168 1
1 70 . 4 1 1 A 7 7 ASP HA H 7 4.797 4.750 0.047 1
1 73 . 4 1 1 A 7 7 ASP CA C 7 52.834 54.463 -1.629 1
1 74 . 4 1 1 A 7 7 ASP CB C 7 42.219 41.542 0.677 1
1 75 . 4 1 1 A 7 7 ASP N N 7 127.061 127.434 -0.373 1
1 76 . 4 1 1 A 8 8 GLY C C 8 175.143 174.928 0.215 1
1 77 . 4 1 1 A 8 8 GLY CA C 8 46.553 47.368 -0.815 1
1 78 . 4 1 1 A 9 9 GLN H H 9 8.408 8.379 0.029 1
1 79 . 4 1 1 A 9 9 GLN HA H 9 4.541 4.262 0.279 1
1 86 . 4 1 1 A 9 9 GLN C C 9 176.463 177.270 -0.807 1
1 87 . 4 1 1 A 9 9 GLN CA C 9 55.167 55.295 -0.128 1
1 88 . 4 1 1 A 9 9 GLN CB C 9 29.376 27.703 1.673 1
1 90 . 4 1 1 A 9 9 GLN N N 9 118.300 124.253 -5.953 1
1 92 . 4 1 1 A 10 10 GLY H H 10 8.162 8.177 -0.015 1
1 93 . 4 1 1 A 10 10 GLY HA2 H 10 4.174 3.933 0.241 1
1 94 . 4 1 1 A 10 10 GLY HA3 H 10 3.521 3.942 -0.421 1
1 95 . 4 1 1 A 10 10 GLY C C 10 174.092 174.704 -0.612 1
1 96 . 4 1 1 A 10 10 GLY CA C 10 45.558 46.274 -0.716 1
1 97 . 4 1 1 A 10 10 GLY N N 10 108.747 109.751 -1.004 1
1 98 . 4 1 1 A 11 11 GLN H H 11 8.507 7.533 0.974 1
1 99 . 4 1 1 A 11 11 GLN HA H 11 4.202 4.230 -0.028 1
1 106 . 4 1 1 A 11 11 GLN C C 11 173.992 175.355 -1.363 1
1 107 . 4 1 1 A 11 11 GLN CA C 11 55.098 56.057 -0.959 1
1 108 . 4 1 1 A 11 11 GLN CB C 11 29.097 29.193 -0.096 1
1 110 . 4 1 1 A 11 11 GLN N N 11 122.979 120.314 2.665 1
1 112 . 4 1 1 A 12 12 ALA H H 12 8.259 8.443 -0.184 1
1 113 . 4 1 1 A 12 12 ALA HA H 12 5.156 4.752 0.404 1
1 117 . 4 1 1 A 12 12 ALA C C 12 177.284 176.739 0.545 1
1 118 . 4 1 1 A 12 12 ALA CA C 12 51.087 51.046 0.041 1
1 119 . 4 1 1 A 12 12 ALA CB C 12 20.500 19.820 0.680 1
1 120 . 4 1 1 A 12 12 ALA N N 12 127.100 128.058 -0.958 1
1 121 . 4 1 1 A 13 13 TRP H H 13 9.245 9.576 -0.331 1
1 122 . 4 1 1 A 13 13 TRP HA H 13 4.717 5.367 -0.650 1
1 131 . 4 1 1 A 13 13 TRP C C 13 175.108 175.536 -0.428 1
1 132 . 4 1 1 A 13 13 TRP CA C 13 55.966 55.769 0.197 1
1 133 . 4 1 1 A 13 13 TRP CB C 13 31.912 32.352 -0.440 1
1 139 . 4 1 1 A 13 13 TRP N N 13 123.088 123.939 -0.851 1
1 141 . 4 1 1 A 14 14 ARG H H 14 8.575 8.804 -0.229 1
1 142 . 4 1 1 A 14 14 ARG HA H 14 5.335 5.315 0.020 1
1 150 . 4 1 1 A 14 14 ARG C C 14 175.191 175.091 0.100 1
1 151 . 4 1 1 A 14 14 ARG CA C 14 53.106 54.303 -1.197 1
1 152 . 4 1 1 A 14 14 ARG CB C 14 32.749 34.721 -1.972 1
1 154 . 4 1 1 A 14 14 ARG N N 14 121.163 120.830 0.333 1
1 156 . 4 1 1 A 15 15 HIS H H 15 8.595 9.335 -0.740 1
1 157 . 4 1 1 A 15 15 HIS HA H 15 4.790 5.368 -0.578 1
1 161 . 4 1 1 A 15 15 HIS C C 15 173.770 174.043 -0.273 1
1 162 . 4 1 1 A 15 15 HIS CA C 15 55.289 53.857 1.432 1
1 163 . 4 1 1 A 15 15 HIS CB C 15 33.208 33.492 -0.284 1
1 165 . 4 1 1 A 15 15 HIS N N 15 117.643 120.128 -2.485 1
1 166 . 4 1 1 A 16 16 HIS H H 16 8.993 9.067 -0.074 1
1 167 . 4 1 1 A 16 16 HIS HA H 16 5.158 4.907 0.251 1
1 171 . 4 1 1 A 16 16 HIS C C 16 173.608 173.923 -0.315 1
1 172 . 4 1 1 A 16 16 HIS CA C 16 56.450 55.038 1.412 1
1 173 . 4 1 1 A 16 16 HIS CB C 16 34.171 31.850 2.321 1
1 175 . 4 1 1 A 16 16 HIS N N 16 123.520 123.775 -0.255 1
1 176 . 4 1 1 A 17 17 ASN H H 17 7.829 9.237 -1.408 1
1 177 . 4 1 1 A 17 17 ASN HA H 17 4.713 5.076 -0.363 1
1 182 . 4 1 1 A 17 17 ASN C C 17 173.682 175.923 -2.241 1
1 183 . 4 1 1 A 17 17 ASN CA C 17 51.822 51.483 0.339 1
1 184 . 4 1 1 A 17 17 ASN CB C 17 43.176 41.364 1.812 1
1 185 . 4 1 1 A 17 17 ASN N N 17 122.213 124.611 -2.398 1
1 187 . 4 1 1 A 18 18 GLY H H 18 8.423 8.206 0.217 1
1 188 . 4 1 1 A 18 18 GLY HA2 H 18 3.931 3.535 0.396 1
1 189 . 4 1 1 A 18 18 GLY HA3 H 18 3.707 3.771 -0.064 1
1 190 . 4 1 1 A 18 18 GLY C C 18 173.985 173.198 0.787 1
1 191 . 4 1 1 A 18 18 GLY CA C 18 43.949 47.000 -3.051 1
1 192 . 4 1 1 A 18 18 GLY N N 18 106.991 109.645 -2.654 1
1 193 . 4 1 1 A 19 19 PHE H H 19 8.338 7.680 0.658 1
1 194 . 4 1 1 A 19 19 PHE HA H 19 4.068 5.202 -1.134 1
1 197 . 4 1 1 A 19 19 PHE C C 19 176.568 174.730 1.838 1
1 198 . 4 1 1 A 19 19 PHE CA C 19 59.338 56.602 2.736 1
1 199 . 4 1 1 A 19 19 PHE CB C 19 40.201 43.613 -3.412 1
1 200 . 4 1 1 A 19 19 PHE N N 19 116.857 114.459 2.398 1
1 201 . 4 1 1 A 20 20 ASP H H 20 8.794 8.777 0.017 1
1 202 . 4 1 1 A 20 20 ASP HA H 20 4.485 4.764 -0.279 1
1 205 . 4 1 1 A 20 20 ASP C C 20 177.379 177.583 -0.204 1
1 206 . 4 1 1 A 20 20 ASP CA C 20 54.140 54.827 -0.687 1
1 207 . 4 1 1 A 20 20 ASP CB C 20 41.915 41.292 0.623 1
1 208 . 4 1 1 A 20 20 ASP N N 20 123.025 124.767 -1.742 1
1 209 . 4 1 1 A 21 21 PHE H H 21 8.862 9.149 -0.287 1
1 210 . 4 1 1 A 21 21 PHE HA H 21 4.087 4.106 -0.019 1
1 218 . 4 1 1 A 21 21 PHE C C 21 176.952 177.310 -0.358 1
1 219 . 4 1 1 A 21 21 PHE CA C 21 61.095 62.482 -1.387 1
1 220 . 4 1 1 A 21 21 PHE CB C 21 38.678 39.352 -0.674 1
1 226 . 4 1 1 A 21 21 PHE N N 21 127.163 124.621 2.542 1
1 227 . 4 1 1 A 22 22 ALA H H 22 8.561 8.361 0.200 1
1 228 . 4 1 1 A 22 22 ALA HA H 22 3.878 3.920 -0.042 1
1 232 . 4 1 1 A 22 22 ALA C C 22 180.710 179.999 0.711 1
1 233 . 4 1 1 A 22 22 ALA CA C 22 55.211 55.126 0.085 1
1 234 . 4 1 1 A 22 22 ALA CB C 22 18.321 18.355 -0.034 1
1 235 . 4 1 1 A 22 22 ALA N N 22 120.293 121.129 -0.836 1
1 236 . 4 1 1 A 23 23 VAL H H 23 7.241 7.635 -0.394 1
1 237 . 4 1 1 A 23 23 VAL HA H 23 3.684 3.490 0.194 1
1 245 . 4 1 1 A 23 23 VAL C C 23 177.101 177.984 -0.883 1
1 246 . 4 1 1 A 23 23 VAL CA C 23 65.237 66.946 -1.709 1
1 247 . 4 1 1 A 23 23 VAL CB C 23 31.780 31.713 0.067 1
1 250 . 4 1 1 A 23 23 VAL N N 23 118.775 117.551 1.224 1
1 251 . 4 1 1 A 24 24 ILE H H 24 6.761 7.752 -0.991 1
1 252 . 4 1 1 A 24 24 ILE HA H 24 3.196 3.375 -0.179 1
1 262 . 4 1 1 A 24 24 ILE C C 24 177.287 177.846 -0.559 1
1 263 . 4 1 1 A 24 24 ILE CA C 24 63.404 65.553 -2.149 1
1 264 . 4 1 1 A 24 24 ILE CB C 24 36.294 37.681 -1.387 1
1 268 . 4 1 1 A 24 24 ILE N N 24 119.036 120.009 -0.973 1
1 269 . 4 1 1 A 25 25 LYS H H 25 8.032 7.961 0.071 1
1 270 . 4 1 1 A 25 25 LYS HA H 25 3.809 3.596 0.213 1
1 279 . 4 1 1 A 25 25 LYS C C 25 179.450 178.752 0.698 1
1 280 . 4 1 1 A 25 25 LYS CA C 25 59.621 59.497 0.124 1
1 281 . 4 1 1 A 25 25 LYS CB C 25 32.259 31.879 0.380 1
1 285 . 4 1 1 A 25 25 LYS N N 25 118.368 120.537 -2.169 1
1 286 . 4 1 1 A 26 26 GLU H H 26 7.845 7.898 -0.053 1
1 287 . 4 1 1 A 26 26 GLU HA H 26 4.021 4.068 -0.047 1
1 292 . 4 1 1 A 26 26 GLU C C 26 179.191 179.027 0.164 1
1 293 . 4 1 1 A 26 26 GLU CA C 26 59.530 59.085 0.445 1
1 294 . 4 1 1 A 26 26 GLU CB C 26 29.449 29.360 0.089 1
1 296 . 4 1 1 A 26 26 GLU N N 26 120.522 118.796 1.726 1
1 297 . 4 1 1 A 27 27 LEU H H 27 8.165 8.077 0.088 1
1 298 . 4 1 1 A 27 27 LEU HA H 27 4.163 4.125 0.038 1
1 308 . 4 1 1 A 27 27 LEU C C 27 177.256 178.375 -1.119 1
1 309 . 4 1 1 A 27 27 LEU CA C 27 58.049 57.526 0.523 1
1 310 . 4 1 1 A 27 27 LEU CB C 27 41.365 41.450 -0.085 1
1 314 . 4 1 1 A 27 27 LEU N N 27 120.879 120.928 -0.049 1
1 315 . 4 1 1 A 28 28 LYS H H 28 8.902 8.215 0.687 1
1 316 . 4 1 1 A 28 28 LYS HA H 28 4.199 4.433 -0.234 1
1 317 . 4 1 1 A 28 28 LYS C C 28 179.707 178.893 0.814 1
1 318 . 4 1 1 A 28 28 LYS CA C 28 60.097 59.507 0.590 1
1 319 . 4 1 1 A 28 28 LYS CB C 28 33.420 32.058 1.362 1
1 320 . 4 1 1 A 28 28 LYS N N 28 120.050 119.731 0.319 1
1 321 . 4 1 1 A 29 29 THR H H 29 8.294 8.158 0.136 1
1 322 . 4 1 1 A 29 29 THR HA H 29 3.892 3.929 -0.037 1
1 327 . 4 1 1 A 29 29 THR C C 29 175.711 176.087 -0.376 1
1 328 . 4 1 1 A 29 29 THR CA C 29 66.846 66.564 0.282 1
1 329 . 4 1 1 A 29 29 THR CB C 29 68.794 68.754 0.040 1
1 331 . 4 1 1 A 29 29 THR N N 29 115.933 117.098 -1.165 1
1 332 . 4 1 1 A 30 30 ALA H H 30 8.244 8.799 -0.555 1
1 333 . 4 1 1 A 30 30 ALA HA H 30 4.241 4.347 -0.106 1
1 337 . 4 1 1 A 30 30 ALA C C 30 179.128 179.909 -0.781 1
1 338 . 4 1 1 A 30 30 ALA CA C 30 55.714 55.700 0.014 1
1 339 . 4 1 1 A 30 30 ALA CB C 30 18.955 18.575 0.380 1
1 340 . 4 1 1 A 30 30 ALA N N 30 124.617 123.016 1.601 1
1 341 . 4 1 1 A 31 31 ALA H H 31 8.968 8.611 0.357 1
1 342 . 4 1 1 A 31 31 ALA HA H 31 3.890 4.047 -0.157 1
1 346 . 4 1 1 A 31 31 ALA C C 31 180.352 179.606 0.746 1
1 347 . 4 1 1 A 31 31 ALA CA C 31 55.454 55.622 -0.168 1
1 348 . 4 1 1 A 31 31 ALA CB C 31 17.124 18.823 -1.699 1
1 349 . 4 1 1 A 31 31 ALA N N 31 119.327 120.000 -0.673 1
1 350 . 4 1 1 A 32 32 SER H H 32 7.995 7.759 0.236 1
1 351 . 4 1 1 A 32 32 SER HA H 32 4.238 4.158 0.080 1
1 354 . 4 1 1 A 32 32 SER C C 32 175.612 176.100 -0.488 1
1 355 . 4 1 1 A 32 32 SER CA C 32 61.203 61.375 -0.172 1
1 356 . 4 1 1 A 32 32 SER CB C 32 63.406 63.132 0.274 1
1 357 . 4 1 1 A 32 32 SER N N 32 111.962 112.405 -0.443 1
1 358 . 4 1 1 A 33 33 GLN H H 33 8.333 7.915 0.418 1
1 359 . 4 1 1 A 33 33 GLN HA H 33 3.992 4.299 -0.307 1
1 366 . 4 1 1 A 33 33 GLN C C 33 177.486 177.120 0.366 1
1 367 . 4 1 1 A 33 33 GLN CA C 33 58.277 57.635 0.642 1
1 368 . 4 1 1 A 33 33 GLN CB C 33 29.140 29.952 -0.812 1
1 370 . 4 1 1 A 33 33 GLN N N 33 119.527 119.499 0.028 1
1 372 . 4 1 1 A 34 34 TYR H H 34 8.587 8.365 0.222 1
1 373 . 4 1 1 A 34 34 TYR HA H 34 4.792 4.671 0.121 1
1 380 . 4 1 1 A 34 34 TYR C C 34 176.499 176.710 -0.211 1
1 381 . 4 1 1 A 34 34 TYR CA C 34 57.711 58.936 -1.225 1
1 382 . 4 1 1 A 34 34 TYR CB C 34 39.561 39.841 -0.280 1
1 387 . 4 1 1 A 34 34 TYR N N 34 114.610 114.937 -0.327 1
1 388 . 4 1 1 A 35 35 GLY H H 35 7.346 8.850 -1.504 1
1 389 . 4 1 1 A 35 35 GLY HA2 H 35 4.785 3.989 0.796 1
1 390 . 4 1 1 A 35 35 GLY HA3 H 35 4.007 4.010 -0.003 1
1 391 . 4 1 1 A 35 35 GLY C C 35 175.796 174.233 1.563 1
1 392 . 4 1 1 A 35 35 GLY CA C 35 44.355 46.165 -1.810 1
1 393 . 4 1 1 A 35 35 GLY N N 35 108.501 107.938 0.563 1
1 394 . 4 1 1 A 36 36 ALA H H 36 9.363 8.380 0.983 1
1 395 . 4 1 1 A 36 36 ALA HA H 36 4.217 4.236 -0.019 1
1 399 . 4 1 1 A 36 36 ALA C C 36 178.039 178.112 -0.073 1
1 400 . 4 1 1 A 36 36 ALA CA C 36 56.114 53.423 2.691 1
1 401 . 4 1 1 A 36 36 ALA CB C 36 19.179 18.491 0.688 1
1 402 . 4 1 1 A 36 36 ALA N N 36 125.811 126.531 -0.720 1
1 403 . 4 1 1 A 37 37 THR H H 37 8.070 8.710 -0.640 1
1 404 . 4 1 1 A 37 37 THR HA H 37 4.570 4.211 0.359 1
1 409 . 4 1 1 A 37 37 THR C C 37 173.685 173.974 -0.289 1
1 410 . 4 1 1 A 37 37 THR CA C 37 59.822 63.800 -3.978 1
1 411 . 4 1 1 A 37 37 THR CB C 37 68.267 66.871 1.396 1
1 413 . 4 1 1 A 37 37 THR N N 37 129.410 116.259 13.151 1
1 414 . 4 1 1 A 38 38 ALA H H 38 6.853 7.728 -0.875 1
1 415 . 4 1 1 A 38 38 ALA HA H 38 4.601 4.536 0.065 1
1 419 . 4 1 1 A 38 38 ALA CA C 38 50.758 50.646 0.112 1
1 420 . 4 1 1 A 38 38 ALA CB C 38 18.325 19.683 -1.358 1
1 421 . 4 1 1 A 38 38 ALA N N 38 124.674 124.998 -0.324 1
1 422 . 4 1 1 A 40 40 TYR HA H 40 4.032 4.026 0.006 1
1 429 . 4 1 1 A 40 40 TYR C C 40 176.456 177.253 -0.797 1
1 430 . 4 1 1 A 40 40 TYR CA C 40 61.010 61.735 -0.725 1
1 431 . 4 1 1 A 40 40 TYR CB C 40 39.286 38.578 0.708 1
1 436 . 4 1 1 A 41 41 THR H H 41 6.874 8.326 -1.452 1
1 437 . 4 1 1 A 41 41 THR HA H 41 3.616 3.860 -0.244 1
1 442 . 4 1 1 A 41 41 THR C C 41 176.930 177.384 -0.454 1
1 443 . 4 1 1 A 41 41 THR CA C 41 65.557 66.752 -1.195 1
1 444 . 4 1 1 A 41 41 THR CB C 41 68.228 68.459 -0.231 1
1 446 . 4 1 1 A 41 41 THR N N 41 115.143 113.925 1.218 1
1 447 . 4 1 1 A 42 42 LEU H H 42 8.623 7.455 1.168 1
1 448 . 4 1 1 A 42 42 LEU HA H 42 3.708 4.071 -0.363 1
1 458 . 4 1 1 A 42 42 LEU C C 42 178.206 179.042 -0.836 1
1 459 . 4 1 1 A 42 42 LEU CA C 42 57.417 57.769 -0.352 1
1 460 . 4 1 1 A 42 42 LEU CB C 42 41.342 41.205 0.137 1
1 464 . 4 1 1 A 42 42 LEU N N 42 120.418 117.849 2.569 1
1 465 . 4 1 1 A 43 43 ALA H H 43 7.735 7.732 0.003 1
1 466 . 4 1 1 A 43 43 ALA HA H 43 4.020 3.984 0.036 1
1 470 . 4 1 1 A 43 43 ALA C C 43 180.826 180.540 0.286 1
1 471 . 4 1 1 A 43 43 ALA CA C 43 54.925 54.970 -0.045 1
1 472 . 4 1 1 A 43 43 ALA CB C 43 17.506 18.224 -0.718 1
1 473 . 4 1 1 A 43 43 ALA N N 43 120.203 121.795 -1.592 1
1 474 . 4 1 1 A 44 44 ILE H H 44 7.149 7.435 -0.286 1
1 475 . 4 1 1 A 44 44 ILE HA H 44 3.603 3.587 0.016 1
1 485 . 4 1 1 A 44 44 ILE C C 44 178.594 178.303 0.291 1
1 486 . 4 1 1 A 44 44 ILE CA C 44 64.782 64.484 0.298 1
1 487 . 4 1 1 A 44 44 ILE CB C 44 37.472 37.690 -0.218 1
1 491 . 4 1 1 A 44 44 ILE N N 44 118.881 119.434 -0.553 1
1 492 . 4 1 1 A 45 45 VAL H H 45 7.968 7.623 0.345 1
1 493 . 4 1 1 A 45 45 VAL HA H 45 2.925 3.381 -0.456 1
1 501 . 4 1 1 A 45 45 VAL C C 45 177.023 177.201 -0.178 1
1 502 . 4 1 1 A 45 45 VAL CA C 45 67.081 67.011 0.070 1
1 503 . 4 1 1 A 45 45 VAL CB C 45 30.854 31.233 -0.379 1
1 506 . 4 1 1 A 45 45 VAL N N 45 120.764 119.628 1.136 1
1 507 . 4 1 1 A 46 46 GLU H H 46 8.399 7.806 0.593 1
1 508 . 4 1 1 A 46 46 GLU HA H 46 3.848 3.912 -0.064 1
1 513 . 4 1 1 A 46 46 GLU C C 46 178.656 178.839 -0.183 1
1 514 . 4 1 1 A 46 46 GLU CA C 46 59.491 59.248 0.243 1
1 515 . 4 1 1 A 46 46 GLU CB C 46 28.991 28.752 0.239 1
1 517 . 4 1 1 A 46 46 GLU N N 46 116.599 119.860 -3.261 1
1 518 . 4 1 1 A 47 47 SER H H 47 7.273 7.876 -0.603 1
1 519 . 4 1 1 A 47 47 SER HA H 47 4.287 4.154 0.133 1
1 521 . 4 1 1 A 47 47 SER CA C 47 61.047 62.090 -1.043 1
1 522 . 4 1 1 A 47 47 SER CB C 47 63.016 63.135 -0.119 1
1 523 . 4 1 1 A 47 47 SER N N 47 113.609 117.806 -4.197 1
1 524 . 4 1 1 A 48 48 VAL H H 48 8.006 8.072 -0.066 1
1 525 . 4 1 1 A 48 48 VAL HA H 48 3.556 3.634 -0.078 1
1 533 . 4 1 1 A 48 48 VAL C C 48 177.257 176.600 0.657 1
1 534 . 4 1 1 A 48 48 VAL CA C 48 65.025 66.132 -1.107 1
1 535 . 4 1 1 A 48 48 VAL CB C 48 31.841 31.349 0.492 1
1 538 . 4 1 1 A 48 48 VAL N N 48 122.327 121.355 0.972 1
1 539 . 4 1 1 A 49 49 ALA H H 49 8.369 7.506 0.863 1
1 540 . 4 1 1 A 49 49 ALA HA H 49 4.115 4.234 -0.119 1
1 544 . 4 1 1 A 49 49 ALA C C 49 177.307 177.272 0.035 1
1 545 . 4 1 1 A 49 49 ALA CA C 49 53.253 52.017 1.236 1
1 546 . 4 1 1 A 49 49 ALA CB C 49 20.131 18.919 1.212 1
1 547 . 4 1 1 A 49 49 ALA N N 49 118.050 120.595 -2.545 1
1 548 . 4 1 1 A 50 50 ASP H H 50 7.052 7.725 -0.673 1
1 549 . 4 1 1 A 50 50 ASP HA H 50 4.788 4.531 0.257 1
1 552 . 4 1 1 A 50 50 ASP C C 50 175.481 176.045 -0.564 1
1 553 . 4 1 1 A 50 50 ASP CA C 50 53.681 53.479 0.202 1
1 554 . 4 1 1 A 50 50 ASP CB C 50 39.333 41.218 -1.885 1
1 555 . 4 1 1 A 50 50 ASP N N 50 116.997 117.477 -0.480 1
1 556 . 4 1 1 A 51 51 ASN H H 51 8.535 7.759 0.776 1
1 557 . 4 1 1 A 51 51 ASN HA H 51 4.628 4.913 -0.285 1
1 562 . 4 1 1 A 51 51 ASN C C 51 174.077 174.281 -0.204 1
1 563 . 4 1 1 A 51 51 ASN CA C 51 52.315 51.419 0.896 1
1 564 . 4 1 1 A 51 51 ASN CB C 51 41.928 41.360 0.568 1
1 565 . 4 1 1 A 51 51 ASN N N 51 118.626 115.004 3.622 1
1 567 . 4 1 1 A 52 52 TRP H H 52 8.555 8.254 0.301 1
1 574 . 4 1 1 A 52 52 TRP C C 52 173.269 176.495 -3.226 1
1 575 . 4 1 1 A 52 52 TRP CA C 52 55.031 58.106 -3.075 1
1 576 . 4 1 1 A 52 52 TRP CB C 52 26.801 30.236 -3.435 1
1 582 . 4 1 1 A 52 52 TRP N N 52 120.693 121.760 -1.067 1
1 584 . 4 1 1 A 53 53 LEU H H 53 7.847 8.774 -0.927 1
1 585 . 4 1 1 A 53 53 LEU HA H 53 4.859 4.898 -0.039 1
1 595 . 4 1 1 A 53 53 LEU C C 53 177.397 175.240 2.157 1
1 596 . 4 1 1 A 53 53 LEU CA C 53 53.619 53.374 0.245 1
1 597 . 4 1 1 A 53 53 LEU CB C 53 41.812 45.531 -3.719 1
1 601 . 4 1 1 A 53 53 LEU N N 53 124.741 120.358 4.383 1
1 602 . 4 1 1 A 54 54 THR H H 54 8.850 8.162 0.688 1
1 603 . 4 1 1 A 54 54 THR HA H 54 4.598 4.982 -0.384 1
1 608 . 4 1 1 A 54 54 THR CA C 54 60.531 58.825 1.706 1
1 609 . 4 1 1 A 54 54 THR CB C 54 67.183 70.127 -2.944 1
1 611 . 4 1 1 A 54 54 THR N N 54 113.407 110.324 3.083 1
1 612 . 4 1 1 A 55 55 PRO HA H 55 4.511 4.715 -0.204 1
1 619 . 4 1 1 A 55 55 PRO C C 55 179.383 179.007 0.376 1
1 620 . 4 1 1 A 55 55 PRO CA C 55 67.159 65.499 1.660 1
1 621 . 4 1 1 A 55 55 PRO CB C 55 32.095 31.717 0.378 1
1 622 . 4 1 1 A 56 56 THR H H 56 8.575 7.914 0.661 1
1 623 . 4 1 1 A 56 56 THR HA H 56 4.229 4.109 0.120 1
1 628 . 4 1 1 A 56 56 THR C C 56 176.668 176.146 0.522 1
1 629 . 4 1 1 A 56 56 THR CA C 56 66.943 65.693 1.250 1
1 630 . 4 1 1 A 56 56 THR CB C 56 68.129 68.390 -0.261 1
1 632 . 4 1 1 A 56 56 THR N N 56 114.855 112.935 1.920 1
1 633 . 4 1 1 A 57 57 ASP H H 57 8.730 8.347 0.383 1
1 634 . 4 1 1 A 57 57 ASP HA H 57 4.425 4.473 -0.048 1
1 637 . 4 1 1 A 57 57 ASP C C 57 178.351 179.330 -0.979 1
1 638 . 4 1 1 A 57 57 ASP CA C 57 57.963 57.686 0.277 1
1 639 . 4 1 1 A 57 57 ASP CB C 57 40.134 40.698 -0.564 1
1 640 . 4 1 1 A 57 57 ASP N N 57 126.239 119.715 6.524 1
1 641 . 4 1 1 A 58 58 TRP H H 58 8.244 8.646 -0.402 1
1 642 . 4 1 1 A 58 58 TRP HA H 58 4.030 4.563 -0.533 1
1 650 . 4 1 1 A 58 58 TRP C C 58 177.432 179.293 -1.861 1
1 651 . 4 1 1 A 58 58 TRP CA C 58 62.731 60.231 2.500 1
1 652 . 4 1 1 A 58 58 TRP CB C 58 29.122 29.420 -0.298 1
1 657 . 4 1 1 A 58 58 TRP N N 58 119.241 120.537 -1.296 1
1 659 . 4 1 1 A 59 59 ASN H H 59 8.098 9.016 -0.918 1
1 660 . 4 1 1 A 59 59 ASN HA H 59 4.424 4.421 0.003 1
1 663 . 4 1 1 A 59 59 ASN C C 59 176.952 178.057 -1.105 1
1 664 . 4 1 1 A 59 59 ASN CA C 59 58.135 56.538 1.597 1
1 665 . 4 1 1 A 59 59 ASN CB C 59 40.168 38.272 1.896 1
1 666 . 4 1 1 A 59 59 ASN N N 59 115.747 118.180 -2.433 1
1 667 . 4 1 1 A 60 60 THR H H 60 8.712 8.028 0.684 1
1 668 . 4 1 1 A 60 60 THR HA H 60 3.717 4.108 -0.391 1
1 673 . 4 1 1 A 60 60 THR C C 60 176.044 176.760 -0.716 1
1 674 . 4 1 1 A 60 60 THR CA C 60 66.576 67.428 -0.852 1
1 675 . 4 1 1 A 60 60 THR CB C 60 69.251 67.984 1.267 1
1 677 . 4 1 1 A 60 60 THR N N 60 114.896 117.547 -2.651 1
1 678 . 4 1 1 A 61 61 LEU H H 61 8.485 8.388 0.097 1
1 679 . 4 1 1 A 61 61 LEU HA H 61 3.391 3.790 -0.399 1
1 689 . 4 1 1 A 61 61 LEU C C 61 177.433 178.696 -1.263 1
1 690 . 4 1 1 A 61 61 LEU CA C 61 58.354 58.581 -0.227 1
1 691 . 4 1 1 A 61 61 LEU CB C 61 41.761 42.325 -0.564 1
1 695 . 4 1 1 A 61 61 LEU N N 61 123.433 121.949 1.484 1
1 696 . 4 1 1 A 62 62 VAL H H 62 8.073 8.310 -0.237 1
1 697 . 4 1 1 A 62 62 VAL HA H 62 3.207 3.841 -0.634 1
1 705 . 4 1 1 A 62 62 VAL C C 62 177.585 177.408 0.177 1
1 706 . 4 1 1 A 62 62 VAL CA C 62 67.345 65.323 2.022 1
1 707 . 4 1 1 A 62 62 VAL CB C 62 30.905 30.609 0.296 1
1 710 . 4 1 1 A 62 62 VAL N N 62 116.018 118.502 -2.484 1
1 711 . 4 1 1 A 63 63 ARG H H 63 7.765 8.049 -0.284 1
1 712 . 4 1 1 A 63 63 ARG HA H 63 3.602 4.032 -0.430 1
1 719 . 4 1 1 A 63 63 ARG C C 63 177.818 178.242 -0.424 1
1 720 . 4 1 1 A 63 63 ARG CA C 63 58.049 57.972 0.077 1
1 721 . 4 1 1 A 63 63 ARG CB C 63 29.955 29.278 0.677 1
1 724 . 4 1 1 A 63 63 ARG N N 63 116.700 120.685 -3.985 1
1 725 . 4 1 1 A 64 64 ALA H H 64 7.574 7.507 0.067 1
1 726 . 4 1 1 A 64 64 ALA HA H 64 4.158 4.320 -0.162 1
1 730 . 4 1 1 A 64 64 ALA C C 64 179.886 179.313 0.573 1
1 731 . 4 1 1 A 64 64 ALA CA C 64 54.007 54.031 -0.024 1
1 732 . 4 1 1 A 64 64 ALA CB C 64 19.147 19.692 -0.545 1
1 733 . 4 1 1 A 64 64 ALA N N 64 117.555 122.200 -4.645 1
1 734 . 4 1 1 A 65 65 VAL H H 65 7.554 7.999 -0.445 1
1 735 . 4 1 1 A 65 65 VAL HA H 65 4.253 3.872 0.381 1
1 743 . 4 1 1 A 65 65 VAL C C 65 174.180 176.379 -2.199 1
1 744 . 4 1 1 A 65 65 VAL CA C 65 62.683 65.415 -2.732 1
1 745 . 4 1 1 A 65 65 VAL CB C 65 33.458 31.448 2.010 1
1 748 . 4 1 1 A 65 65 VAL N N 65 110.013 115.389 -5.376 1
1 749 . 4 1 1 A 66 66 LEU H H 66 7.792 7.082 0.710 1
1 750 . 4 1 1 A 66 66 LEU HA H 66 4.790 4.825 -0.035 1
1 760 . 4 1 1 A 66 66 LEU C C 66 177.537 175.496 2.041 1
1 761 . 4 1 1 A 66 66 LEU CA C 66 52.823 52.679 0.144 1
1 762 . 4 1 1 A 66 66 LEU CB C 66 44.071 45.510 -1.439 1
1 766 . 4 1 1 A 66 66 LEU N N 66 118.967 121.456 -2.489 1
1 767 . 4 1 1 A 67 67 SER H H 67 9.208 8.508 0.700 1
1 768 . 4 1 1 A 67 67 SER HA H 67 4.414 5.028 -0.614 1
1 771 . 4 1 1 A 67 67 SER CA C 67 57.943 57.035 0.908 1
1 772 . 4 1 1 A 67 67 SER CB C 67 64.743 65.750 -1.007 1
1 773 . 4 1 1 A 67 67 SER N N 67 116.378 115.653 0.725 1
1 774 . 4 1 1 A 69 69 GLY HA2 H 69 3.916 3.760 0.156 1
1 775 . 4 1 1 A 69 69 GLY HA3 H 69 3.867 3.775 0.092 1
1 776 . 4 1 1 A 69 69 GLY C C 69 176.783 175.502 1.281 1
1 777 . 4 1 1 A 69 69 GLY CA C 69 46.977 46.674 0.303 1
1 778 . 4 1 1 A 70 70 ASP H H 70 7.674 8.106 -0.432 1
1 779 . 4 1 1 A 70 70 ASP HA H 70 4.511 3.519 0.992 1
1 782 . 4 1 1 A 70 70 ASP C C 70 178.096 178.001 0.095 1
1 783 . 4 1 1 A 70 70 ASP CA C 70 57.262 56.447 0.815 1
1 784 . 4 1 1 A 70 70 ASP CB C 70 40.594 39.698 0.896 1
1 785 . 4 1 1 A 70 70 ASP N N 70 123.930 121.699 2.231 1
1 786 . 4 1 1 A 71 71 HIS H H 71 8.729 7.898 0.831 1
1 787 . 4 1 1 A 71 71 HIS HA H 71 4.235 4.053 0.182 1
1 790 . 4 1 1 A 71 71 HIS C C 71 176.769 176.682 0.087 1
1 791 . 4 1 1 A 71 71 HIS CA C 71 60.041 59.827 0.214 1
1 792 . 4 1 1 A 71 71 HIS CB C 71 30.682 29.976 0.706 1
1 793 . 4 1 1 A 71 71 HIS N N 71 121.003 119.313 1.690 1
1 794 . 4 1 1 A 72 72 LEU H H 72 7.620 7.905 -0.285 1
1 795 . 4 1 1 A 72 72 LEU HA H 72 3.769 3.851 -0.082 1
1 805 . 4 1 1 A 72 72 LEU C C 72 180.275 178.916 1.359 1
1 806 . 4 1 1 A 72 72 LEU CA C 72 58.192 57.901 0.291 1
1 807 . 4 1 1 A 72 72 LEU CB C 72 41.381 41.429 -0.048 1
1 811 . 4 1 1 A 72 72 LEU N N 72 118.569 118.483 0.086 1
1 812 . 4 1 1 A 73 73 LEU H H 73 7.542 7.493 0.049 1
1 813 . 4 1 1 A 73 73 LEU HA H 73 4.107 4.143 -0.036 1
1 823 . 4 1 1 A 73 73 LEU C C 73 179.436 179.173 0.263 1
1 824 . 4 1 1 A 73 73 LEU CA C 73 58.026 57.167 0.859 1
1 825 . 4 1 1 A 73 73 LEU CB C 73 41.638 42.100 -0.462 1
1 829 . 4 1 1 A 73 73 LEU N N 73 121.418 120.072 1.346 1
1 830 . 4 1 1 A 74 74 TRP H H 74 8.786 8.039 0.747 1
1 831 . 4 1 1 A 74 74 TRP HA H 74 3.589 5.326 -1.737 1
1 840 . 4 1 1 A 74 74 TRP C C 74 176.816 178.520 -1.704 1
1 841 . 4 1 1 A 74 74 TRP CA C 74 63.046 59.721 3.325 1
1 842 . 4 1 1 A 74 74 TRP CB C 74 28.065 28.740 -0.675 1
1 848 . 4 1 1 A 74 74 TRP N N 74 121.111 118.153 2.958 1
1 850 . 4 1 1 A 75 75 LYS H H 75 8.939 7.329 1.610 1
1 851 . 4 1 1 A 75 75 LYS HA H 75 3.055 3.820 -0.765 1
1 860 . 4 1 1 A 75 75 LYS C C 75 177.967 178.666 -0.699 1
1 861 . 4 1 1 A 75 75 LYS CA C 75 60.029 58.102 1.927 1
1 862 . 4 1 1 A 75 75 LYS CB C 75 32.533 32.406 0.127 1
1 866 . 4 1 1 A 75 75 LYS N N 75 119.783 118.360 1.423 1
1 867 . 4 1 1 A 76 76 SER H H 76 7.832 7.672 0.160 1
1 868 . 4 1 1 A 76 76 SER HA H 76 4.040 3.953 0.087 1
1 871 . 4 1 1 A 76 76 SER C C 76 177.816 176.585 1.231 1
1 872 . 4 1 1 A 76 76 SER CA C 76 62.105 61.819 0.286 1
1 873 . 4 1 1 A 76 76 SER CB C 76 62.679 62.898 -0.219 1
1 874 . 4 1 1 A 76 76 SER N N 76 113.395 116.630 -3.235 1
1 875 . 4 1 1 A 77 77 GLU H H 77 7.590 7.387 0.203 1
1 876 . 4 1 1 A 77 77 GLU HA H 77 4.042 4.321 -0.279 1
1 881 . 4 1 1 A 77 77 GLU C C 77 177.809 178.602 -0.793 1
1 882 . 4 1 1 A 77 77 GLU CA C 77 58.270 58.188 0.082 1
1 883 . 4 1 1 A 77 77 GLU CB C 77 29.208 29.392 -0.184 1
1 885 . 4 1 1 A 77 77 GLU N N 77 121.574 122.505 -0.931 1
1 886 . 4 1 1 A 78 78 PHE H H 78 9.081 7.677 1.404 1
1 887 . 4 1 1 A 78 78 PHE HA H 78 3.778 4.161 -0.383 1
1 895 . 4 1 1 A 78 78 PHE C C 78 178.114 177.408 0.706 1
1 896 . 4 1 1 A 78 78 PHE CA C 78 60.629 61.334 -0.705 1
1 897 . 4 1 1 A 78 78 PHE CB C 78 38.295 38.774 -0.479 1
1 902 . 4 1 1 A 78 78 PHE N N 78 122.682 122.400 0.282 1
1 903 . 4 1 1 A 79 79 PHE H H 79 8.890 7.746 1.144 1
1 904 . 4 1 1 A 79 79 PHE HA H 79 3.800 4.085 -0.285 1
1 912 . 4 1 1 A 79 79 PHE C C 79 178.354 178.254 0.100 1
1 913 . 4 1 1 A 79 79 PHE CA C 79 60.704 61.822 -1.118 1
1 914 . 4 1 1 A 79 79 PHE CB C 79 37.184 38.694 -1.510 1
1 920 . 4 1 1 A 79 79 PHE N N 79 121.056 118.382 2.674 1
1 921 . 4 1 1 A 80 80 GLU H H 80 7.793 8.231 -0.438 1
1 922 . 4 1 1 A 80 80 GLU HA H 80 4.082 3.962 0.120 1
1 927 . 4 1 1 A 80 80 GLU C C 80 179.068 179.497 -0.429 1
1 928 . 4 1 1 A 80 80 GLU CA C 80 59.735 59.509 0.226 1
1 929 . 4 1 1 A 80 80 GLU CB C 80 28.722 29.124 -0.402 1
1 931 . 4 1 1 A 80 80 GLU N N 80 120.312 118.403 1.909 1
1 932 . 4 1 1 A 81 81 ASN H H 81 8.624 8.541 0.083 1
1 933 . 4 1 1 A 81 81 ASN HA H 81 4.521 4.485 0.036 1
1 938 . 4 1 1 A 81 81 ASN C C 81 179.262 178.375 0.887 1
1 939 . 4 1 1 A 81 81 ASN CA C 81 55.504 56.362 -0.858 1
1 940 . 4 1 1 A 81 81 ASN CB C 81 37.517 37.636 -0.119 1
1 941 . 4 1 1 A 81 81 ASN N N 81 119.338 118.474 0.864 1
1 943 . 4 1 1 A 82 82 CYS H H 82 8.554 7.893 0.661 1
1 944 . 4 1 1 A 82 82 CYS HA H 82 3.792 3.976 -0.184 1
1 947 . 4 1 1 A 82 82 CYS C C 82 176.478 177.174 -0.696 1
1 948 . 4 1 1 A 82 82 CYS CA C 82 65.232 62.960 2.272 1
1 949 . 4 1 1 A 82 82 CYS CB C 82 26.762 27.244 -0.482 1
1 950 . 4 1 1 A 82 82 CYS N N 82 120.576 118.078 2.498 1
1 951 . 4 1 1 A 83 83 ARG H H 83 8.522 7.986 0.536 1
1 952 . 4 1 1 A 83 83 ARG HA H 83 3.932 4.175 -0.243 1
1 960 . 4 1 1 A 83 83 ARG C C 83 179.138 178.777 0.361 1
1 961 . 4 1 1 A 83 83 ARG CA C 83 60.443 59.003 1.440 1
1 962 . 4 1 1 A 83 83 ARG CB C 83 29.550 29.752 -0.202 1
1 965 . 4 1 1 A 83 83 ARG N N 83 123.035 119.649 3.386 1
1 967 . 4 1 1 A 84 84 ASP H H 84 7.791 8.281 -0.490 1
1 968 . 4 1 1 A 84 84 ASP HA H 84 4.353 4.410 -0.057 1
1 971 . 4 1 1 A 84 84 ASP C C 84 178.649 178.260 0.389 1
1 972 . 4 1 1 A 84 84 ASP CA C 84 57.767 57.632 0.135 1
1 973 . 4 1 1 A 84 84 ASP CB C 84 41.305 41.641 -0.336 1
1 974 . 4 1 1 A 84 84 ASP N N 84 120.332 119.675 0.657 1
1 975 . 4 1 1 A 85 85 THR H H 85 8.370 7.868 0.502 1
1 976 . 4 1 1 A 85 85 THR HA H 85 3.730 3.990 -0.260 1
1 981 . 4 1 1 A 85 85 THR C C 85 175.198 176.849 -1.651 1
1 982 . 4 1 1 A 85 85 THR CA C 85 66.830 65.269 1.561 1
1 983 . 4 1 1 A 85 85 THR CB C 85 68.533 68.875 -0.342 1
1 985 . 4 1 1 A 85 85 THR N N 85 117.360 113.429 3.931 1
1 986 . 4 1 1 A 86 86 ALA H H 86 8.845 8.394 0.451 1
1 987 . 4 1 1 A 86 86 ALA HA H 86 3.991 4.164 -0.173 1
1 991 . 4 1 1 A 86 86 ALA C C 86 179.980 179.601 0.379 1
1 992 . 4 1 1 A 86 86 ALA CA C 86 55.769 55.760 0.009 1
1 993 . 4 1 1 A 86 86 ALA CB C 86 17.881 18.381 -0.500 1
1 994 . 4 1 1 A 86 86 ALA N N 86 123.613 123.261 0.352 1
1 995 . 4 1 1 A 87 87 LYS H H 87 7.686 8.311 -0.625 1
1 996 . 4 1 1 A 87 87 LYS HA H 87 4.099 4.032 0.067 1
1 1005 . 4 1 1 A 87 87 LYS C C 87 179.592 178.771 0.821 1
1 1006 . 4 1 1 A 87 87 LYS CA C 87 59.708 59.273 0.435 1
1 1007 . 4 1 1 A 87 87 LYS CB C 87 32.054 32.051 0.003 1
1 1011 . 4 1 1 A 87 87 LYS N N 87 119.623 117.115 2.508 1
1 1012 . 4 1 1 A 88 88 ARG H H 88 7.683 7.655 0.028 1
1 1013 . 4 1 1 A 88 88 ARG HA H 88 4.051 4.134 -0.083 1
1 1020 . 4 1 1 A 88 88 ARG C C 88 180.053 178.918 1.135 1
1 1021 . 4 1 1 A 88 88 ARG CA C 88 59.558 59.141 0.417 1
1 1022 . 4 1 1 A 88 88 ARG CB C 88 29.684 30.054 -0.370 1
1 1025 . 4 1 1 A 88 88 ARG N N 88 120.788 119.752 1.036 1
1 1026 . 4 1 1 A 89 89 ASN H H 89 8.973 8.584 0.389 1
1 1027 . 4 1 1 A 89 89 ASN HA H 89 4.354 4.647 -0.293 1
1 1032 . 4 1 1 A 89 89 ASN C C 89 178.382 178.416 -0.034 1
1 1033 . 4 1 1 A 89 89 ASN CA C 89 55.334 55.683 -0.349 1
1 1034 . 4 1 1 A 89 89 ASN CB C 89 37.864 38.541 -0.677 1
1 1035 . 4 1 1 A 89 89 ASN N N 89 121.012 117.839 3.173 1
1 1037 . 4 1 1 A 90 90 GLN H H 90 8.152 7.950 0.202 1
1 1038 . 4 1 1 A 90 90 GLN HA H 90 4.020 4.141 -0.121 1
1 1045 . 4 1 1 A 90 90 GLN C C 90 179.075 178.871 0.204 1
1 1046 . 4 1 1 A 90 90 GLN CA C 90 59.318 58.728 0.590 1
1 1047 . 4 1 1 A 90 90 GLN CB C 90 28.049 28.469 -0.420 1
1 1049 . 4 1 1 A 90 90 GLN N N 90 122.122 119.578 2.544 1
1 1051 . 4 1 1 A 91 91 GLN H H 91 7.514 8.244 -0.730 1
1 1052 . 4 1 1 A 91 91 GLN HA H 91 4.053 4.075 -0.022 1
1 1059 . 4 1 1 A 91 91 GLN C C 91 177.081 177.284 -0.203 1
1 1060 . 4 1 1 A 91 91 GLN CA C 91 58.031 58.288 -0.257 1
1 1061 . 4 1 1 A 91 91 GLN CB C 91 28.365 27.761 0.604 1
1 1063 . 4 1 1 A 91 91 GLN N N 91 118.124 117.925 0.199 1
1 1065 . 4 1 1 A 92 92 ALA H H 92 7.704 7.380 0.324 1
1 1066 . 4 1 1 A 92 92 ALA HA H 92 4.246 4.360 -0.114 1
1 1070 . 4 1 1 A 92 92 ALA C C 92 178.450 177.811 0.639 1
1 1071 . 4 1 1 A 92 92 ALA CA C 92 52.671 52.014 0.657 1
1 1072 . 4 1 1 A 92 92 ALA CB C 92 19.316 19.629 -0.313 1
1 1073 . 4 1 1 A 92 92 ALA N N 92 119.880 120.866 -0.986 1
1 1074 . 4 1 1 A 93 93 GLY H H 93 7.693 8.081 -0.388 1
1 1075 . 4 1 1 A 93 93 GLY HA2 H 93 3.941 3.856 0.085 1
1 1076 . 4 1 1 A 93 93 GLY HA3 H 93 3.744 3.860 -0.116 1
1 1077 . 4 1 1 A 93 93 GLY C C 93 174.344 175.448 -1.104 1
1 1078 . 4 1 1 A 93 93 GLY CA C 93 45.949 46.763 -0.814 1
1 1079 . 4 1 1 A 93 93 GLY N N 93 105.347 107.566 -2.219 1
1 1080 . 4 1 1 A 94 94 ASN H H 94 7.076 9.060 -1.984 1
1 1081 . 4 1 1 A 94 94 ASN HA H 94 4.115 4.513 -0.398 1
1 1085 . 4 1 1 A 94 94 ASN C C 94 175.410 175.526 -0.116 1
1 1086 . 4 1 1 A 94 94 ASN CA C 94 52.651 52.408 0.243 1
1 1087 . 4 1 1 A 94 94 ASN CB C 94 38.330 39.170 -0.840 1
1 1088 . 4 1 1 A 94 94 ASN N N 94 115.747 116.841 -1.094 1
1 1090 . 4 1 1 A 95 95 GLY H H 95 8.236 8.405 -0.169 1
1 1091 . 4 1 1 A 95 95 GLY HA2 H 95 3.633 3.750 -0.117 1
1 1092 . 4 1 1 A 95 95 GLY HA3 H 95 3.633 3.911 -0.278 1
1 1093 . 4 1 1 A 95 95 GLY C C 95 174.450 173.645 0.805 1
1 1094 . 4 1 1 A 95 95 GLY CA C 95 45.522 46.190 -0.668 1
1 1095 . 4 1 1 A 95 95 GLY N N 95 109.166 108.950 0.216 1
1 1096 . 4 1 1 A 96 96 TRP H H 96 7.899 7.911 -0.012 1
1 1097 . 4 1 1 A 96 96 TRP HA H 96 5.241 5.239 0.002 1
1 1106 . 4 1 1 A 96 96 TRP C C 96 175.661 175.838 -0.177 1
1 1107 . 4 1 1 A 96 96 TRP CA C 96 55.090 56.142 -1.052 1
1 1108 . 4 1 1 A 96 96 TRP CB C 96 27.138 32.472 -5.334 1
1 1114 . 4 1 1 A 96 96 TRP N N 96 122.840 120.061 2.779 1
1 1116 . 4 1 1 A 97 97 ASP H H 97 7.344 9.037 -1.693 1
1 1117 . 4 1 1 A 97 97 ASP HA H 97 4.829 4.416 0.413 1
1 1120 . 4 1 1 A 97 97 ASP C C 97 175.019 176.145 -1.126 1
1 1121 . 4 1 1 A 97 97 ASP CA C 97 52.149 56.377 -4.228 1
1 1122 . 4 1 1 A 97 97 ASP CB C 97 42.697 38.657 4.040 1
1 1123 . 4 1 1 A 97 97 ASP N N 97 126.861 117.168 9.693 1
1 1124 . 4 1 1 A 98 98 PHE H H 98 8.566 8.490 0.076 1
1 1125 . 4 1 1 A 98 98 PHE HA H 98 3.727 4.223 -0.496 1
1 1133 . 4 1 1 A 98 98 PHE C C 98 177.443 177.327 0.116 1
1 1134 . 4 1 1 A 98 98 PHE CA C 98 62.471 61.182 1.289 1
1 1135 . 4 1 1 A 98 98 PHE CB C 98 39.919 39.888 0.031 1
1 1141 . 4 1 1 A 98 98 PHE N N 98 117.781 121.209 -3.428 1
1 1142 . 4 1 1 A 99 99 ASP H H 99 8.259 8.528 -0.269 1
1 1143 . 4 1 1 A 99 99 ASP HA H 99 3.960 4.121 -0.161 1
1 1146 . 4 1 1 A 99 99 ASP C C 99 178.132 178.410 -0.278 1
1 1147 . 4 1 1 A 99 99 ASP CA C 99 57.658 56.488 1.170 1
1 1148 . 4 1 1 A 99 99 ASP CB C 99 38.572 40.667 -2.095 1
1 1149 . 4 1 1 A 99 99 ASP N N 99 121.709 119.290 2.419 1
1 1150 . 4 1 1 A 100 100 MET H H 100 8.008 8.231 -0.223 1
1 1151 . 4 1 1 A 100 100 MET HA H 100 3.644 4.184 -0.540 1
1 1156 . 4 1 1 A 100 100 MET C C 100 180.008 176.313 3.695 1
1 1157 . 4 1 1 A 100 100 MET CA C 100 58.598 58.536 0.062 1
1 1158 . 4 1 1 A 100 100 MET CB C 100 33.423 32.675 0.748 1
1 1160 . 4 1 1 A 100 100 MET N N 100 119.668 118.530 1.138 1
1 1161 . 4 1 1 A 101 101 LEU H H 101 7.961 8.021 -0.060 1
1 1162 . 4 1 1 A 101 101 LEU HA H 101 3.523 4.908 -1.385 1
1 1172 . 4 1 1 A 101 101 LEU C C 101 173.873 176.306 -2.433 1
1 1173 . 4 1 1 A 101 101 LEU CA C 101 58.743 53.666 5.077 1
1 1174 . 4 1 1 A 101 101 LEU CB C 101 42.632 44.241 -1.609 1
1 1178 . 4 1 1 A 101 101 LEU N N 101 119.752 119.514 0.238 1
1 1179 . 4 1 1 A 102 102 THR H H 102 6.955 8.922 -1.967 1
1 1180 . 4 1 1 A 102 102 THR HA H 102 4.134 4.742 -0.608 1
1 1185 . 4 1 1 A 102 102 THR C C 102 176.513 174.158 2.355 1
1 1186 . 4 1 1 A 102 102 THR CA C 102 61.125 62.408 -1.283 1
1 1187 . 4 1 1 A 102 102 THR CB C 102 71.415 69.222 2.193 1
1 1189 . 4 1 1 A 102 102 THR N N 102 124.665 120.806 3.859 1
1 1190 . 4 1 1 A 103 103 GLY H H 103 7.816 8.816 -1.000 1
1 1191 . 4 1 1 A 103 103 GLY HA2 H 103 3.824 4.046 -0.222 1
1 1192 . 4 1 1 A 103 103 GLY HA3 H 103 3.824 4.056 -0.232 1
1 1193 . 4 1 1 A 103 103 GLY C C 103 174.126 173.684 0.442 1
1 1194 . 4 1 1 A 103 103 GLY CA C 103 47.805 47.369 0.436 1
1 1195 . 4 1 1 A 103 103 GLY N N 103 114.191 112.372 1.819 1
1 1196 . 4 1 1 A 104 104 SER H H 104 8.860 8.307 0.553 1
1 1197 . 4 1 1 A 104 104 SER HA H 104 4.758 5.374 -0.616 1
1 1200 . 4 1 1 A 104 104 SER C C 104 174.591 173.343 1.248 1
1 1201 . 4 1 1 A 104 104 SER CA C 104 56.755 57.499 -0.744 1
1 1202 . 4 1 1 A 104 104 SER CB C 104 65.050 65.951 -0.901 1
1 1203 . 4 1 1 A 104 104 SER N N 104 114.771 115.880 -1.109 1
1 1204 . 4 1 1 A 105 105 GLY H H 105 8.788 8.464 0.324 1
1 1205 . 4 1 1 A 105 105 GLY HA2 H 105 3.733 4.178 -0.445 1
1 1206 . 4 1 1 A 105 105 GLY HA3 H 105 3.733 4.241 -0.508 1
1 1207 . 4 1 1 A 105 105 GLY CA C 105 47.247 45.750 1.497 1
1 1208 . 4 1 1 A 105 105 GLY N N 105 110.394 111.798 -1.404 1
1 1209 . 4 1 1 A 106 106 ASN HA H 106 4.454 4.656 -0.202 1
1 1212 . 4 1 1 A 106 106 ASN C C 106 175.180 176.087 -0.907 1
1 1213 . 4 1 1 A 106 106 ASN CA C 106 54.492 55.544 -1.052 1
1 1214 . 4 1 1 A 106 106 ASN CB C 106 37.282 39.344 -2.062 1
1 1215 . 4 1 1 A 107 107 TYR H H 107 8.241 7.584 0.657 1
1 1216 . 4 1 1 A 107 107 TYR HA H 107 4.335 4.758 -0.423 1
1 1223 . 4 1 1 A 107 107 TYR C C 107 173.954 177.316 -3.362 1
1 1224 . 4 1 1 A 107 107 TYR CA C 107 57.727 57.980 -0.253 1
1 1225 . 4 1 1 A 107 107 TYR CB C 107 37.063 40.168 -3.105 1
1 1230 . 4 1 1 A 107 107 TYR N N 107 120.708 115.932 4.776 1
1 1231 . 4 1 1 A 108 108 SER H H 108 7.117 8.215 -1.098 1
1 1232 . 4 1 1 A 108 108 SER HA H 108 4.221 4.138 0.083 1
1 1235 . 4 1 1 A 108 108 SER C C 108 174.834 174.244 0.590 1
1 1236 . 4 1 1 A 108 108 SER CA C 108 59.859 61.966 -2.107 1
1 1237 . 4 1 1 A 108 108 SER CB C 108 63.846 62.856 0.990 1
1 1238 . 4 1 1 A 108 108 SER N N 108 113.362 116.614 -3.252 1
1 1239 . 4 1 1 A 109 109 SER H H 109 8.053 7.896 0.157 1
1 1240 . 4 1 1 A 109 109 SER HA H 109 4.560 4.362 0.198 1
1 1243 . 4 1 1 A 109 109 SER CA C 109 57.141 59.392 -2.251 1
1 1244 . 4 1 1 A 109 109 SER CB C 109 64.874 62.935 1.939 1
1 1245 . 4 1 1 A 109 109 SER N N 109 116.657 114.938 1.719 1
1 1246 . 4 1 1 A 110 110 THR HA H 110 3.541 3.801 -0.260 1
1 1251 . 4 1 1 A 110 110 THR C C 110 175.477 176.318 -0.841 1
1 1252 . 4 1 1 A 110 110 THR CA C 110 66.443 65.997 0.446 1
1 1253 . 4 1 1 A 110 110 THR CB C 110 68.091 68.274 -0.183 1
1 1255 . 4 1 1 A 111 111 ASP H H 111 8.224 8.280 -0.056 1
1 1256 . 4 1 1 A 111 111 ASP HA H 111 4.237 4.233 0.004 1
1 1259 . 4 1 1 A 111 111 ASP C C 111 177.520 178.142 -0.622 1
1 1260 . 4 1 1 A 111 111 ASP CA C 111 57.559 57.237 0.322 1
1 1261 . 4 1 1 A 111 111 ASP CB C 111 40.292 41.303 -1.011 1
1 1262 . 4 1 1 A 111 111 ASP N N 111 119.490 121.348 -1.858 1
1 1263 . 4 1 1 A 112 112 ALA H H 112 7.431 8.451 -1.020 1
1 1264 . 4 1 1 A 112 112 ALA HA H 112 4.191 4.140 0.051 1
1 1268 . 4 1 1 A 112 112 ALA C C 112 180.646 180.556 0.090 1
1 1269 . 4 1 1 A 112 112 ALA CA C 112 54.534 55.648 -1.114 1
1 1270 . 4 1 1 A 112 112 ALA CB C 112 18.992 18.347 0.645 1
1 1271 . 4 1 1 A 112 112 ALA N N 112 119.710 120.733 -1.023 1
1 1272 . 4 1 1 A 113 113 GLN H H 113 7.576 8.413 -0.837 1
1 1273 . 4 1 1 A 113 113 GLN HA H 113 3.562 4.149 -0.587 1
1 1278 . 4 1 1 A 113 113 GLN C C 113 176.756 178.826 -2.070 1
1 1279 . 4 1 1 A 113 113 GLN CA C 113 57.736 58.615 -0.879 1
1 1280 . 4 1 1 A 113 113 GLN CB C 113 29.110 28.375 0.735 1
1 1281 . 4 1 1 A 113 113 GLN N N 113 117.518 117.372 0.146 1
1 1283 . 4 1 1 A 114 114 MET H H 114 8.192 7.700 0.492 1
1 1284 . 4 1 1 A 114 114 MET HA H 114 4.231 3.913 0.318 1
1 1289 . 4 1 1 A 114 114 MET C C 114 175.648 177.987 -2.339 1
1 1290 . 4 1 1 A 114 114 MET CA C 114 57.446 57.819 -0.373 1
1 1291 . 4 1 1 A 114 114 MET CB C 114 33.570 32.251 1.319 1
1 1293 . 4 1 1 A 114 114 MET N N 114 111.509 119.878 -8.369 1
1 1294 . 4 1 1 A 115 115 GLN H H 115 6.940 7.425 -0.485 1
1 1295 . 4 1 1 A 115 115 GLN HA H 115 4.307 4.112 0.195 1
1 1302 . 4 1 1 A 115 115 GLN C C 115 176.270 175.982 0.288 1
1 1303 . 4 1 1 A 115 115 GLN CA C 115 54.680 56.128 -1.448 1
1 1304 . 4 1 1 A 115 115 GLN CB C 115 28.233 28.890 -0.657 1
1 1306 . 4 1 1 A 115 115 GLN N N 115 114.300 116.047 -1.747 1
1 1308 . 4 1 1 A 116 116 TYR H H 116 6.677 7.775 -1.098 1
1 1309 . 4 1 1 A 116 116 TYR HA H 116 4.193 4.280 -0.087 1
1 1312 . 4 1 1 A 116 116 TYR C C 116 175.268 173.693 1.575 1
1 1313 . 4 1 1 A 116 116 TYR CA C 116 54.357 58.731 -4.374 1
1 1314 . 4 1 1 A 116 116 TYR CB C 116 35.498 36.902 -1.404 1
1 1315 . 4 1 1 A 116 116 TYR N N 116 117.919 118.969 -1.050 1
1 1316 . 4 1 1 A 117 117 ASP H H 117 8.081 8.347 -0.266 1
1 1317 . 4 1 1 A 117 117 ASP HA H 117 4.665 4.610 0.055 1
1 1320 . 4 1 1 A 117 117 ASP CA C 117 52.422 50.186 2.236 1
1 1321 . 4 1 1 A 117 117 ASP CB C 117 42.416 43.388 -0.972 1
1 1322 . 4 1 1 A 117 117 ASP N N 117 120.887 127.527 -6.640 1
1 1323 . 4 1 1 A 118 118 PRO C C 118 179.180 179.114 0.066 1
1 1324 . 4 1 1 A 118 118 PRO CA C 118 65.942 65.912 0.030 1
1 1325 . 4 1 1 A 118 118 PRO CB C 118 32.197 31.807 0.390 1
1 1326 . 4 1 1 A 119 119 GLY H H 119 9.742 8.572 1.170 1
1 1327 . 4 1 1 A 119 119 GLY C C 119 175.622 175.296 0.326 1
1 1328 . 4 1 1 A 119 119 GLY CA C 119 46.785 46.780 0.005 1
1 1329 . 4 1 1 A 119 119 GLY N N 119 106.412 106.414 -0.002 1
1 1330 . 4 1 1 A 120 120 LEU H H 120 6.666 7.485 -0.819 1
1 1331 . 4 1 1 A 120 120 LEU HA H 120 3.365 3.735 -0.370 1
1 1341 . 4 1 1 A 120 120 LEU C C 120 179.262 178.527 0.735 1
1 1342 . 4 1 1 A 120 120 LEU CA C 120 56.605 57.111 -0.506 1
1 1343 . 4 1 1 A 120 120 LEU CB C 120 39.262 41.619 -2.357 1
1 1347 . 4 1 1 A 120 120 LEU N N 120 126.226 122.182 4.044 1
1 1348 . 4 1 1 A 121 121 PHE H H 121 7.356 8.588 -1.232 1
1 1349 . 4 1 1 A 121 121 PHE HA H 121 4.459 3.988 0.471 1
1 1352 . 4 1 1 A 121 121 PHE C C 121 179.716 177.935 1.781 1
1 1353 . 4 1 1 A 121 121 PHE CA C 121 62.838 62.154 0.684 1
1 1354 . 4 1 1 A 121 121 PHE CB C 121 37.603 39.391 -1.788 1
1 1355 . 4 1 1 A 121 121 PHE N N 121 117.437 119.444 -2.007 1
1 1356 . 4 1 1 A 122 122 ALA H H 122 7.926 8.581 -0.655 1
1 1357 . 4 1 1 A 122 122 ALA HA H 122 4.523 3.715 0.808 1
1 1361 . 4 1 1 A 122 122 ALA C C 122 180.435 179.590 0.845 1
1 1362 . 4 1 1 A 122 122 ALA CA C 122 55.527 55.205 0.322 1
1 1363 . 4 1 1 A 122 122 ALA CB C 122 17.814 18.098 -0.284 1
1 1364 . 4 1 1 A 122 122 ALA N N 122 121.068 121.335 -0.267 1
1 1365 . 4 1 1 A 123 123 GLN H H 123 7.507 7.940 -0.433 1
1 1366 . 4 1 1 A 123 123 GLN HA H 123 4.153 3.965 0.188 1
1 1371 . 4 1 1 A 123 123 GLN C C 123 180.561 178.355 2.206 1
1 1372 . 4 1 1 A 123 123 GLN CA C 123 59.948 58.866 1.082 1
1 1373 . 4 1 1 A 123 123 GLN CB C 123 29.135 28.063 1.072 1
1 1375 . 4 1 1 A 123 123 GLN N N 123 120.324 117.259 3.065 1
1 1376 . 4 1 1 A 124 124 ILE H H 124 8.318 8.137 0.181 1
1 1377 . 4 1 1 A 124 124 ILE HA H 124 3.635 3.899 -0.264 1
1 1387 . 4 1 1 A 124 124 ILE C C 124 176.481 178.186 -1.705 1
1 1388 . 4 1 1 A 124 124 ILE CA C 124 66.432 64.411 2.021 1
1 1389 . 4 1 1 A 124 124 ILE CB C 124 39.168 37.947 1.221 1
1 1393 . 4 1 1 A 124 124 ILE N N 124 123.747 119.292 4.455 1
1 1394 . 4 1 1 A 125 125 GLN H H 125 8.474 7.854 0.620 1
1 1395 . 4 1 1 A 125 125 GLN HA H 125 4.264 3.978 0.286 1
1 1402 . 4 1 1 A 125 125 GLN C C 125 178.947 177.776 1.171 1
1 1403 . 4 1 1 A 125 125 GLN CA C 125 59.651 58.495 1.156 1
1 1404 . 4 1 1 A 125 125 GLN CB C 125 28.880 28.605 0.275 1
1 1406 . 4 1 1 A 125 125 GLN N N 125 120.368 121.193 -0.825 1
1 1408 . 4 1 1 A 126 126 ALA H H 126 8.002 8.154 -0.152 1
1 1409 . 4 1 1 A 126 126 ALA HA H 126 4.144 4.023 0.121 1
1 1413 . 4 1 1 A 126 126 ALA C C 126 179.316 180.163 -0.847 1
1 1414 . 4 1 1 A 126 126 ALA CA C 126 55.036 54.946 0.090 1
1 1415 . 4 1 1 A 126 126 ALA CB C 126 18.087 17.989 0.098 1
1 1416 . 4 1 1 A 126 126 ALA N N 126 121.661 121.486 0.175 1
1 1417 . 4 1 1 A 127 127 ALA H H 127 7.823 8.128 -0.305 1
1 1418 . 4 1 1 A 127 127 ALA HA H 127 4.162 4.002 0.160 1
1 1422 . 4 1 1 A 127 127 ALA C C 127 180.707 179.307 1.400 1
1 1423 . 4 1 1 A 127 127 ALA CA C 127 55.080 54.957 0.123 1
1 1424 . 4 1 1 A 127 127 ALA CB C 127 19.354 18.487 0.867 1
1 1425 . 4 1 1 A 127 127 ALA N N 127 119.853 120.211 -0.358 1
1 1426 . 4 1 1 A 128 128 ALA H H 128 8.936 7.735 1.201 1
1 1427 . 4 1 1 A 128 128 ALA HA H 128 3.928 3.734 0.194 1
1 1431 . 4 1 1 A 128 128 ALA C C 128 181.031 179.402 1.629 1
1 1432 . 4 1 1 A 128 128 ALA CA C 128 55.502 54.644 0.858 1
1 1433 . 4 1 1 A 128 128 ALA CB C 128 16.609 17.963 -1.354 1
1 1434 . 4 1 1 A 128 128 ALA N N 128 121.355 120.236 1.119 1
1 1435 . 4 1 1 A 129 129 THR H H 129 8.543 7.788 0.755 1
1 1436 . 4 1 1 A 129 129 THR HA H 129 4.015 3.677 0.338 1
1 1441 . 4 1 1 A 129 129 THR C C 129 177.332 176.332 1.000 1
1 1442 . 4 1 1 A 129 129 THR CA C 129 65.893 65.168 0.725 1
1 1443 . 4 1 1 A 129 129 THR CB C 129 68.566 68.551 0.015 1
1 1445 . 4 1 1 A 129 129 THR N N 129 112.709 112.250 0.459 1
1 1446 . 4 1 1 A 130 130 LYS H H 130 8.126 7.354 0.772 1
1 1447 . 4 1 1 A 130 130 LYS HA H 130 4.000 4.050 -0.050 1
1 1456 . 4 1 1 A 130 130 LYS C C 130 179.082 178.688 0.394 1
1 1457 . 4 1 1 A 130 130 LYS CA C 130 60.299 58.492 1.807 1
1 1458 . 4 1 1 A 130 130 LYS CB C 130 32.767 31.742 1.025 1
1 1462 . 4 1 1 A 130 130 LYS N N 130 123.879 120.707 3.172 1
1 1463 . 4 1 1 A 131 131 ALA H H 131 7.184 7.611 -0.427 1
1 1464 . 4 1 1 A 131 131 ALA HA H 131 4.005 4.253 -0.248 1
1 1468 . 4 1 1 A 131 131 ALA C C 131 178.482 179.574 -1.092 1
1 1469 . 4 1 1 A 131 131 ALA CA C 131 55.027 55.069 -0.042 1
1 1470 . 4 1 1 A 131 131 ALA CB C 131 18.669 19.560 -0.891 1
1 1471 . 4 1 1 A 131 131 ALA N N 131 118.590 121.196 -2.606 1
1 1472 . 4 1 1 A 132 132 TRP H H 132 7.977 8.516 -0.539 1
1 1473 . 4 1 1 A 132 132 TRP HA H 132 4.001 4.360 -0.359 1
1 1480 . 4 1 1 A 132 132 TRP C C 132 177.332 175.885 1.447 1
1 1481 . 4 1 1 A 132 132 TRP CA C 132 60.431 56.915 3.516 1
1 1482 . 4 1 1 A 132 132 TRP CB C 132 27.786 27.858 -0.072 1
1 1486 . 4 1 1 A 132 132 TRP N N 132 119.168 116.788 2.380 1
1 1488 . 4 1 1 A 133 133 ARG H H 133 8.006 8.037 -0.031 1
1 1489 . 4 1 1 A 133 133 ARG HA H 133 4.027 4.390 -0.363 1
1 1497 . 4 1 1 A 133 133 ARG C C 133 176.664 178.293 -1.629 1
1 1498 . 4 1 1 A 133 133 ARG CA C 133 59.355 56.922 2.433 1
1 1499 . 4 1 1 A 133 133 ARG CB C 133 30.451 32.396 -1.945 1
1 1502 . 4 1 1 A 133 133 ARG N N 133 113.062 120.605 -7.543 1
1 1504 . 4 1 1 A 134 134 LYS H H 134 7.322 8.084 -0.762 1
1 1505 . 4 1 1 A 134 134 LYS HA H 134 4.313 4.310 0.003 1
1 1514 . 4 1 1 A 134 134 LYS C C 134 176.282 175.943 0.339 1
1 1515 . 4 1 1 A 134 134 LYS CA C 134 54.922 56.751 -1.829 1
1 1516 . 4 1 1 A 134 134 LYS CB C 134 32.633 31.995 0.638 1
1 1520 . 4 1 1 A 134 134 LYS N N 134 118.170 119.291 -1.121 1
1 1521 . 4 1 1 A 135 135 LEU H H 135 7.440 7.955 -0.515 1
1 1522 . 4 1 1 A 135 135 LEU HA H 135 4.174 4.539 -0.365 1
1 1532 . 4 1 1 A 135 135 LEU CA C 135 54.408 52.412 1.996 1
1 1533 . 4 1 1 A 135 135 LEU CB C 135 40.407 41.822 -1.415 1
1 1537 . 4 1 1 A 135 135 LEU N N 135 123.358 121.507 1.851 1
1 1538 . 4 1 1 A 136 136 PRO HA H 136 4.437 4.489 -0.052 1
1 1545 . 4 1 1 A 136 136 PRO C C 136 177.106 175.718 1.388 1
1 1546 . 4 1 1 A 136 136 PRO CA C 136 62.889 64.846 -1.957 1
1 1547 . 4 1 1 A 136 136 PRO CB C 136 32.192 32.280 -0.088 1
1 1550 . 4 1 1 A 137 137 VAL H H 137 8.219 7.358 0.861 1
1 1551 . 4 1 1 A 137 137 VAL HA H 137 4.077 4.435 -0.358 1
1 1559 . 4 1 1 A 137 137 VAL C C 137 176.305 176.062 0.243 1
1 1560 . 4 1 1 A 137 137 VAL CA C 137 61.958 59.243 2.715 1
1 1561 . 4 1 1 A 137 137 VAL CB C 137 32.755 35.359 -2.604 1
1 1564 . 4 1 1 A 137 137 VAL N N 137 120.079 111.822 8.257 1
1 1565 . 4 1 1 A 138 138 LYS H H 138 8.444 8.510 -0.066 1
1 1566 . 4 1 1 A 138 138 LYS HA H 138 4.316 4.048 0.268 1
1 1575 . 4 1 1 A 138 138 LYS C C 138 176.790 176.452 0.338 1
1 1576 . 4 1 1 A 138 138 LYS CA C 138 56.792 57.861 -1.069 1
1 1577 . 4 1 1 A 138 138 LYS CB C 138 33.205 32.864 0.341 1
1 1581 . 4 1 1 A 138 138 LYS N N 138 126.449 121.546 4.903 1
1 1582 . 4 1 1 A 139 139 GLY H H 139 8.518 7.745 0.773 1
1 1583 . 4 1 1 A 139 139 GLY HA2 H 139 4.070 3.959 0.111 1
1 1584 . 4 1 1 A 139 139 GLY HA3 H 139 3.897 3.972 -0.075 1
1 1585 . 4 1 1 A 139 139 GLY C C 139 172.874 174.143 -1.269 1
1 1586 . 4 1 1 A 139 139 GLY CA C 139 45.157 45.270 -0.113 1
1 1587 . 4 1 1 A 139 139 GLY N N 139 112.617 105.933 6.684 1
1 6 . 5 1 1 A 2 2 VAL H H 2 8.992 9.236 -0.244 1
1 7 . 5 1 1 A 2 2 VAL HA H 2 5.370 4.872 0.498 1
1 15 . 5 1 1 A 2 2 VAL C C 2 174.325 174.530 -0.205 1
1 16 . 5 1 1 A 2 2 VAL CA C 2 61.267 60.719 0.548 1
1 17 . 5 1 1 A 2 2 VAL CB C 2 33.890 33.983 -0.093 1
1 20 . 5 1 1 A 2 2 VAL N N 2 126.939 120.310 6.629 1
1 21 . 5 1 1 A 3 3 THR H H 3 8.912 9.023 -0.111 1
1 22 . 5 1 1 A 3 3 THR HA H 3 4.505 4.824 -0.319 1
1 27 . 5 1 1 A 3 3 THR C C 3 172.710 172.988 -0.278 1
1 28 . 5 1 1 A 3 3 THR CA C 3 59.689 59.461 0.228 1
1 29 . 5 1 1 A 3 3 THR CB C 3 72.398 71.683 0.715 1
1 31 . 5 1 1 A 3 3 THR N N 3 118.091 122.790 -4.699 1
1 32 . 5 1 1 A 4 4 GLU H H 4 8.631 8.245 0.386 1
1 33 . 5 1 1 A 4 4 GLU HA H 4 5.788 4.896 0.892 1
1 38 . 5 1 1 A 4 4 GLU C C 4 175.758 174.509 1.249 1
1 39 . 5 1 1 A 4 4 GLU CA C 4 54.902 55.001 -0.099 1
1 40 . 5 1 1 A 4 4 GLU CB C 4 35.097 31.530 3.567 1
1 42 . 5 1 1 A 4 4 GLU N N 4 120.966 124.724 -3.758 1
1 43 . 5 1 1 A 5 5 THR H H 5 9.188 8.790 0.398 1
1 44 . 5 1 1 A 5 5 THR HA H 5 4.739 4.749 -0.010 1
1 49 . 5 1 1 A 5 5 THR C C 5 172.757 172.213 0.544 1
1 50 . 5 1 1 A 5 5 THR CA C 5 60.382 59.565 0.817 1
1 51 . 5 1 1 A 5 5 THR CB C 5 71.558 70.477 1.081 1
1 53 . 5 1 1 A 5 5 THR N N 5 119.366 116.126 3.240 1
1 54 . 5 1 1 A 6 6 VAL H H 6 8.476 8.805 -0.329 1
1 55 . 5 1 1 A 6 6 VAL HA H 6 5.026 5.029 -0.003 1
1 63 . 5 1 1 A 6 6 VAL C C 6 176.674 173.502 3.172 1
1 64 . 5 1 1 A 6 6 VAL CA C 6 61.008 58.916 2.092 1
1 65 . 5 1 1 A 6 6 VAL CB C 6 33.861 34.565 -0.704 1
1 68 . 5 1 1 A 6 6 VAL N N 6 121.384 121.539 -0.155 1
1 69 . 5 1 1 A 7 7 ASP H H 7 8.848 9.066 -0.218 1
1 70 . 5 1 1 A 7 7 ASP HA H 7 4.797 5.234 -0.437 1
1 73 . 5 1 1 A 7 7 ASP CA C 7 52.834 53.124 -0.290 1
1 74 . 5 1 1 A 7 7 ASP CB C 7 42.219 43.439 -1.220 1
1 75 . 5 1 1 A 7 7 ASP N N 7 127.061 124.266 2.795 1
1 76 . 5 1 1 A 8 8 GLY C C 8 175.143 174.868 0.275 1
1 77 . 5 1 1 A 8 8 GLY CA C 8 46.553 46.831 -0.278 1
1 78 . 5 1 1 A 9 9 GLN H H 9 8.408 8.058 0.350 1
1 79 . 5 1 1 A 9 9 GLN HA H 9 4.541 4.255 0.286 1
1 86 . 5 1 1 A 9 9 GLN C C 9 176.463 176.533 -0.070 1
1 87 . 5 1 1 A 9 9 GLN CA C 9 55.167 55.423 -0.256 1
1 88 . 5 1 1 A 9 9 GLN CB C 9 29.376 27.929 1.447 1
1 90 . 5 1 1 A 9 9 GLN N N 9 118.300 117.145 1.155 1
1 92 . 5 1 1 A 10 10 GLY H H 10 8.162 8.243 -0.081 1
1 93 . 5 1 1 A 10 10 GLY HA2 H 10 4.174 3.942 0.232 1
1 94 . 5 1 1 A 10 10 GLY HA3 H 10 3.521 3.947 -0.426 1
1 95 . 5 1 1 A 10 10 GLY C C 10 174.092 174.551 -0.459 1
1 96 . 5 1 1 A 10 10 GLY CA C 10 45.558 45.535 0.023 1
1 97 . 5 1 1 A 10 10 GLY N N 10 108.747 109.482 -0.735 1
1 98 . 5 1 1 A 11 11 GLN H H 11 8.507 7.962 0.545 1
1 99 . 5 1 1 A 11 11 GLN HA H 11 4.202 4.586 -0.384 1
1 106 . 5 1 1 A 11 11 GLN C C 11 173.992 174.796 -0.804 1
1 107 . 5 1 1 A 11 11 GLN CA C 11 55.098 55.319 -0.221 1
1 108 . 5 1 1 A 11 11 GLN CB C 11 29.097 30.004 -0.907 1
1 110 . 5 1 1 A 11 11 GLN N N 11 122.979 120.049 2.930 1
1 112 . 5 1 1 A 12 12 ALA H H 12 8.259 8.595 -0.336 1
1 113 . 5 1 1 A 12 12 ALA HA H 12 5.156 5.396 -0.240 1
1 117 . 5 1 1 A 12 12 ALA C C 12 177.284 176.386 0.898 1
1 118 . 5 1 1 A 12 12 ALA CA C 12 51.087 50.793 0.294 1
1 119 . 5 1 1 A 12 12 ALA CB C 12 20.500 22.138 -1.638 1
1 120 . 5 1 1 A 12 12 ALA N N 12 127.100 122.653 4.447 1
1 121 . 5 1 1 A 13 13 TRP H H 13 9.245 9.061 0.184 1
1 122 . 5 1 1 A 13 13 TRP HA H 13 4.717 5.834 -1.117 1
1 131 . 5 1 1 A 13 13 TRP C C 13 175.108 174.720 0.388 1
1 132 . 5 1 1 A 13 13 TRP CA C 13 55.966 55.054 0.912 1
1 133 . 5 1 1 A 13 13 TRP CB C 13 31.912 33.481 -1.569 1
1 139 . 5 1 1 A 13 13 TRP N N 13 123.088 119.291 3.797 1
1 141 . 5 1 1 A 14 14 ARG H H 14 8.575 8.888 -0.313 1
1 142 . 5 1 1 A 14 14 ARG HA H 14 5.335 5.095 0.240 1
1 150 . 5 1 1 A 14 14 ARG C C 14 175.191 174.854 0.337 1
1 151 . 5 1 1 A 14 14 ARG CA C 14 53.106 54.536 -1.430 1
1 152 . 5 1 1 A 14 14 ARG CB C 14 32.749 34.036 -1.287 1
1 154 . 5 1 1 A 14 14 ARG N N 14 121.163 120.365 0.798 1
1 156 . 5 1 1 A 15 15 HIS H H 15 8.595 9.278 -0.683 1
1 157 . 5 1 1 A 15 15 HIS HA H 15 4.790 5.149 -0.359 1
1 161 . 5 1 1 A 15 15 HIS C C 15 173.770 174.443 -0.673 1
1 162 . 5 1 1 A 15 15 HIS CA C 15 55.289 53.709 1.580 1
1 163 . 5 1 1 A 15 15 HIS CB C 15 33.208 33.423 -0.215 1
1 165 . 5 1 1 A 15 15 HIS N N 15 117.643 119.494 -1.851 1
1 166 . 5 1 1 A 16 16 HIS H H 16 8.993 8.848 0.145 1
1 167 . 5 1 1 A 16 16 HIS HA H 16 5.158 4.805 0.353 1
1 171 . 5 1 1 A 16 16 HIS C C 16 173.608 175.181 -1.573 1
1 172 . 5 1 1 A 16 16 HIS CA C 16 56.450 55.879 0.571 1
1 173 . 5 1 1 A 16 16 HIS CB C 16 34.171 30.875 3.296 1
1 175 . 5 1 1 A 16 16 HIS N N 16 123.520 121.200 2.320 1
1 176 . 5 1 1 A 17 17 ASN H H 17 7.829 9.164 -1.335 1
1 177 . 5 1 1 A 17 17 ASN HA H 17 4.713 5.328 -0.615 1
1 182 . 5 1 1 A 17 17 ASN C C 17 173.682 175.711 -2.029 1
1 183 . 5 1 1 A 17 17 ASN CA C 17 51.822 51.667 0.155 1
1 184 . 5 1 1 A 17 17 ASN CB C 17 43.176 41.283 1.893 1
1 185 . 5 1 1 A 17 17 ASN N N 17 122.213 120.786 1.427 1
1 187 . 5 1 1 A 18 18 GLY H H 18 8.423 8.553 -0.130 1
1 188 . 5 1 1 A 18 18 GLY HA2 H 18 3.931 3.698 0.233 1
1 189 . 5 1 1 A 18 18 GLY HA3 H 18 3.707 3.964 -0.257 1
1 190 . 5 1 1 A 18 18 GLY C C 18 173.985 173.062 0.923 1
1 191 . 5 1 1 A 18 18 GLY CA C 18 43.949 44.076 -0.127 1
1 192 . 5 1 1 A 18 18 GLY N N 18 106.991 109.687 -2.696 1
1 193 . 5 1 1 A 19 19 PHE H H 19 8.338 8.402 -0.064 1
1 194 . 5 1 1 A 19 19 PHE HA H 19 4.068 5.061 -0.993 1
1 197 . 5 1 1 A 19 19 PHE C C 19 176.568 174.881 1.687 1
1 198 . 5 1 1 A 19 19 PHE CA C 19 59.338 57.167 2.171 1
1 199 . 5 1 1 A 19 19 PHE CB C 19 40.201 39.928 0.273 1
1 200 . 5 1 1 A 19 19 PHE N N 19 116.857 119.817 -2.960 1
1 201 . 5 1 1 A 20 20 ASP H H 20 8.794 9.014 -0.220 1
1 202 . 5 1 1 A 20 20 ASP HA H 20 4.485 4.695 -0.210 1
1 205 . 5 1 1 A 20 20 ASP C C 20 177.379 177.341 0.038 1
1 206 . 5 1 1 A 20 20 ASP CA C 20 54.140 54.938 -0.798 1
1 207 . 5 1 1 A 20 20 ASP CB C 20 41.915 41.117 0.798 1
1 208 . 5 1 1 A 20 20 ASP N N 20 123.025 125.521 -2.496 1
1 209 . 5 1 1 A 21 21 PHE H H 21 8.862 9.133 -0.271 1
1 210 . 5 1 1 A 21 21 PHE HA H 21 4.087 4.132 -0.045 1
1 218 . 5 1 1 A 21 21 PHE C C 21 176.952 177.299 -0.347 1
1 219 . 5 1 1 A 21 21 PHE CA C 21 61.095 62.334 -1.239 1
1 220 . 5 1 1 A 21 21 PHE CB C 21 38.678 39.375 -0.697 1
1 226 . 5 1 1 A 21 21 PHE N N 21 127.163 125.344 1.819 1
1 227 . 5 1 1 A 22 22 ALA H H 22 8.561 8.403 0.158 1
1 228 . 5 1 1 A 22 22 ALA HA H 22 3.878 3.989 -0.111 1
1 232 . 5 1 1 A 22 22 ALA C C 22 180.710 179.970 0.740 1
1 233 . 5 1 1 A 22 22 ALA CA C 22 55.211 55.237 -0.026 1
1 234 . 5 1 1 A 22 22 ALA CB C 22 18.321 18.500 -0.179 1
1 235 . 5 1 1 A 22 22 ALA N N 22 120.293 121.175 -0.882 1
1 236 . 5 1 1 A 23 23 VAL H H 23 7.241 8.018 -0.777 1
1 237 . 5 1 1 A 23 23 VAL HA H 23 3.684 3.500 0.184 1
1 245 . 5 1 1 A 23 23 VAL C C 23 177.101 178.102 -1.001 1
1 246 . 5 1 1 A 23 23 VAL CA C 23 65.237 66.985 -1.748 1
1 247 . 5 1 1 A 23 23 VAL CB C 23 31.780 31.593 0.187 1
1 250 . 5 1 1 A 23 23 VAL N N 23 118.775 117.702 1.073 1
1 251 . 5 1 1 A 24 24 ILE H H 24 6.761 7.818 -1.057 1
1 252 . 5 1 1 A 24 24 ILE HA H 24 3.196 3.506 -0.310 1
1 262 . 5 1 1 A 24 24 ILE C C 24 177.287 178.206 -0.919 1
1 263 . 5 1 1 A 24 24 ILE CA C 24 63.404 65.688 -2.284 1
1 264 . 5 1 1 A 24 24 ILE CB C 24 36.294 37.821 -1.527 1
1 268 . 5 1 1 A 24 24 ILE N N 24 119.036 119.471 -0.435 1
1 269 . 5 1 1 A 25 25 LYS H H 25 8.032 8.147 -0.115 1
1 270 . 5 1 1 A 25 25 LYS HA H 25 3.809 3.648 0.161 1
1 279 . 5 1 1 A 25 25 LYS C C 25 179.450 178.580 0.870 1
1 280 . 5 1 1 A 25 25 LYS CA C 25 59.621 59.398 0.223 1
1 281 . 5 1 1 A 25 25 LYS CB C 25 32.259 31.996 0.263 1
1 285 . 5 1 1 A 25 25 LYS N N 25 118.368 119.726 -1.358 1
1 286 . 5 1 1 A 26 26 GLU H H 26 7.845 8.039 -0.194 1
1 287 . 5 1 1 A 26 26 GLU HA H 26 4.021 4.102 -0.081 1
1 292 . 5 1 1 A 26 26 GLU C C 26 179.191 178.896 0.295 1
1 293 . 5 1 1 A 26 26 GLU CA C 26 59.530 59.238 0.292 1
1 294 . 5 1 1 A 26 26 GLU CB C 26 29.449 29.357 0.092 1
1 296 . 5 1 1 A 26 26 GLU N N 26 120.522 119.038 1.484 1
1 297 . 5 1 1 A 27 27 LEU H H 27 8.165 8.119 0.046 1
1 298 . 5 1 1 A 27 27 LEU HA H 27 4.163 4.137 0.026 1
1 308 . 5 1 1 A 27 27 LEU C C 27 177.256 178.366 -1.110 1
1 309 . 5 1 1 A 27 27 LEU CA C 27 58.049 57.275 0.774 1
1 310 . 5 1 1 A 27 27 LEU CB C 27 41.365 41.131 0.234 1
1 314 . 5 1 1 A 27 27 LEU N N 27 120.879 120.914 -0.035 1
1 315 . 5 1 1 A 28 28 LYS H H 28 8.902 8.116 0.786 1
1 316 . 5 1 1 A 28 28 LYS HA H 28 4.199 4.299 -0.100 1
1 317 . 5 1 1 A 28 28 LYS C C 28 179.707 179.392 0.315 1
1 318 . 5 1 1 A 28 28 LYS CA C 28 60.097 58.972 1.125 1
1 319 . 5 1 1 A 28 28 LYS CB C 28 33.420 31.659 1.761 1
1 320 . 5 1 1 A 28 28 LYS N N 28 120.050 119.370 0.680 1
1 321 . 5 1 1 A 29 29 THR H H 29 8.294 8.249 0.045 1
1 322 . 5 1 1 A 29 29 THR HA H 29 3.892 3.951 -0.059 1
1 327 . 5 1 1 A 29 29 THR C C 29 175.711 176.241 -0.530 1
1 328 . 5 1 1 A 29 29 THR CA C 29 66.846 66.576 0.270 1
1 329 . 5 1 1 A 29 29 THR CB C 29 68.794 68.677 0.117 1
1 331 . 5 1 1 A 29 29 THR N N 29 115.933 116.867 -0.934 1
1 332 . 5 1 1 A 30 30 ALA H H 30 8.244 8.670 -0.426 1
1 333 . 5 1 1 A 30 30 ALA HA H 30 4.241 4.340 -0.099 1
1 337 . 5 1 1 A 30 30 ALA C C 30 179.128 179.526 -0.398 1
1 338 . 5 1 1 A 30 30 ALA CA C 30 55.714 55.801 -0.087 1
1 339 . 5 1 1 A 30 30 ALA CB C 30 18.955 18.220 0.735 1
1 340 . 5 1 1 A 30 30 ALA N N 30 124.617 123.268 1.349 1
1 341 . 5 1 1 A 31 31 ALA H H 31 8.968 8.587 0.381 1
1 342 . 5 1 1 A 31 31 ALA HA H 31 3.890 4.046 -0.156 1
1 346 . 5 1 1 A 31 31 ALA C C 31 180.352 179.261 1.091 1
1 347 . 5 1 1 A 31 31 ALA CA C 31 55.454 55.457 -0.003 1
1 348 . 5 1 1 A 31 31 ALA CB C 31 17.124 18.043 -0.919 1
1 349 . 5 1 1 A 31 31 ALA N N 31 119.327 120.351 -1.024 1
1 350 . 5 1 1 A 32 32 SER H H 32 7.995 7.763 0.232 1
1 351 . 5 1 1 A 32 32 SER HA H 32 4.238 4.240 -0.002 1
1 354 . 5 1 1 A 32 32 SER C C 32 175.612 176.022 -0.410 1
1 355 . 5 1 1 A 32 32 SER CA C 32 61.203 61.727 -0.524 1
1 356 . 5 1 1 A 32 32 SER CB C 32 63.406 63.468 -0.062 1
1 357 . 5 1 1 A 32 32 SER N N 32 111.962 113.953 -1.991 1
1 358 . 5 1 1 A 33 33 GLN H H 33 8.333 8.079 0.254 1
1 359 . 5 1 1 A 33 33 GLN HA H 33 3.992 4.210 -0.218 1
1 366 . 5 1 1 A 33 33 GLN C C 33 177.486 176.820 0.666 1
1 367 . 5 1 1 A 33 33 GLN CA C 33 58.277 57.856 0.421 1
1 368 . 5 1 1 A 33 33 GLN CB C 33 29.140 29.772 -0.632 1
1 370 . 5 1 1 A 33 33 GLN N N 33 119.527 119.356 0.171 1
1 372 . 5 1 1 A 34 34 TYR H H 34 8.587 8.439 0.148 1
1 373 . 5 1 1 A 34 34 TYR HA H 34 4.792 4.828 -0.036 1
1 380 . 5 1 1 A 34 34 TYR C C 34 176.499 176.240 0.259 1
1 381 . 5 1 1 A 34 34 TYR CA C 34 57.711 57.900 -0.189 1
1 382 . 5 1 1 A 34 34 TYR CB C 34 39.561 38.351 1.210 1
1 387 . 5 1 1 A 34 34 TYR N N 34 114.610 113.945 0.665 1
1 388 . 5 1 1 A 35 35 GLY H H 35 7.346 8.163 -0.817 1
1 389 . 5 1 1 A 35 35 GLY HA2 H 35 4.785 3.951 0.834 1
1 390 . 5 1 1 A 35 35 GLY HA3 H 35 4.007 3.987 0.020 1
1 391 . 5 1 1 A 35 35 GLY C C 35 175.796 173.994 1.802 1
1 392 . 5 1 1 A 35 35 GLY CA C 35 44.355 45.681 -1.326 1
1 393 . 5 1 1 A 35 35 GLY N N 35 108.501 108.433 0.068 1
1 394 . 5 1 1 A 36 36 ALA H H 36 9.363 8.315 1.048 1
1 395 . 5 1 1 A 36 36 ALA HA H 36 4.217 4.367 -0.150 1
1 399 . 5 1 1 A 36 36 ALA C C 36 178.039 177.889 0.150 1
1 400 . 5 1 1 A 36 36 ALA CA C 36 56.114 53.425 2.689 1
1 401 . 5 1 1 A 36 36 ALA CB C 36 19.179 18.950 0.229 1
1 402 . 5 1 1 A 36 36 ALA N N 36 125.811 123.227 2.584 1
1 403 . 5 1 1 A 37 37 THR H H 37 8.070 8.848 -0.778 1
1 404 . 5 1 1 A 37 37 THR HA H 37 4.570 4.508 0.062 1
1 409 . 5 1 1 A 37 37 THR C C 37 173.685 174.534 -0.849 1
1 410 . 5 1 1 A 37 37 THR CA C 37 59.822 63.009 -3.187 1
1 411 . 5 1 1 A 37 37 THR CB C 37 68.267 70.758 -2.491 1
1 413 . 5 1 1 A 37 37 THR N N 37 129.410 114.973 14.437 1
1 414 . 5 1 1 A 38 38 ALA H H 38 6.853 7.489 -0.636 1
1 415 . 5 1 1 A 38 38 ALA HA H 38 4.601 4.575 0.026 1
1 419 . 5 1 1 A 38 38 ALA CA C 38 50.758 50.724 0.034 1
1 420 . 5 1 1 A 38 38 ALA CB C 38 18.325 19.568 -1.243 1
1 421 . 5 1 1 A 38 38 ALA N N 38 124.674 124.198 0.476 1
1 422 . 5 1 1 A 40 40 TYR HA H 40 4.032 4.074 -0.042 1
1 429 . 5 1 1 A 40 40 TYR C C 40 176.456 177.319 -0.863 1
1 430 . 5 1 1 A 40 40 TYR CA C 40 61.010 61.779 -0.769 1
1 431 . 5 1 1 A 40 40 TYR CB C 40 39.286 38.781 0.505 1
1 436 . 5 1 1 A 41 41 THR H H 41 6.874 8.387 -1.513 1
1 437 . 5 1 1 A 41 41 THR HA H 41 3.616 3.787 -0.171 1
1 442 . 5 1 1 A 41 41 THR C C 41 176.930 176.620 0.310 1
1 443 . 5 1 1 A 41 41 THR CA C 41 65.557 65.638 -0.081 1
1 444 . 5 1 1 A 41 41 THR CB C 41 68.228 69.290 -1.062 1
1 446 . 5 1 1 A 41 41 THR N N 41 115.143 114.001 1.142 1
1 447 . 5 1 1 A 42 42 LEU H H 42 8.623 7.886 0.737 1
1 448 . 5 1 1 A 42 42 LEU HA H 42 3.708 4.026 -0.318 1
1 458 . 5 1 1 A 42 42 LEU C C 42 178.206 178.913 -0.707 1
1 459 . 5 1 1 A 42 42 LEU CA C 42 57.417 57.853 -0.436 1
1 460 . 5 1 1 A 42 42 LEU CB C 42 41.342 41.195 0.147 1
1 464 . 5 1 1 A 42 42 LEU N N 42 120.418 118.586 1.832 1
1 465 . 5 1 1 A 43 43 ALA H H 43 7.735 7.667 0.068 1
1 466 . 5 1 1 A 43 43 ALA HA H 43 4.020 4.008 0.012 1
1 470 . 5 1 1 A 43 43 ALA C C 43 180.826 180.572 0.254 1
1 471 . 5 1 1 A 43 43 ALA CA C 43 54.925 55.005 -0.080 1
1 472 . 5 1 1 A 43 43 ALA CB C 43 17.506 18.417 -0.911 1
1 473 . 5 1 1 A 43 43 ALA N N 43 120.203 121.756 -1.553 1
1 474 . 5 1 1 A 44 44 ILE H H 44 7.149 7.380 -0.231 1
1 475 . 5 1 1 A 44 44 ILE HA H 44 3.603 3.854 -0.251 1
1 485 . 5 1 1 A 44 44 ILE C C 44 178.594 178.120 0.474 1
1 486 . 5 1 1 A 44 44 ILE CA C 44 64.782 64.351 0.431 1
1 487 . 5 1 1 A 44 44 ILE CB C 44 37.472 37.765 -0.293 1
1 491 . 5 1 1 A 44 44 ILE N N 44 118.881 119.408 -0.527 1
1 492 . 5 1 1 A 45 45 VAL H H 45 7.968 7.990 -0.022 1
1 493 . 5 1 1 A 45 45 VAL HA H 45 2.925 3.409 -0.484 1
1 501 . 5 1 1 A 45 45 VAL C C 45 177.023 177.877 -0.854 1
1 502 . 5 1 1 A 45 45 VAL CA C 45 67.081 67.087 -0.006 1
1 503 . 5 1 1 A 45 45 VAL CB C 45 30.854 31.373 -0.519 1
1 506 . 5 1 1 A 45 45 VAL N N 45 120.764 119.894 0.870 1
1 507 . 5 1 1 A 46 46 GLU H H 46 8.399 8.367 0.032 1
1 508 . 5 1 1 A 46 46 GLU HA H 46 3.848 3.932 -0.084 1
1 513 . 5 1 1 A 46 46 GLU C C 46 178.656 178.240 0.416 1
1 514 . 5 1 1 A 46 46 GLU CA C 46 59.491 59.056 0.435 1
1 515 . 5 1 1 A 46 46 GLU CB C 46 28.991 28.993 -0.002 1
1 517 . 5 1 1 A 46 46 GLU N N 46 116.599 119.892 -3.293 1
1 518 . 5 1 1 A 47 47 SER H H 47 7.273 7.969 -0.696 1
1 519 . 5 1 1 A 47 47 SER HA H 47 4.287 4.222 0.065 1
1 521 . 5 1 1 A 47 47 SER CA C 47 61.047 61.291 -0.244 1
1 522 . 5 1 1 A 47 47 SER CB C 47 63.016 62.480 0.536 1
1 523 . 5 1 1 A 47 47 SER N N 47 113.609 115.467 -1.858 1
1 524 . 5 1 1 A 48 48 VAL H H 48 8.006 8.056 -0.050 1
1 525 . 5 1 1 A 48 48 VAL HA H 48 3.556 3.629 -0.073 1
1 533 . 5 1 1 A 48 48 VAL C C 48 177.257 176.581 0.676 1
1 534 . 5 1 1 A 48 48 VAL CA C 48 65.025 65.898 -0.873 1
1 535 . 5 1 1 A 48 48 VAL CB C 48 31.841 31.232 0.609 1
1 538 . 5 1 1 A 48 48 VAL N N 48 122.327 122.221 0.106 1
1 539 . 5 1 1 A 49 49 ALA H H 49 8.369 7.467 0.902 1
1 540 . 5 1 1 A 49 49 ALA HA H 49 4.115 4.469 -0.354 1
1 544 . 5 1 1 A 49 49 ALA C C 49 177.307 177.451 -0.144 1
1 545 . 5 1 1 A 49 49 ALA CA C 49 53.253 51.623 1.630 1
1 546 . 5 1 1 A 49 49 ALA CB C 49 20.131 18.977 1.154 1
1 547 . 5 1 1 A 49 49 ALA N N 49 118.050 120.790 -2.740 1
1 548 . 5 1 1 A 50 50 ASP H H 50 7.052 7.947 -0.895 1
1 549 . 5 1 1 A 50 50 ASP HA H 50 4.788 4.577 0.211 1
1 552 . 5 1 1 A 50 50 ASP C C 50 175.481 175.995 -0.514 1
1 553 . 5 1 1 A 50 50 ASP CA C 50 53.681 55.395 -1.714 1
1 554 . 5 1 1 A 50 50 ASP CB C 50 39.333 41.135 -1.802 1
1 555 . 5 1 1 A 50 50 ASP N N 50 116.997 118.012 -1.015 1
1 556 . 5 1 1 A 51 51 ASN H H 51 8.535 7.727 0.808 1
1 557 . 5 1 1 A 51 51 ASN HA H 51 4.628 5.366 -0.738 1
1 562 . 5 1 1 A 51 51 ASN C C 51 174.077 175.299 -1.222 1
1 563 . 5 1 1 A 51 51 ASN CA C 51 52.315 51.370 0.945 1
1 564 . 5 1 1 A 51 51 ASN CB C 51 41.928 40.034 1.894 1
1 565 . 5 1 1 A 51 51 ASN N N 51 118.626 115.045 3.581 1
1 567 . 5 1 1 A 52 52 TRP H H 52 8.555 8.758 -0.203 1
1 574 . 5 1 1 A 52 52 TRP C C 52 173.269 176.428 -3.159 1
1 575 . 5 1 1 A 52 52 TRP CA C 52 55.031 56.945 -1.914 1
1 576 . 5 1 1 A 52 52 TRP CB C 52 26.801 30.618 -3.817 1
1 582 . 5 1 1 A 52 52 TRP N N 52 120.693 119.931 0.762 1
1 584 . 5 1 1 A 53 53 LEU H H 53 7.847 8.811 -0.964 1
1 585 . 5 1 1 A 53 53 LEU HA H 53 4.859 4.867 -0.008 1
1 595 . 5 1 1 A 53 53 LEU C C 53 177.397 175.239 2.158 1
1 596 . 5 1 1 A 53 53 LEU CA C 53 53.619 53.483 0.136 1
1 597 . 5 1 1 A 53 53 LEU CB C 53 41.812 45.398 -3.586 1
1 601 . 5 1 1 A 53 53 LEU N N 53 124.741 120.489 4.252 1
1 602 . 5 1 1 A 54 54 THR H H 54 8.850 8.400 0.450 1
1 603 . 5 1 1 A 54 54 THR HA H 54 4.598 4.637 -0.039 1
1 608 . 5 1 1 A 54 54 THR CA C 54 60.531 58.845 1.686 1
1 609 . 5 1 1 A 54 54 THR CB C 54 67.183 69.612 -2.429 1
1 611 . 5 1 1 A 54 54 THR N N 54 113.407 110.698 2.709 1
1 612 . 5 1 1 A 55 55 PRO HA H 55 4.511 4.509 0.002 1
1 619 . 5 1 1 A 55 55 PRO C C 55 179.383 178.674 0.709 1
1 620 . 5 1 1 A 55 55 PRO CA C 55 67.159 64.728 2.431 1
1 621 . 5 1 1 A 55 55 PRO CB C 55 32.095 31.783 0.312 1
1 622 . 5 1 1 A 56 56 THR H H 56 8.575 7.653 0.922 1
1 623 . 5 1 1 A 56 56 THR HA H 56 4.229 4.081 0.148 1
1 628 . 5 1 1 A 56 56 THR C C 56 176.668 176.185 0.483 1
1 629 . 5 1 1 A 56 56 THR CA C 56 66.943 65.799 1.144 1
1 630 . 5 1 1 A 56 56 THR CB C 56 68.129 68.078 0.051 1
1 632 . 5 1 1 A 56 56 THR N N 56 114.855 112.048 2.807 1
1 633 . 5 1 1 A 57 57 ASP H H 57 8.730 8.430 0.300 1
1 634 . 5 1 1 A 57 57 ASP HA H 57 4.425 4.765 -0.340 1
1 637 . 5 1 1 A 57 57 ASP C C 57 178.351 179.177 -0.826 1
1 638 . 5 1 1 A 57 57 ASP CA C 57 57.963 57.733 0.230 1
1 639 . 5 1 1 A 57 57 ASP CB C 57 40.134 40.670 -0.536 1
1 640 . 5 1 1 A 57 57 ASP N N 57 126.239 120.455 5.784 1
1 641 . 5 1 1 A 58 58 TRP H H 58 8.244 8.291 -0.047 1
1 642 . 5 1 1 A 58 58 TRP HA H 58 4.030 4.596 -0.566 1
1 650 . 5 1 1 A 58 58 TRP C C 58 177.432 178.811 -1.379 1
1 651 . 5 1 1 A 58 58 TRP CA C 58 62.731 60.215 2.516 1
1 652 . 5 1 1 A 58 58 TRP CB C 58 29.122 29.235 -0.113 1
1 657 . 5 1 1 A 58 58 TRP N N 58 119.241 120.495 -1.254 1
1 659 . 5 1 1 A 59 59 ASN H H 59 8.098 8.495 -0.397 1
1 660 . 5 1 1 A 59 59 ASN HA H 59 4.424 4.466 -0.042 1
1 663 . 5 1 1 A 59 59 ASN C C 59 176.952 178.361 -1.409 1
1 664 . 5 1 1 A 59 59 ASN CA C 59 58.135 56.543 1.592 1
1 665 . 5 1 1 A 59 59 ASN CB C 59 40.168 39.531 0.637 1
1 666 . 5 1 1 A 59 59 ASN N N 59 115.747 118.500 -2.753 1
1 667 . 5 1 1 A 60 60 THR H H 60 8.712 7.859 0.853 1
1 668 . 5 1 1 A 60 60 THR HA H 60 3.717 3.930 -0.213 1
1 673 . 5 1 1 A 60 60 THR C C 60 176.044 176.565 -0.521 1
1 674 . 5 1 1 A 60 60 THR CA C 60 66.576 66.186 0.390 1
1 675 . 5 1 1 A 60 60 THR CB C 60 69.251 67.685 1.566 1
1 677 . 5 1 1 A 60 60 THR N N 60 114.896 115.314 -0.418 1
1 678 . 5 1 1 A 61 61 LEU H H 61 8.485 8.415 0.070 1
1 679 . 5 1 1 A 61 61 LEU HA H 61 3.391 4.065 -0.674 1
1 689 . 5 1 1 A 61 61 LEU C C 61 177.433 178.718 -1.285 1
1 690 . 5 1 1 A 61 61 LEU CA C 61 58.354 58.657 -0.303 1
1 691 . 5 1 1 A 61 61 LEU CB C 61 41.761 42.422 -0.661 1
1 695 . 5 1 1 A 61 61 LEU N N 61 123.433 122.680 0.753 1
1 696 . 5 1 1 A 62 62 VAL H H 62 8.073 8.226 -0.153 1
1 697 . 5 1 1 A 62 62 VAL HA H 62 3.207 3.778 -0.571 1
1 705 . 5 1 1 A 62 62 VAL C C 62 177.585 177.647 -0.062 1
1 706 . 5 1 1 A 62 62 VAL CA C 62 67.345 64.918 2.427 1
1 707 . 5 1 1 A 62 62 VAL CB C 62 30.905 30.568 0.337 1
1 710 . 5 1 1 A 62 62 VAL N N 62 116.018 118.409 -2.391 1
1 711 . 5 1 1 A 63 63 ARG H H 63 7.765 7.863 -0.098 1
1 712 . 5 1 1 A 63 63 ARG HA H 63 3.602 3.892 -0.290 1
1 719 . 5 1 1 A 63 63 ARG C C 63 177.818 178.431 -0.613 1
1 720 . 5 1 1 A 63 63 ARG CA C 63 58.049 59.824 -1.775 1
1 721 . 5 1 1 A 63 63 ARG CB C 63 29.955 29.932 0.023 1
1 724 . 5 1 1 A 63 63 ARG N N 63 116.700 121.180 -4.480 1
1 725 . 5 1 1 A 64 64 ALA H H 64 7.574 7.598 -0.024 1
1 726 . 5 1 1 A 64 64 ALA HA H 64 4.158 4.352 -0.194 1
1 730 . 5 1 1 A 64 64 ALA C C 64 179.886 179.299 0.587 1
1 731 . 5 1 1 A 64 64 ALA CA C 64 54.007 54.159 -0.152 1
1 732 . 5 1 1 A 64 64 ALA CB C 64 19.147 19.649 -0.502 1
1 733 . 5 1 1 A 64 64 ALA N N 64 117.555 121.054 -3.499 1
1 734 . 5 1 1 A 65 65 VAL H H 65 7.554 8.241 -0.687 1
1 735 . 5 1 1 A 65 65 VAL HA H 65 4.253 3.862 0.391 1
1 743 . 5 1 1 A 65 65 VAL C C 65 174.180 176.336 -2.156 1
1 744 . 5 1 1 A 65 65 VAL CA C 65 62.683 65.602 -2.919 1
1 745 . 5 1 1 A 65 65 VAL CB C 65 33.458 31.365 2.093 1
1 748 . 5 1 1 A 65 65 VAL N N 65 110.013 115.908 -5.895 1
1 749 . 5 1 1 A 66 66 LEU H H 66 7.792 7.491 0.301 1
1 750 . 5 1 1 A 66 66 LEU HA H 66 4.790 4.660 0.130 1
1 760 . 5 1 1 A 66 66 LEU C C 66 177.537 175.399 2.138 1
1 761 . 5 1 1 A 66 66 LEU CA C 66 52.823 53.209 -0.386 1
1 762 . 5 1 1 A 66 66 LEU CB C 66 44.071 43.290 0.781 1
1 766 . 5 1 1 A 66 66 LEU N N 66 118.967 120.919 -1.952 1
1 767 . 5 1 1 A 67 67 SER H H 67 9.208 8.387 0.821 1
1 768 . 5 1 1 A 67 67 SER HA H 67 4.414 4.891 -0.477 1
1 771 . 5 1 1 A 67 67 SER CA C 67 57.943 57.288 0.655 1
1 772 . 5 1 1 A 67 67 SER CB C 67 64.743 67.258 -2.515 1
1 773 . 5 1 1 A 67 67 SER N N 67 116.378 115.240 1.138 1
1 774 . 5 1 1 A 69 69 GLY HA2 H 69 3.916 3.767 0.149 1
1 775 . 5 1 1 A 69 69 GLY HA3 H 69 3.867 3.790 0.077 1
1 776 . 5 1 1 A 69 69 GLY C C 69 176.783 175.575 1.208 1
1 777 . 5 1 1 A 69 69 GLY CA C 69 46.977 46.689 0.288 1
1 778 . 5 1 1 A 70 70 ASP H H 70 7.674 8.183 -0.509 1
1 779 . 5 1 1 A 70 70 ASP HA H 70 4.511 3.693 0.818 1
1 782 . 5 1 1 A 70 70 ASP C C 70 178.096 178.275 -0.179 1
1 783 . 5 1 1 A 70 70 ASP CA C 70 57.262 56.566 0.696 1
1 784 . 5 1 1 A 70 70 ASP CB C 70 40.594 39.754 0.840 1
1 785 . 5 1 1 A 70 70 ASP N N 70 123.930 121.874 2.056 1
1 786 . 5 1 1 A 71 71 HIS H H 71 8.729 8.131 0.598 1
1 787 . 5 1 1 A 71 71 HIS HA H 71 4.235 4.178 0.057 1
1 790 . 5 1 1 A 71 71 HIS C C 71 176.769 177.918 -1.149 1
1 791 . 5 1 1 A 71 71 HIS CA C 71 60.041 59.009 1.032 1
1 792 . 5 1 1 A 71 71 HIS CB C 71 30.682 30.100 0.582 1
1 793 . 5 1 1 A 71 71 HIS N N 71 121.003 117.037 3.966 1
1 794 . 5 1 1 A 72 72 LEU H H 72 7.620 7.913 -0.293 1
1 795 . 5 1 1 A 72 72 LEU HA H 72 3.769 3.960 -0.191 1
1 805 . 5 1 1 A 72 72 LEU C C 72 180.275 179.144 1.131 1
1 806 . 5 1 1 A 72 72 LEU CA C 72 58.192 57.981 0.211 1
1 807 . 5 1 1 A 72 72 LEU CB C 72 41.381 41.253 0.128 1
1 811 . 5 1 1 A 72 72 LEU N N 72 118.569 116.880 1.689 1
1 812 . 5 1 1 A 73 73 LEU H H 73 7.542 7.626 -0.084 1
1 813 . 5 1 1 A 73 73 LEU HA H 73 4.107 4.243 -0.136 1
1 823 . 5 1 1 A 73 73 LEU C C 73 179.436 179.217 0.219 1
1 824 . 5 1 1 A 73 73 LEU CA C 73 58.026 57.247 0.779 1
1 825 . 5 1 1 A 73 73 LEU CB C 73 41.638 42.110 -0.472 1
1 829 . 5 1 1 A 73 73 LEU N N 73 121.418 120.369 1.049 1
1 830 . 5 1 1 A 74 74 TRP H H 74 8.786 8.015 0.771 1
1 831 . 5 1 1 A 74 74 TRP HA H 74 3.589 5.247 -1.658 1
1 840 . 5 1 1 A 74 74 TRP C C 74 176.816 178.714 -1.898 1
1 841 . 5 1 1 A 74 74 TRP CA C 74 63.046 59.978 3.068 1
1 842 . 5 1 1 A 74 74 TRP CB C 74 28.065 28.927 -0.862 1
1 848 . 5 1 1 A 74 74 TRP N N 74 121.111 118.186 2.925 1
1 850 . 5 1 1 A 75 75 LYS H H 75 8.939 7.687 1.252 1
1 851 . 5 1 1 A 75 75 LYS HA H 75 3.055 4.141 -1.086 1
1 860 . 5 1 1 A 75 75 LYS C C 75 177.967 179.185 -1.218 1
1 861 . 5 1 1 A 75 75 LYS CA C 75 60.029 58.781 1.248 1
1 862 . 5 1 1 A 75 75 LYS CB C 75 32.533 32.817 -0.284 1
1 866 . 5 1 1 A 75 75 LYS N N 75 119.783 118.619 1.164 1
1 867 . 5 1 1 A 76 76 SER H H 76 7.832 7.852 -0.020 1
1 868 . 5 1 1 A 76 76 SER HA H 76 4.040 4.325 -0.285 1
1 871 . 5 1 1 A 76 76 SER C C 76 177.816 177.336 0.480 1
1 872 . 5 1 1 A 76 76 SER CA C 76 62.105 61.762 0.343 1
1 873 . 5 1 1 A 76 76 SER CB C 76 62.679 62.968 -0.289 1
1 874 . 5 1 1 A 76 76 SER N N 76 113.395 115.301 -1.906 1
1 875 . 5 1 1 A 77 77 GLU H H 77 7.590 7.981 -0.391 1
1 876 . 5 1 1 A 77 77 GLU HA H 77 4.042 4.269 -0.227 1
1 881 . 5 1 1 A 77 77 GLU C C 77 177.809 178.500 -0.691 1
1 882 . 5 1 1 A 77 77 GLU CA C 77 58.270 58.249 0.021 1
1 883 . 5 1 1 A 77 77 GLU CB C 77 29.208 29.477 -0.269 1
1 885 . 5 1 1 A 77 77 GLU N N 77 121.574 121.587 -0.013 1
1 886 . 5 1 1 A 78 78 PHE H H 78 9.081 7.887 1.194 1
1 887 . 5 1 1 A 78 78 PHE HA H 78 3.778 4.187 -0.409 1
1 895 . 5 1 1 A 78 78 PHE C C 78 178.114 177.269 0.845 1
1 896 . 5 1 1 A 78 78 PHE CA C 78 60.629 61.337 -0.708 1
1 897 . 5 1 1 A 78 78 PHE CB C 78 38.295 38.861 -0.566 1
1 902 . 5 1 1 A 78 78 PHE N N 78 122.682 122.864 -0.182 1
1 903 . 5 1 1 A 79 79 PHE H H 79 8.890 8.084 0.806 1
1 904 . 5 1 1 A 79 79 PHE HA H 79 3.800 4.035 -0.235 1
1 912 . 5 1 1 A 79 79 PHE C C 79 178.354 178.166 0.188 1
1 913 . 5 1 1 A 79 79 PHE CA C 79 60.704 61.668 -0.964 1
1 914 . 5 1 1 A 79 79 PHE CB C 79 37.184 38.708 -1.524 1
1 920 . 5 1 1 A 79 79 PHE N N 79 121.056 117.809 3.247 1
1 921 . 5 1 1 A 80 80 GLU H H 80 7.793 8.268 -0.475 1
1 922 . 5 1 1 A 80 80 GLU HA H 80 4.082 4.135 -0.053 1
1 927 . 5 1 1 A 80 80 GLU C C 80 179.068 179.385 -0.317 1
1 928 . 5 1 1 A 80 80 GLU CA C 80 59.735 59.772 -0.037 1
1 929 . 5 1 1 A 80 80 GLU CB C 80 28.722 29.628 -0.906 1
1 931 . 5 1 1 A 80 80 GLU N N 80 120.312 119.966 0.346 1
1 932 . 5 1 1 A 81 81 ASN H H 81 8.624 8.562 0.062 1
1 933 . 5 1 1 A 81 81 ASN HA H 81 4.521 4.497 0.024 1
1 938 . 5 1 1 A 81 81 ASN C C 81 179.262 177.807 1.455 1
1 939 . 5 1 1 A 81 81 ASN CA C 81 55.504 56.460 -0.956 1
1 940 . 5 1 1 A 81 81 ASN CB C 81 37.517 37.796 -0.279 1
1 941 . 5 1 1 A 81 81 ASN N N 81 119.338 118.769 0.569 1
1 943 . 5 1 1 A 82 82 CYS H H 82 8.554 8.047 0.507 1
1 944 . 5 1 1 A 82 82 CYS HA H 82 3.792 4.047 -0.255 1
1 947 . 5 1 1 A 82 82 CYS C C 82 176.478 176.781 -0.303 1
1 948 . 5 1 1 A 82 82 CYS CA C 82 65.232 62.300 2.932 1
1 949 . 5 1 1 A 82 82 CYS CB C 82 26.762 26.828 -0.066 1
1 950 . 5 1 1 A 82 82 CYS N N 82 120.576 118.602 1.974 1
1 951 . 5 1 1 A 83 83 ARG H H 83 8.522 7.916 0.606 1
1 952 . 5 1 1 A 83 83 ARG HA H 83 3.932 4.152 -0.220 1
1 960 . 5 1 1 A 83 83 ARG C C 83 179.138 178.734 0.404 1
1 961 . 5 1 1 A 83 83 ARG CA C 83 60.443 58.900 1.543 1
1 962 . 5 1 1 A 83 83 ARG CB C 83 29.550 29.953 -0.403 1
1 965 . 5 1 1 A 83 83 ARG N N 83 123.035 120.297 2.738 1
1 967 . 5 1 1 A 84 84 ASP H H 84 7.791 8.157 -0.366 1
1 968 . 5 1 1 A 84 84 ASP HA H 84 4.353 4.412 -0.059 1
1 971 . 5 1 1 A 84 84 ASP C C 84 178.649 178.343 0.306 1
1 972 . 5 1 1 A 84 84 ASP CA C 84 57.767 57.631 0.136 1
1 973 . 5 1 1 A 84 84 ASP CB C 84 41.305 41.656 -0.351 1
1 974 . 5 1 1 A 84 84 ASP N N 84 120.332 119.675 0.657 1
1 975 . 5 1 1 A 85 85 THR H H 85 8.370 7.824 0.546 1
1 976 . 5 1 1 A 85 85 THR HA H 85 3.730 3.994 -0.264 1
1 981 . 5 1 1 A 85 85 THR C C 85 175.198 176.751 -1.553 1
1 982 . 5 1 1 A 85 85 THR CA C 85 66.830 65.201 1.629 1
1 983 . 5 1 1 A 85 85 THR CB C 85 68.533 68.872 -0.339 1
1 985 . 5 1 1 A 85 85 THR N N 85 117.360 113.494 3.866 1
1 986 . 5 1 1 A 86 86 ALA H H 86 8.845 8.241 0.604 1
1 987 . 5 1 1 A 86 86 ALA HA H 86 3.991 4.097 -0.106 1
1 991 . 5 1 1 A 86 86 ALA C C 86 179.980 179.678 0.302 1
1 992 . 5 1 1 A 86 86 ALA CA C 86 55.769 55.751 0.018 1
1 993 . 5 1 1 A 86 86 ALA CB C 86 17.881 18.334 -0.453 1
1 994 . 5 1 1 A 86 86 ALA N N 86 123.613 123.236 0.377 1
1 995 . 5 1 1 A 87 87 LYS H H 87 7.686 7.873 -0.187 1
1 996 . 5 1 1 A 87 87 LYS HA H 87 4.099 4.033 0.066 1
1 1005 . 5 1 1 A 87 87 LYS C C 87 179.592 178.535 1.057 1
1 1006 . 5 1 1 A 87 87 LYS CA C 87 59.708 59.254 0.454 1
1 1007 . 5 1 1 A 87 87 LYS CB C 87 32.054 31.888 0.166 1
1 1011 . 5 1 1 A 87 87 LYS N N 87 119.623 116.744 2.879 1
1 1012 . 5 1 1 A 88 88 ARG H H 88 7.683 7.594 0.089 1
1 1013 . 5 1 1 A 88 88 ARG HA H 88 4.051 4.122 -0.071 1
1 1020 . 5 1 1 A 88 88 ARG C C 88 180.053 178.891 1.162 1
1 1021 . 5 1 1 A 88 88 ARG CA C 88 59.558 59.091 0.467 1
1 1022 . 5 1 1 A 88 88 ARG CB C 88 29.684 30.036 -0.352 1
1 1025 . 5 1 1 A 88 88 ARG N N 88 120.788 119.401 1.387 1
1 1026 . 5 1 1 A 89 89 ASN H H 89 8.973 8.396 0.577 1
1 1027 . 5 1 1 A 89 89 ASN HA H 89 4.354 4.511 -0.157 1
1 1032 . 5 1 1 A 89 89 ASN C C 89 178.382 178.020 0.362 1
1 1033 . 5 1 1 A 89 89 ASN CA C 89 55.334 55.895 -0.561 1
1 1034 . 5 1 1 A 89 89 ASN CB C 89 37.864 38.398 -0.534 1
1 1035 . 5 1 1 A 89 89 ASN N N 89 121.012 117.799 3.213 1
1 1037 . 5 1 1 A 90 90 GLN H H 90 8.152 8.006 0.146 1
1 1038 . 5 1 1 A 90 90 GLN HA H 90 4.020 4.038 -0.018 1
1 1045 . 5 1 1 A 90 90 GLN C C 90 179.075 178.434 0.641 1
1 1046 . 5 1 1 A 90 90 GLN CA C 90 59.318 58.892 0.426 1
1 1047 . 5 1 1 A 90 90 GLN CB C 90 28.049 28.062 -0.013 1
1 1049 . 5 1 1 A 90 90 GLN N N 90 122.122 118.225 3.897 1
1 1051 . 5 1 1 A 91 91 GLN H H 91 7.514 8.060 -0.546 1
1 1052 . 5 1 1 A 91 91 GLN HA H 91 4.053 4.035 0.018 1
1 1059 . 5 1 1 A 91 91 GLN C C 91 177.081 177.913 -0.832 1
1 1060 . 5 1 1 A 91 91 GLN CA C 91 58.031 58.528 -0.497 1
1 1061 . 5 1 1 A 91 91 GLN CB C 91 28.365 27.736 0.629 1
1 1063 . 5 1 1 A 91 91 GLN N N 91 118.124 118.188 -0.064 1
1 1065 . 5 1 1 A 92 92 ALA H H 92 7.704 7.230 0.474 1
1 1066 . 5 1 1 A 92 92 ALA HA H 92 4.246 4.226 0.020 1
1 1070 . 5 1 1 A 92 92 ALA C C 92 178.450 177.940 0.510 1
1 1071 . 5 1 1 A 92 92 ALA CA C 92 52.671 52.780 -0.109 1
1 1072 . 5 1 1 A 92 92 ALA CB C 92 19.316 19.732 -0.416 1
1 1073 . 5 1 1 A 92 92 ALA N N 92 119.880 119.824 0.056 1
1 1074 . 5 1 1 A 93 93 GLY H H 93 7.693 7.851 -0.158 1
1 1075 . 5 1 1 A 93 93 GLY HA2 H 93 3.941 3.929 0.012 1
1 1076 . 5 1 1 A 93 93 GLY HA3 H 93 3.744 3.931 -0.187 1
1 1077 . 5 1 1 A 93 93 GLY C C 93 174.344 175.203 -0.859 1
1 1078 . 5 1 1 A 93 93 GLY CA C 93 45.949 45.463 0.486 1
1 1079 . 5 1 1 A 93 93 GLY N N 93 105.347 106.294 -0.947 1
1 1080 . 5 1 1 A 94 94 ASN H H 94 7.076 8.172 -1.096 1
1 1081 . 5 1 1 A 94 94 ASN HA H 94 4.115 4.434 -0.319 1
1 1085 . 5 1 1 A 94 94 ASN C C 94 175.410 175.348 0.062 1
1 1086 . 5 1 1 A 94 94 ASN CA C 94 52.651 53.018 -0.367 1
1 1087 . 5 1 1 A 94 94 ASN CB C 94 38.330 38.656 -0.326 1
1 1088 . 5 1 1 A 94 94 ASN N N 94 115.747 118.724 -2.977 1
1 1090 . 5 1 1 A 95 95 GLY H H 95 8.236 7.860 0.376 1
1 1091 . 5 1 1 A 95 95 GLY HA2 H 95 3.633 3.745 -0.112 1
1 1092 . 5 1 1 A 95 95 GLY HA3 H 95 3.633 3.856 -0.223 1
1 1093 . 5 1 1 A 95 95 GLY C C 95 174.450 174.384 0.066 1
1 1094 . 5 1 1 A 95 95 GLY CA C 95 45.522 45.458 0.064 1
1 1095 . 5 1 1 A 95 95 GLY N N 95 109.166 106.614 2.552 1
1 1096 . 5 1 1 A 96 96 TRP H H 96 7.899 7.428 0.471 1
1 1097 . 5 1 1 A 96 96 TRP HA H 96 5.241 4.926 0.315 1
1 1106 . 5 1 1 A 96 96 TRP C C 96 175.661 176.356 -0.695 1
1 1107 . 5 1 1 A 96 96 TRP CA C 96 55.090 57.466 -2.376 1
1 1108 . 5 1 1 A 96 96 TRP CB C 96 27.138 31.289 -4.151 1
1 1114 . 5 1 1 A 96 96 TRP N N 96 122.840 120.838 2.002 1
1 1116 . 5 1 1 A 97 97 ASP H H 97 7.344 9.021 -1.677 1
1 1117 . 5 1 1 A 97 97 ASP HA H 97 4.829 4.325 0.504 1
1 1120 . 5 1 1 A 97 97 ASP C C 97 175.019 175.988 -0.969 1
1 1121 . 5 1 1 A 97 97 ASP CA C 97 52.149 56.303 -4.154 1
1 1122 . 5 1 1 A 97 97 ASP CB C 97 42.697 38.624 4.073 1
1 1123 . 5 1 1 A 97 97 ASP N N 97 126.861 117.078 9.783 1
1 1124 . 5 1 1 A 98 98 PHE H H 98 8.566 8.419 0.147 1
1 1125 . 5 1 1 A 98 98 PHE HA H 98 3.727 4.208 -0.481 1
1 1133 . 5 1 1 A 98 98 PHE C C 98 177.443 177.391 0.052 1
1 1134 . 5 1 1 A 98 98 PHE CA C 98 62.471 61.094 1.377 1
1 1135 . 5 1 1 A 98 98 PHE CB C 98 39.919 39.876 0.043 1
1 1141 . 5 1 1 A 98 98 PHE N N 98 117.781 120.897 -3.116 1
1 1142 . 5 1 1 A 99 99 ASP H H 99 8.259 8.395 -0.136 1
1 1143 . 5 1 1 A 99 99 ASP HA H 99 3.960 4.182 -0.222 1
1 1146 . 5 1 1 A 99 99 ASP C C 99 178.132 178.735 -0.603 1
1 1147 . 5 1 1 A 99 99 ASP CA C 99 57.658 56.624 1.034 1
1 1148 . 5 1 1 A 99 99 ASP CB C 99 38.572 40.720 -2.148 1
1 1149 . 5 1 1 A 99 99 ASP N N 99 121.709 118.733 2.976 1
1 1150 . 5 1 1 A 100 100 MET H H 100 8.008 7.982 0.026 1
1 1151 . 5 1 1 A 100 100 MET HA H 100 3.644 4.282 -0.638 1
1 1156 . 5 1 1 A 100 100 MET C C 100 180.008 176.522 3.486 1
1 1157 . 5 1 1 A 100 100 MET CA C 100 58.598 58.304 0.294 1
1 1158 . 5 1 1 A 100 100 MET CB C 100 33.423 32.793 0.630 1
1 1160 . 5 1 1 A 100 100 MET N N 100 119.668 117.455 2.213 1
1 1161 . 5 1 1 A 101 101 LEU H H 101 7.961 8.005 -0.044 1
1 1162 . 5 1 1 A 101 101 LEU HA H 101 3.523 4.622 -1.099 1
1 1172 . 5 1 1 A 101 101 LEU C C 101 173.873 176.300 -2.427 1
1 1173 . 5 1 1 A 101 101 LEU CA C 101 58.743 53.635 5.108 1
1 1174 . 5 1 1 A 101 101 LEU CB C 101 42.632 43.567 -0.935 1
1 1178 . 5 1 1 A 101 101 LEU N N 101 119.752 119.390 0.362 1
1 1179 . 5 1 1 A 102 102 THR H H 102 6.955 9.180 -2.225 1
1 1180 . 5 1 1 A 102 102 THR HA H 102 4.134 4.357 -0.223 1
1 1185 . 5 1 1 A 102 102 THR C C 102 176.513 174.332 2.181 1
1 1186 . 5 1 1 A 102 102 THR CA C 102 61.125 62.425 -1.300 1
1 1187 . 5 1 1 A 102 102 THR CB C 102 71.415 68.854 2.561 1
1 1189 . 5 1 1 A 102 102 THR N N 102 124.665 122.436 2.229 1
1 1190 . 5 1 1 A 103 103 GLY H H 103 7.816 8.672 -0.856 1
1 1191 . 5 1 1 A 103 103 GLY HA2 H 103 3.824 3.723 0.101 1
1 1192 . 5 1 1 A 103 103 GLY HA3 H 103 3.824 3.834 -0.010 1
1 1193 . 5 1 1 A 103 103 GLY C C 103 174.126 174.517 -0.391 1
1 1194 . 5 1 1 A 103 103 GLY CA C 103 47.805 47.078 0.727 1
1 1195 . 5 1 1 A 103 103 GLY N N 103 114.191 112.383 1.808 1
1 1196 . 5 1 1 A 104 104 SER H H 104 8.860 7.935 0.925 1
1 1197 . 5 1 1 A 104 104 SER HA H 104 4.758 4.105 0.653 1
1 1200 . 5 1 1 A 104 104 SER C C 104 174.591 174.683 -0.092 1
1 1201 . 5 1 1 A 104 104 SER CA C 104 56.755 59.035 -2.280 1
1 1202 . 5 1 1 A 104 104 SER CB C 104 65.050 61.207 3.843 1
1 1203 . 5 1 1 A 104 104 SER N N 104 114.771 113.445 1.326 1
1 1204 . 5 1 1 A 105 105 GLY H H 105 8.788 8.988 -0.200 1
1 1205 . 5 1 1 A 105 105 GLY HA2 H 105 3.733 4.227 -0.494 1
1 1206 . 5 1 1 A 105 105 GLY HA3 H 105 3.733 4.228 -0.495 1
1 1207 . 5 1 1 A 105 105 GLY CA C 105 47.247 45.364 1.883 1
1 1208 . 5 1 1 A 105 105 GLY N N 105 110.394 107.924 2.470 1
1 1209 . 5 1 1 A 106 106 ASN HA H 106 4.454 4.904 -0.450 1
1 1212 . 5 1 1 A 106 106 ASN C C 106 175.180 176.485 -1.305 1
1 1213 . 5 1 1 A 106 106 ASN CA C 106 54.492 54.456 0.036 1
1 1214 . 5 1 1 A 106 106 ASN CB C 106 37.282 41.197 -3.915 1
1 1215 . 5 1 1 A 107 107 TYR H H 107 8.241 8.395 -0.154 1
1 1216 . 5 1 1 A 107 107 TYR HA H 107 4.335 4.831 -0.496 1
1 1223 . 5 1 1 A 107 107 TYR C C 107 173.954 176.253 -2.299 1
1 1224 . 5 1 1 A 107 107 TYR CA C 107 57.727 57.142 0.585 1
1 1225 . 5 1 1 A 107 107 TYR CB C 107 37.063 39.498 -2.435 1
1 1230 . 5 1 1 A 107 107 TYR N N 107 120.708 112.605 8.103 1
1 1231 . 5 1 1 A 108 108 SER H H 108 7.117 7.838 -0.721 1
1 1232 . 5 1 1 A 108 108 SER HA H 108 4.221 4.036 0.185 1
1 1235 . 5 1 1 A 108 108 SER C C 108 174.834 174.030 0.804 1
1 1236 . 5 1 1 A 108 108 SER CA C 108 59.859 61.076 -1.217 1
1 1237 . 5 1 1 A 108 108 SER CB C 108 63.846 62.874 0.972 1
1 1238 . 5 1 1 A 108 108 SER N N 108 113.362 116.294 -2.932 1
1 1239 . 5 1 1 A 109 109 SER H H 109 8.053 7.797 0.256 1
1 1240 . 5 1 1 A 109 109 SER HA H 109 4.560 4.244 0.316 1
1 1243 . 5 1 1 A 109 109 SER CA C 109 57.141 60.888 -3.747 1
1 1244 . 5 1 1 A 109 109 SER CB C 109 64.874 61.938 2.936 1
1 1245 . 5 1 1 A 109 109 SER N N 109 116.657 114.673 1.984 1
1 1246 . 5 1 1 A 110 110 THR HA H 110 3.541 3.942 -0.401 1
1 1251 . 5 1 1 A 110 110 THR C C 110 175.477 176.480 -1.003 1
1 1252 . 5 1 1 A 110 110 THR CA C 110 66.443 65.761 0.682 1
1 1253 . 5 1 1 A 110 110 THR CB C 110 68.091 68.481 -0.390 1
1 1255 . 5 1 1 A 111 111 ASP H H 111 8.224 8.233 -0.009 1
1 1256 . 5 1 1 A 111 111 ASP HA H 111 4.237 4.400 -0.163 1
1 1259 . 5 1 1 A 111 111 ASP C C 111 177.520 178.184 -0.664 1
1 1260 . 5 1 1 A 111 111 ASP CA C 111 57.559 57.338 0.221 1
1 1261 . 5 1 1 A 111 111 ASP CB C 111 40.292 41.241 -0.949 1
1 1262 . 5 1 1 A 111 111 ASP N N 111 119.490 121.244 -1.754 1
1 1263 . 5 1 1 A 112 112 ALA H H 112 7.431 7.985 -0.554 1
1 1264 . 5 1 1 A 112 112 ALA HA H 112 4.191 4.104 0.087 1
1 1268 . 5 1 1 A 112 112 ALA C C 112 180.646 180.091 0.555 1
1 1269 . 5 1 1 A 112 112 ALA CA C 112 54.534 54.836 -0.302 1
1 1270 . 5 1 1 A 112 112 ALA CB C 112 18.992 18.287 0.705 1
1 1271 . 5 1 1 A 112 112 ALA N N 112 119.710 121.762 -2.052 1
1 1272 . 5 1 1 A 113 113 GLN H H 113 7.576 8.233 -0.657 1
1 1273 . 5 1 1 A 113 113 GLN HA H 113 3.562 4.058 -0.496 1
1 1278 . 5 1 1 A 113 113 GLN C C 113 176.756 177.502 -0.746 1
1 1279 . 5 1 1 A 113 113 GLN CA C 113 57.736 58.278 -0.542 1
1 1280 . 5 1 1 A 113 113 GLN CB C 113 29.110 28.169 0.941 1
1 1281 . 5 1 1 A 113 113 GLN N N 113 117.518 115.789 1.729 1
1 1283 . 5 1 1 A 114 114 MET H H 114 8.192 7.869 0.323 1
1 1284 . 5 1 1 A 114 114 MET HA H 114 4.231 4.301 -0.070 1
1 1289 . 5 1 1 A 114 114 MET C C 114 175.648 177.558 -1.910 1
1 1290 . 5 1 1 A 114 114 MET CA C 114 57.446 57.363 0.083 1
1 1291 . 5 1 1 A 114 114 MET CB C 114 33.570 32.398 1.172 1
1 1293 . 5 1 1 A 114 114 MET N N 114 111.509 117.071 -5.562 1
1 1294 . 5 1 1 A 115 115 GLN H H 115 6.940 7.468 -0.528 1
1 1295 . 5 1 1 A 115 115 GLN HA H 115 4.307 4.409 -0.102 1
1 1302 . 5 1 1 A 115 115 GLN C C 115 176.270 175.877 0.393 1
1 1303 . 5 1 1 A 115 115 GLN CA C 115 54.680 55.919 -1.239 1
1 1304 . 5 1 1 A 115 115 GLN CB C 115 28.233 28.987 -0.754 1
1 1306 . 5 1 1 A 115 115 GLN N N 115 114.300 117.376 -3.076 1
1 1308 . 5 1 1 A 116 116 TYR H H 116 6.677 7.708 -1.031 1
1 1309 . 5 1 1 A 116 116 TYR HA H 116 4.193 4.052 0.141 1
1 1312 . 5 1 1 A 116 116 TYR C C 116 175.268 173.650 1.618 1
1 1313 . 5 1 1 A 116 116 TYR CA C 116 54.357 58.616 -4.259 1
1 1314 . 5 1 1 A 116 116 TYR CB C 116 35.498 36.445 -0.947 1
1 1315 . 5 1 1 A 116 116 TYR N N 116 117.919 118.892 -0.973 1
1 1316 . 5 1 1 A 117 117 ASP H H 117 8.081 8.485 -0.404 1
1 1317 . 5 1 1 A 117 117 ASP HA H 117 4.665 4.798 -0.133 1
1 1320 . 5 1 1 A 117 117 ASP CA C 117 52.422 49.867 2.555 1
1 1321 . 5 1 1 A 117 117 ASP CB C 117 42.416 42.310 0.106 1
1 1322 . 5 1 1 A 117 117 ASP N N 117 120.887 125.965 -5.078 1
1 1323 . 5 1 1 A 118 118 PRO C C 118 179.180 177.496 1.684 1
1 1324 . 5 1 1 A 118 118 PRO CA C 118 65.942 64.315 1.627 1
1 1325 . 5 1 1 A 118 118 PRO CB C 118 32.197 31.667 0.530 1
1 1326 . 5 1 1 A 119 119 GLY H H 119 9.742 7.643 2.099 1
1 1327 . 5 1 1 A 119 119 GLY C C 119 175.622 175.220 0.402 1
1 1328 . 5 1 1 A 119 119 GLY CA C 119 46.785 45.793 0.992 1
1 1329 . 5 1 1 A 119 119 GLY N N 119 106.412 105.795 0.617 1
1 1330 . 5 1 1 A 120 120 LEU H H 120 6.666 7.037 -0.371 1
1 1331 . 5 1 1 A 120 120 LEU HA H 120 3.365 3.897 -0.532 1
1 1341 . 5 1 1 A 120 120 LEU C C 120 179.262 178.129 1.133 1
1 1342 . 5 1 1 A 120 120 LEU CA C 120 56.605 56.816 -0.211 1
1 1343 . 5 1 1 A 120 120 LEU CB C 120 39.262 41.192 -1.930 1
1 1347 . 5 1 1 A 120 120 LEU N N 120 126.226 122.853 3.373 1
1 1348 . 5 1 1 A 121 121 PHE H H 121 7.356 8.278 -0.922 1
1 1349 . 5 1 1 A 121 121 PHE HA H 121 4.459 3.889 0.570 1
1 1352 . 5 1 1 A 121 121 PHE C C 121 179.716 177.675 2.041 1
1 1353 . 5 1 1 A 121 121 PHE CA C 121 62.838 61.981 0.857 1
1 1354 . 5 1 1 A 121 121 PHE CB C 121 37.603 39.190 -1.587 1
1 1355 . 5 1 1 A 121 121 PHE N N 121 117.437 119.099 -1.662 1
1 1356 . 5 1 1 A 122 122 ALA H H 122 7.926 7.761 0.165 1
1 1357 . 5 1 1 A 122 122 ALA HA H 122 4.523 3.828 0.695 1
1 1361 . 5 1 1 A 122 122 ALA C C 122 180.435 179.916 0.519 1
1 1362 . 5 1 1 A 122 122 ALA CA C 122 55.527 55.179 0.348 1
1 1363 . 5 1 1 A 122 122 ALA CB C 122 17.814 17.956 -0.142 1
1 1364 . 5 1 1 A 122 122 ALA N N 122 121.068 120.862 0.206 1
1 1365 . 5 1 1 A 123 123 GLN H H 123 7.507 7.881 -0.374 1
1 1366 . 5 1 1 A 123 123 GLN HA H 123 4.153 4.008 0.145 1
1 1371 . 5 1 1 A 123 123 GLN C C 123 180.561 178.787 1.774 1
1 1372 . 5 1 1 A 123 123 GLN CA C 123 59.948 58.666 1.282 1
1 1373 . 5 1 1 A 123 123 GLN CB C 123 29.135 28.267 0.868 1
1 1375 . 5 1 1 A 123 123 GLN N N 123 120.324 116.401 3.923 1
1 1376 . 5 1 1 A 124 124 ILE H H 124 8.318 7.917 0.401 1
1 1377 . 5 1 1 A 124 124 ILE HA H 124 3.635 3.880 -0.245 1
1 1387 . 5 1 1 A 124 124 ILE C C 124 176.481 178.107 -1.626 1
1 1388 . 5 1 1 A 124 124 ILE CA C 124 66.432 64.487 1.945 1
1 1389 . 5 1 1 A 124 124 ILE CB C 124 39.168 37.842 1.326 1
1 1393 . 5 1 1 A 124 124 ILE N N 124 123.747 118.131 5.616 1
1 1394 . 5 1 1 A 125 125 GLN H H 125 8.474 7.736 0.738 1
1 1395 . 5 1 1 A 125 125 GLN HA H 125 4.264 3.937 0.327 1
1 1402 . 5 1 1 A 125 125 GLN C C 125 178.947 177.930 1.017 1
1 1403 . 5 1 1 A 125 125 GLN CA C 125 59.651 58.379 1.272 1
1 1404 . 5 1 1 A 125 125 GLN CB C 125 28.880 28.555 0.325 1
1 1406 . 5 1 1 A 125 125 GLN N N 125 120.368 121.120 -0.752 1
1 1408 . 5 1 1 A 126 126 ALA H H 126 8.002 7.730 0.272 1
1 1409 . 5 1 1 A 126 126 ALA HA H 126 4.144 4.034 0.110 1
1 1413 . 5 1 1 A 126 126 ALA C C 126 179.316 179.614 -0.298 1
1 1414 . 5 1 1 A 126 126 ALA CA C 126 55.036 54.890 0.146 1
1 1415 . 5 1 1 A 126 126 ALA CB C 126 18.087 17.934 0.153 1
1 1416 . 5 1 1 A 126 126 ALA N N 126 121.661 121.078 0.583 1
1 1417 . 5 1 1 A 127 127 ALA H H 127 7.823 8.389 -0.566 1
1 1418 . 5 1 1 A 127 127 ALA HA H 127 4.162 3.960 0.202 1
1 1422 . 5 1 1 A 127 127 ALA C C 127 180.707 179.264 1.443 1
1 1423 . 5 1 1 A 127 127 ALA CA C 127 55.080 54.833 0.247 1
1 1424 . 5 1 1 A 127 127 ALA CB C 127 19.354 18.099 1.255 1
1 1425 . 5 1 1 A 127 127 ALA N N 127 119.853 119.603 0.250 1
1 1426 . 5 1 1 A 128 128 ALA H H 128 8.936 7.531 1.405 1
1 1427 . 5 1 1 A 128 128 ALA HA H 128 3.928 3.463 0.465 1
1 1431 . 5 1 1 A 128 128 ALA C C 128 181.031 178.894 2.137 1
1 1432 . 5 1 1 A 128 128 ALA CA C 128 55.502 54.474 1.028 1
1 1433 . 5 1 1 A 128 128 ALA CB C 128 16.609 17.974 -1.365 1
1 1434 . 5 1 1 A 128 128 ALA N N 128 121.355 120.233 1.122 1
1 1435 . 5 1 1 A 129 129 THR H H 129 8.543 7.433 1.110 1
1 1436 . 5 1 1 A 129 129 THR HA H 129 4.015 3.680 0.335 1
1 1441 . 5 1 1 A 129 129 THR C C 129 177.332 176.163 1.169 1
1 1442 . 5 1 1 A 129 129 THR CA C 129 65.893 64.937 0.956 1
1 1443 . 5 1 1 A 129 129 THR CB C 129 68.566 68.490 0.076 1
1 1445 . 5 1 1 A 129 129 THR N N 129 112.709 112.232 0.477 1
1 1446 . 5 1 1 A 130 130 LYS H H 130 8.126 7.599 0.527 1
1 1447 . 5 1 1 A 130 130 LYS HA H 130 4.000 4.012 -0.012 1
1 1456 . 5 1 1 A 130 130 LYS C C 130 179.082 178.648 0.434 1
1 1457 . 5 1 1 A 130 130 LYS CA C 130 60.299 58.441 1.858 1
1 1458 . 5 1 1 A 130 130 LYS CB C 130 32.767 31.913 0.854 1
1 1462 . 5 1 1 A 130 130 LYS N N 130 123.879 120.726 3.153 1
1 1463 . 5 1 1 A 131 131 ALA H H 131 7.184 7.567 -0.383 1
1 1464 . 5 1 1 A 131 131 ALA HA H 131 4.005 4.240 -0.235 1
1 1468 . 5 1 1 A 131 131 ALA C C 131 178.482 179.534 -1.052 1
1 1469 . 5 1 1 A 131 131 ALA CA C 131 55.027 55.103 -0.076 1
1 1470 . 5 1 1 A 131 131 ALA CB C 131 18.669 19.596 -0.927 1
1 1471 . 5 1 1 A 131 131 ALA N N 131 118.590 121.192 -2.602 1
1 1472 . 5 1 1 A 132 132 TRP H H 132 7.977 8.613 -0.636 1
1 1473 . 5 1 1 A 132 132 TRP HA H 132 4.001 4.204 -0.203 1
1 1480 . 5 1 1 A 132 132 TRP C C 132 177.332 175.802 1.530 1
1 1481 . 5 1 1 A 132 132 TRP CA C 132 60.431 57.395 3.036 1
1 1482 . 5 1 1 A 132 132 TRP CB C 132 27.786 27.566 0.220 1
1 1486 . 5 1 1 A 132 132 TRP N N 132 119.168 117.253 1.915 1
1 1488 . 5 1 1 A 133 133 ARG H H 133 8.006 8.081 -0.075 1
1 1489 . 5 1 1 A 133 133 ARG HA H 133 4.027 4.376 -0.349 1
1 1497 . 5 1 1 A 133 133 ARG C C 133 176.664 177.740 -1.076 1
1 1498 . 5 1 1 A 133 133 ARG CA C 133 59.355 57.310 2.045 1
1 1499 . 5 1 1 A 133 133 ARG CB C 133 30.451 32.193 -1.742 1
1 1502 . 5 1 1 A 133 133 ARG N N 133 113.062 120.660 -7.598 1
1 1504 . 5 1 1 A 134 134 LYS H H 134 7.322 7.564 -0.242 1
1 1505 . 5 1 1 A 134 134 LYS HA H 134 4.313 4.478 -0.165 1
1 1514 . 5 1 1 A 134 134 LYS C C 134 176.282 176.357 -0.075 1
1 1515 . 5 1 1 A 134 134 LYS CA C 134 54.922 56.629 -1.707 1
1 1516 . 5 1 1 A 134 134 LYS CB C 134 32.633 31.555 1.078 1
1 1520 . 5 1 1 A 134 134 LYS N N 134 118.170 118.436 -0.266 1
1 1521 . 5 1 1 A 135 135 LEU H H 135 7.440 7.933 -0.493 1
1 1522 . 5 1 1 A 135 135 LEU HA H 135 4.174 4.577 -0.403 1
1 1532 . 5 1 1 A 135 135 LEU CA C 135 54.408 53.009 1.399 1
1 1533 . 5 1 1 A 135 135 LEU CB C 135 40.407 41.140 -0.733 1
1 1537 . 5 1 1 A 135 135 LEU N N 135 123.358 121.149 2.209 1
1 1538 . 5 1 1 A 136 136 PRO HA H 136 4.437 4.599 -0.162 1
1 1545 . 5 1 1 A 136 136 PRO C C 136 177.106 175.065 2.041 1
1 1546 . 5 1 1 A 136 136 PRO CA C 136 62.889 62.347 0.542 1
1 1547 . 5 1 1 A 136 136 PRO CB C 136 32.192 33.008 -0.816 1
1 1550 . 5 1 1 A 137 137 VAL H H 137 8.219 8.194 0.025 1
1 1551 . 5 1 1 A 137 137 VAL HA H 137 4.077 4.853 -0.776 1
1 1559 . 5 1 1 A 137 137 VAL C C 137 176.305 174.615 1.690 1
1 1560 . 5 1 1 A 137 137 VAL CA C 137 61.958 60.380 1.578 1
1 1561 . 5 1 1 A 137 137 VAL CB C 137 32.755 35.825 -3.070 1
1 1564 . 5 1 1 A 137 137 VAL N N 137 120.079 119.043 1.036 1
1 1565 . 5 1 1 A 138 138 LYS H H 138 8.444 8.768 -0.324 1
1 1566 . 5 1 1 A 138 138 LYS HA H 138 4.316 4.505 -0.189 1
1 1575 . 5 1 1 A 138 138 LYS C C 138 176.790 176.233 0.557 1
1 1576 . 5 1 1 A 138 138 LYS CA C 138 56.792 55.437 1.355 1
1 1577 . 5 1 1 A 138 138 LYS CB C 138 33.205 31.945 1.260 1
1 1581 . 5 1 1 A 138 138 LYS N N 138 126.449 126.656 -0.207 1
1 1582 . 5 1 1 A 139 139 GLY H H 139 8.518 8.400 0.118 1
1 1583 . 5 1 1 A 139 139 GLY HA2 H 139 4.070 3.986 0.084 1
1 1584 . 5 1 1 A 139 139 GLY HA3 H 139 3.897 3.996 -0.099 1
1 1585 . 5 1 1 A 139 139 GLY C C 139 172.874 173.253 -0.379 1
1 1586 . 5 1 1 A 139 139 GLY CA C 139 45.157 45.896 -0.739 1
1 1587 . 5 1 1 A 139 139 GLY N N 139 112.617 112.878 -0.261 1
1 6 . 6 1 1 A 2 2 VAL H H 2 8.992 8.694 0.298 1
1 7 . 6 1 1 A 2 2 VAL HA H 2 5.370 4.483 0.887 1
1 15 . 6 1 1 A 2 2 VAL C C 2 174.325 175.263 -0.938 1
1 16 . 6 1 1 A 2 2 VAL CA C 2 61.267 61.831 -0.564 1
1 17 . 6 1 1 A 2 2 VAL CB C 2 33.890 33.309 0.581 1
1 20 . 6 1 1 A 2 2 VAL N N 2 126.939 123.067 3.872 1
1 21 . 6 1 1 A 3 3 THR H H 3 8.912 8.679 0.233 1
1 22 . 6 1 1 A 3 3 THR HA H 3 4.505 4.811 -0.306 1
1 27 . 6 1 1 A 3 3 THR C C 3 172.710 173.624 -0.914 1
1 28 . 6 1 1 A 3 3 THR CA C 3 59.689 61.315 -1.626 1
1 29 . 6 1 1 A 3 3 THR CB C 3 72.398 70.421 1.977 1
1 31 . 6 1 1 A 3 3 THR N N 3 118.091 123.054 -4.963 1
1 32 . 6 1 1 A 4 4 GLU H H 4 8.631 8.746 -0.115 1
1 33 . 6 1 1 A 4 4 GLU HA H 4 5.788 4.949 0.839 1
1 38 . 6 1 1 A 4 4 GLU C C 4 175.758 174.245 1.513 1
1 39 . 6 1 1 A 4 4 GLU CA C 4 54.902 54.065 0.837 1
1 40 . 6 1 1 A 4 4 GLU CB C 4 35.097 32.378 2.719 1
1 42 . 6 1 1 A 4 4 GLU N N 4 120.966 124.354 -3.388 1
1 43 . 6 1 1 A 5 5 THR H H 5 9.188 8.556 0.632 1
1 44 . 6 1 1 A 5 5 THR HA H 5 4.739 4.615 0.124 1
1 49 . 6 1 1 A 5 5 THR C C 5 172.757 171.739 1.018 1
1 50 . 6 1 1 A 5 5 THR CA C 5 60.382 60.345 0.037 1
1 51 . 6 1 1 A 5 5 THR CB C 5 71.558 70.098 1.460 1
1 53 . 6 1 1 A 5 5 THR N N 5 119.366 113.963 5.403 1
1 54 . 6 1 1 A 6 6 VAL H H 6 8.476 8.322 0.154 1
1 55 . 6 1 1 A 6 6 VAL HA H 6 5.026 5.837 -0.811 1
1 63 . 6 1 1 A 6 6 VAL C C 6 176.674 174.818 1.856 1
1 64 . 6 1 1 A 6 6 VAL CA C 6 61.008 60.827 0.181 1
1 65 . 6 1 1 A 6 6 VAL CB C 6 33.861 35.064 -1.203 1
1 68 . 6 1 1 A 6 6 VAL N N 6 121.384 122.879 -1.495 1
1 69 . 6 1 1 A 7 7 ASP H H 7 8.848 8.935 -0.087 1
1 70 . 6 1 1 A 7 7 ASP HA H 7 4.797 4.757 0.040 1
1 73 . 6 1 1 A 7 7 ASP CA C 7 52.834 54.927 -2.093 1
1 74 . 6 1 1 A 7 7 ASP CB C 7 42.219 42.559 -0.340 1
1 75 . 6 1 1 A 7 7 ASP N N 7 127.061 127.214 -0.153 1
1 76 . 6 1 1 A 8 8 GLY C C 8 175.143 174.481 0.662 1
1 77 . 6 1 1 A 8 8 GLY CA C 8 46.553 47.036 -0.483 1
1 78 . 6 1 1 A 9 9 GLN H H 9 8.408 7.767 0.641 1
1 79 . 6 1 1 A 9 9 GLN HA H 9 4.541 4.269 0.272 1
1 86 . 6 1 1 A 9 9 GLN C C 9 176.463 177.126 -0.663 1
1 87 . 6 1 1 A 9 9 GLN CA C 9 55.167 55.165 0.002 1
1 88 . 6 1 1 A 9 9 GLN CB C 9 29.376 27.789 1.587 1
1 90 . 6 1 1 A 9 9 GLN N N 9 118.300 116.565 1.735 1
1 92 . 6 1 1 A 10 10 GLY H H 10 8.162 8.411 -0.249 1
1 93 . 6 1 1 A 10 10 GLY HA2 H 10 4.174 3.961 0.213 1
1 94 . 6 1 1 A 10 10 GLY HA3 H 10 3.521 3.963 -0.442 1
1 95 . 6 1 1 A 10 10 GLY C C 10 174.092 174.742 -0.650 1
1 96 . 6 1 1 A 10 10 GLY CA C 10 45.558 46.187 -0.629 1
1 97 . 6 1 1 A 10 10 GLY N N 10 108.747 110.322 -1.575 1
1 98 . 6 1 1 A 11 11 GLN H H 11 8.507 7.564 0.943 1
1 99 . 6 1 1 A 11 11 GLN HA H 11 4.202 4.629 -0.427 1
1 106 . 6 1 1 A 11 11 GLN C C 11 173.992 174.567 -0.575 1
1 107 . 6 1 1 A 11 11 GLN CA C 11 55.098 54.778 0.320 1
1 108 . 6 1 1 A 11 11 GLN CB C 11 29.097 30.665 -1.568 1
1 110 . 6 1 1 A 11 11 GLN N N 11 122.979 119.747 3.232 1
1 112 . 6 1 1 A 12 12 ALA H H 12 8.259 9.012 -0.753 1
1 113 . 6 1 1 A 12 12 ALA HA H 12 5.156 5.535 -0.379 1
1 117 . 6 1 1 A 12 12 ALA C C 12 177.284 176.586 0.698 1
1 118 . 6 1 1 A 12 12 ALA CA C 12 51.087 50.832 0.255 1
1 119 . 6 1 1 A 12 12 ALA CB C 12 20.500 19.590 0.910 1
1 120 . 6 1 1 A 12 12 ALA N N 12 127.100 128.568 -1.468 1
1 121 . 6 1 1 A 13 13 TRP H H 13 9.245 8.695 0.550 1
1 122 . 6 1 1 A 13 13 TRP HA H 13 4.717 5.565 -0.848 1
1 131 . 6 1 1 A 13 13 TRP C C 13 175.108 174.322 0.786 1
1 132 . 6 1 1 A 13 13 TRP CA C 13 55.966 55.584 0.382 1
1 133 . 6 1 1 A 13 13 TRP CB C 13 31.912 32.157 -0.245 1
1 139 . 6 1 1 A 13 13 TRP N N 13 123.088 120.655 2.433 1
1 141 . 6 1 1 A 14 14 ARG H H 14 8.575 8.807 -0.232 1
1 142 . 6 1 1 A 14 14 ARG HA H 14 5.335 3.991 1.344 1
1 150 . 6 1 1 A 14 14 ARG C C 14 175.191 173.917 1.274 1
1 151 . 6 1 1 A 14 14 ARG CA C 14 53.106 54.944 -1.838 1
1 152 . 6 1 1 A 14 14 ARG CB C 14 32.749 31.464 1.285 1
1 154 . 6 1 1 A 14 14 ARG N N 14 121.163 120.003 1.160 1
1 156 . 6 1 1 A 15 15 HIS H H 15 8.595 7.886 0.709 1
1 157 . 6 1 1 A 15 15 HIS HA H 15 4.790 4.919 -0.129 1
1 161 . 6 1 1 A 15 15 HIS C C 15 173.770 173.913 -0.143 1
1 162 . 6 1 1 A 15 15 HIS CA C 15 55.289 54.466 0.823 1
1 163 . 6 1 1 A 15 15 HIS CB C 15 33.208 33.977 -0.769 1
1 165 . 6 1 1 A 15 15 HIS N N 15 117.643 118.481 -0.838 1
1 166 . 6 1 1 A 16 16 HIS H H 16 8.993 8.958 0.035 1
1 167 . 6 1 1 A 16 16 HIS HA H 16 5.158 5.093 0.065 1
1 171 . 6 1 1 A 16 16 HIS C C 16 173.608 174.789 -1.181 1
1 172 . 6 1 1 A 16 16 HIS CA C 16 56.450 55.281 1.169 1
1 173 . 6 1 1 A 16 16 HIS CB C 16 34.171 31.244 2.927 1
1 175 . 6 1 1 A 16 16 HIS N N 16 123.520 118.009 5.511 1
1 176 . 6 1 1 A 17 17 ASN H H 17 7.829 8.926 -1.097 1
1 177 . 6 1 1 A 17 17 ASN HA H 17 4.713 5.247 -0.534 1
1 182 . 6 1 1 A 17 17 ASN C C 17 173.682 175.589 -1.907 1
1 183 . 6 1 1 A 17 17 ASN CA C 17 51.822 51.722 0.100 1
1 184 . 6 1 1 A 17 17 ASN CB C 17 43.176 41.218 1.958 1
1 185 . 6 1 1 A 17 17 ASN N N 17 122.213 120.946 1.267 1
1 187 . 6 1 1 A 18 18 GLY H H 18 8.423 8.499 -0.076 1
1 188 . 6 1 1 A 18 18 GLY HA2 H 18 3.931 3.606 0.325 1
1 189 . 6 1 1 A 18 18 GLY HA3 H 18 3.707 3.608 0.099 1
1 190 . 6 1 1 A 18 18 GLY C C 18 173.985 173.596 0.389 1
1 191 . 6 1 1 A 18 18 GLY CA C 18 43.949 46.690 -2.741 1
1 192 . 6 1 1 A 18 18 GLY N N 18 106.991 110.899 -3.908 1
1 193 . 6 1 1 A 19 19 PHE H H 19 8.338 7.900 0.438 1
1 194 . 6 1 1 A 19 19 PHE HA H 19 4.068 5.251 -1.183 1
1 197 . 6 1 1 A 19 19 PHE C C 19 176.568 174.446 2.122 1
1 198 . 6 1 1 A 19 19 PHE CA C 19 59.338 56.510 2.828 1
1 199 . 6 1 1 A 19 19 PHE CB C 19 40.201 41.250 -1.049 1
1 200 . 6 1 1 A 19 19 PHE N N 19 116.857 115.859 0.998 1
1 201 . 6 1 1 A 20 20 ASP H H 20 8.794 8.973 -0.179 1
1 202 . 6 1 1 A 20 20 ASP HA H 20 4.485 5.060 -0.575 1
1 205 . 6 1 1 A 20 20 ASP C C 20 177.379 176.521 0.858 1
1 206 . 6 1 1 A 20 20 ASP CA C 20 54.140 54.255 -0.115 1
1 207 . 6 1 1 A 20 20 ASP CB C 20 41.915 41.477 0.438 1
1 208 . 6 1 1 A 20 20 ASP N N 20 123.025 124.859 -1.834 1
1 209 . 6 1 1 A 21 21 PHE H H 21 8.862 9.113 -0.251 1
1 210 . 6 1 1 A 21 21 PHE HA H 21 4.087 4.110 -0.023 1
1 218 . 6 1 1 A 21 21 PHE C C 21 176.952 177.192 -0.240 1
1 219 . 6 1 1 A 21 21 PHE CA C 21 61.095 61.838 -0.743 1
1 220 . 6 1 1 A 21 21 PHE CB C 21 38.678 39.122 -0.444 1
1 226 . 6 1 1 A 21 21 PHE N N 21 127.163 125.505 1.658 1
1 227 . 6 1 1 A 22 22 ALA H H 22 8.561 8.395 0.166 1
1 228 . 6 1 1 A 22 22 ALA HA H 22 3.878 4.016 -0.138 1
1 232 . 6 1 1 A 22 22 ALA C C 22 180.710 180.355 0.355 1
1 233 . 6 1 1 A 22 22 ALA CA C 22 55.211 55.175 0.036 1
1 234 . 6 1 1 A 22 22 ALA CB C 22 18.321 18.194 0.127 1
1 235 . 6 1 1 A 22 22 ALA N N 22 120.293 121.289 -0.996 1
1 236 . 6 1 1 A 23 23 VAL H H 23 7.241 7.948 -0.707 1
1 237 . 6 1 1 A 23 23 VAL HA H 23 3.684 3.475 0.209 1
1 245 . 6 1 1 A 23 23 VAL C C 23 177.101 178.077 -0.976 1
1 246 . 6 1 1 A 23 23 VAL CA C 23 65.237 66.923 -1.686 1
1 247 . 6 1 1 A 23 23 VAL CB C 23 31.780 31.588 0.192 1
1 250 . 6 1 1 A 23 23 VAL N N 23 118.775 118.727 0.048 1
1 251 . 6 1 1 A 24 24 ILE H H 24 6.761 8.197 -1.436 1
1 252 . 6 1 1 A 24 24 ILE HA H 24 3.196 3.451 -0.255 1
1 262 . 6 1 1 A 24 24 ILE C C 24 177.287 177.697 -0.410 1
1 263 . 6 1 1 A 24 24 ILE CA C 24 63.404 65.747 -2.343 1
1 264 . 6 1 1 A 24 24 ILE CB C 24 36.294 37.604 -1.310 1
1 268 . 6 1 1 A 24 24 ILE N N 24 119.036 119.187 -0.151 1
1 269 . 6 1 1 A 25 25 LYS H H 25 8.032 8.145 -0.113 1
1 270 . 6 1 1 A 25 25 LYS HA H 25 3.809 3.597 0.212 1
1 279 . 6 1 1 A 25 25 LYS C C 25 179.450 178.911 0.539 1
1 280 . 6 1 1 A 25 25 LYS CA C 25 59.621 59.442 0.179 1
1 281 . 6 1 1 A 25 25 LYS CB C 25 32.259 32.261 -0.002 1
1 285 . 6 1 1 A 25 25 LYS N N 25 118.368 120.168 -1.800 1
1 286 . 6 1 1 A 26 26 GLU H H 26 7.845 7.909 -0.064 1
1 287 . 6 1 1 A 26 26 GLU HA H 26 4.021 4.250 -0.229 1
1 292 . 6 1 1 A 26 26 GLU C C 26 179.191 178.878 0.313 1
1 293 . 6 1 1 A 26 26 GLU CA C 26 59.530 58.712 0.818 1
1 294 . 6 1 1 A 26 26 GLU CB C 26 29.449 29.489 -0.040 1
1 296 . 6 1 1 A 26 26 GLU N N 26 120.522 118.851 1.671 1
1 297 . 6 1 1 A 27 27 LEU H H 27 8.165 8.148 0.017 1
1 298 . 6 1 1 A 27 27 LEU HA H 27 4.163 4.169 -0.006 1
1 308 . 6 1 1 A 27 27 LEU C C 27 177.256 178.323 -1.067 1
1 309 . 6 1 1 A 27 27 LEU CA C 27 58.049 57.811 0.238 1
1 310 . 6 1 1 A 27 27 LEU CB C 27 41.365 41.962 -0.597 1
1 314 . 6 1 1 A 27 27 LEU N N 27 120.879 121.175 -0.296 1
1 315 . 6 1 1 A 28 28 LYS H H 28 8.902 8.174 0.728 1
1 316 . 6 1 1 A 28 28 LYS HA H 28 4.199 4.408 -0.209 1
1 317 . 6 1 1 A 28 28 LYS C C 28 179.707 179.127 0.580 1
1 318 . 6 1 1 A 28 28 LYS CA C 28 60.097 59.089 1.008 1
1 319 . 6 1 1 A 28 28 LYS CB C 28 33.420 31.751 1.669 1
1 320 . 6 1 1 A 28 28 LYS N N 28 120.050 119.543 0.507 1
1 321 . 6 1 1 A 29 29 THR H H 29 8.294 7.836 0.458 1
1 322 . 6 1 1 A 29 29 THR HA H 29 3.892 3.927 -0.035 1
1 327 . 6 1 1 A 29 29 THR C C 29 175.711 176.263 -0.552 1
1 328 . 6 1 1 A 29 29 THR CA C 29 66.846 66.695 0.151 1
1 329 . 6 1 1 A 29 29 THR CB C 29 68.794 68.684 0.110 1
1 331 . 6 1 1 A 29 29 THR N N 29 115.933 116.616 -0.683 1
1 332 . 6 1 1 A 30 30 ALA H H 30 8.244 8.685 -0.441 1
1 333 . 6 1 1 A 30 30 ALA HA H 30 4.241 4.246 -0.005 1
1 337 . 6 1 1 A 30 30 ALA C C 30 179.128 179.622 -0.494 1
1 338 . 6 1 1 A 30 30 ALA CA C 30 55.714 55.834 -0.120 1
1 339 . 6 1 1 A 30 30 ALA CB C 30 18.955 18.274 0.681 1
1 340 . 6 1 1 A 30 30 ALA N N 30 124.617 123.010 1.607 1
1 341 . 6 1 1 A 31 31 ALA H H 31 8.968 8.770 0.198 1
1 342 . 6 1 1 A 31 31 ALA HA H 31 3.890 4.076 -0.186 1
1 346 . 6 1 1 A 31 31 ALA C C 31 180.352 179.807 0.545 1
1 347 . 6 1 1 A 31 31 ALA CA C 31 55.454 55.492 -0.038 1
1 348 . 6 1 1 A 31 31 ALA CB C 31 17.124 18.025 -0.901 1
1 349 . 6 1 1 A 31 31 ALA N N 31 119.327 120.223 -0.896 1
1 350 . 6 1 1 A 32 32 SER H H 32 7.995 7.820 0.175 1
1 351 . 6 1 1 A 32 32 SER HA H 32 4.238 4.244 -0.006 1
1 354 . 6 1 1 A 32 32 SER C C 32 175.612 176.090 -0.478 1
1 355 . 6 1 1 A 32 32 SER CA C 32 61.203 61.479 -0.276 1
1 356 . 6 1 1 A 32 32 SER CB C 32 63.406 63.466 -0.060 1
1 357 . 6 1 1 A 32 32 SER N N 32 111.962 114.223 -2.261 1
1 358 . 6 1 1 A 33 33 GLN H H 33 8.333 7.942 0.391 1
1 359 . 6 1 1 A 33 33 GLN HA H 33 3.992 4.168 -0.176 1
1 366 . 6 1 1 A 33 33 GLN C C 33 177.486 177.324 0.162 1
1 367 . 6 1 1 A 33 33 GLN CA C 33 58.277 58.115 0.162 1
1 368 . 6 1 1 A 33 33 GLN CB C 33 29.140 29.675 -0.535 1
1 370 . 6 1 1 A 33 33 GLN N N 33 119.527 120.496 -0.969 1
1 372 . 6 1 1 A 34 34 TYR H H 34 8.587 8.334 0.253 1
1 373 . 6 1 1 A 34 34 TYR HA H 34 4.792 4.619 0.173 1
1 380 . 6 1 1 A 34 34 TYR C C 34 176.499 176.666 -0.167 1
1 381 . 6 1 1 A 34 34 TYR CA C 34 57.711 58.960 -1.249 1
1 382 . 6 1 1 A 34 34 TYR CB C 34 39.561 39.428 0.133 1
1 387 . 6 1 1 A 34 34 TYR N N 34 114.610 115.144 -0.534 1
1 388 . 6 1 1 A 35 35 GLY H H 35 7.346 8.421 -1.075 1
1 389 . 6 1 1 A 35 35 GLY HA2 H 35 4.785 4.120 0.665 1
1 390 . 6 1 1 A 35 35 GLY HA3 H 35 4.007 4.127 -0.120 1
1 391 . 6 1 1 A 35 35 GLY C C 35 175.796 173.480 2.316 1
1 392 . 6 1 1 A 35 35 GLY CA C 35 44.355 44.764 -0.409 1
1 393 . 6 1 1 A 35 35 GLY N N 35 108.501 107.030 1.471 1
1 394 . 6 1 1 A 36 36 ALA H H 36 9.363 8.314 1.049 1
1 395 . 6 1 1 A 36 36 ALA HA H 36 4.217 4.561 -0.344 1
1 399 . 6 1 1 A 36 36 ALA C C 36 178.039 178.275 -0.236 1
1 400 . 6 1 1 A 36 36 ALA CA C 36 56.114 51.795 4.319 1
1 401 . 6 1 1 A 36 36 ALA CB C 36 19.179 20.233 -1.054 1
1 402 . 6 1 1 A 36 36 ALA N N 36 125.811 123.642 2.169 1
1 403 . 6 1 1 A 37 37 THR H H 37 8.070 8.747 -0.677 1
1 404 . 6 1 1 A 37 37 THR HA H 37 4.570 4.038 0.532 1
1 409 . 6 1 1 A 37 37 THR C C 37 173.685 173.769 -0.084 1
1 410 . 6 1 1 A 37 37 THR CA C 37 59.822 64.620 -4.798 1
1 411 . 6 1 1 A 37 37 THR CB C 37 68.267 67.157 1.110 1
1 413 . 6 1 1 A 37 37 THR N N 37 129.410 108.982 20.428 1
1 414 . 6 1 1 A 38 38 ALA H H 38 6.853 7.722 -0.869 1
1 415 . 6 1 1 A 38 38 ALA HA H 38 4.601 4.686 -0.085 1
1 419 . 6 1 1 A 38 38 ALA CA C 38 50.758 49.450 1.308 1
1 420 . 6 1 1 A 38 38 ALA CB C 38 18.325 20.289 -1.964 1
1 421 . 6 1 1 A 38 38 ALA N N 38 124.674 124.025 0.649 1
1 422 . 6 1 1 A 40 40 TYR HA H 40 4.032 3.997 0.035 1
1 429 . 6 1 1 A 40 40 TYR C C 40 176.456 177.155 -0.699 1
1 430 . 6 1 1 A 40 40 TYR CA C 40 61.010 61.701 -0.691 1
1 431 . 6 1 1 A 40 40 TYR CB C 40 39.286 38.460 0.826 1
1 436 . 6 1 1 A 41 41 THR H H 41 6.874 8.171 -1.297 1
1 437 . 6 1 1 A 41 41 THR HA H 41 3.616 3.965 -0.349 1
1 442 . 6 1 1 A 41 41 THR C C 41 176.930 177.274 -0.344 1
1 443 . 6 1 1 A 41 41 THR CA C 41 65.557 66.860 -1.303 1
1 444 . 6 1 1 A 41 41 THR CB C 41 68.228 68.576 -0.348 1
1 446 . 6 1 1 A 41 41 THR N N 41 115.143 113.865 1.278 1
1 447 . 6 1 1 A 42 42 LEU H H 42 8.623 7.430 1.193 1
1 448 . 6 1 1 A 42 42 LEU HA H 42 3.708 4.130 -0.422 1
1 458 . 6 1 1 A 42 42 LEU C C 42 178.206 179.152 -0.946 1
1 459 . 6 1 1 A 42 42 LEU CA C 42 57.417 57.640 -0.223 1
1 460 . 6 1 1 A 42 42 LEU CB C 42 41.342 41.276 0.066 1
1 464 . 6 1 1 A 42 42 LEU N N 42 120.418 117.832 2.586 1
1 465 . 6 1 1 A 43 43 ALA H H 43 7.735 7.925 -0.190 1
1 466 . 6 1 1 A 43 43 ALA HA H 43 4.020 3.950 0.070 1
1 470 . 6 1 1 A 43 43 ALA C C 43 180.826 180.527 0.299 1
1 471 . 6 1 1 A 43 43 ALA CA C 43 54.925 55.087 -0.162 1
1 472 . 6 1 1 A 43 43 ALA CB C 43 17.506 18.073 -0.567 1
1 473 . 6 1 1 A 43 43 ALA N N 43 120.203 121.880 -1.677 1
1 474 . 6 1 1 A 44 44 ILE H H 44 7.149 7.387 -0.238 1
1 475 . 6 1 1 A 44 44 ILE HA H 44 3.603 3.596 0.007 1
1 485 . 6 1 1 A 44 44 ILE C C 44 178.594 177.832 0.762 1
1 486 . 6 1 1 A 44 44 ILE CA C 44 64.782 64.665 0.117 1
1 487 . 6 1 1 A 44 44 ILE CB C 44 37.472 37.656 -0.184 1
1 491 . 6 1 1 A 44 44 ILE N N 44 118.881 119.532 -0.651 1
1 492 . 6 1 1 A 45 45 VAL H H 45 7.968 7.691 0.277 1
1 493 . 6 1 1 A 45 45 VAL HA H 45 2.925 3.335 -0.410 1
1 501 . 6 1 1 A 45 45 VAL C C 45 177.023 177.953 -0.930 1
1 502 . 6 1 1 A 45 45 VAL CA C 45 67.081 67.068 0.013 1
1 503 . 6 1 1 A 45 45 VAL CB C 45 30.854 31.302 -0.448 1
1 506 . 6 1 1 A 45 45 VAL N N 45 120.764 119.910 0.854 1
1 507 . 6 1 1 A 46 46 GLU H H 46 8.399 8.292 0.107 1
1 508 . 6 1 1 A 46 46 GLU HA H 46 3.848 3.988 -0.140 1
1 513 . 6 1 1 A 46 46 GLU C C 46 178.656 178.555 0.101 1
1 514 . 6 1 1 A 46 46 GLU CA C 46 59.491 58.698 0.793 1
1 515 . 6 1 1 A 46 46 GLU CB C 46 28.991 28.350 0.641 1
1 517 . 6 1 1 A 46 46 GLU N N 46 116.599 119.668 -3.069 1
1 518 . 6 1 1 A 47 47 SER H H 47 7.273 7.493 -0.220 1
1 519 . 6 1 1 A 47 47 SER HA H 47 4.287 4.233 0.054 1
1 521 . 6 1 1 A 47 47 SER CA C 47 61.047 60.977 0.070 1
1 522 . 6 1 1 A 47 47 SER CB C 47 63.016 63.022 -0.006 1
1 523 . 6 1 1 A 47 47 SER N N 47 113.609 115.908 -2.299 1
1 524 . 6 1 1 A 48 48 VAL H H 48 8.006 8.068 -0.062 1
1 525 . 6 1 1 A 48 48 VAL HA H 48 3.556 3.709 -0.153 1
1 533 . 6 1 1 A 48 48 VAL C C 48 177.257 176.591 0.666 1
1 534 . 6 1 1 A 48 48 VAL CA C 48 65.025 65.765 -0.740 1
1 535 . 6 1 1 A 48 48 VAL CB C 48 31.841 31.132 0.709 1
1 538 . 6 1 1 A 48 48 VAL N N 48 122.327 121.126 1.201 1
1 539 . 6 1 1 A 49 49 ALA H H 49 8.369 7.718 0.651 1
1 540 . 6 1 1 A 49 49 ALA HA H 49 4.115 4.294 -0.179 1
1 544 . 6 1 1 A 49 49 ALA C C 49 177.307 177.756 -0.449 1
1 545 . 6 1 1 A 49 49 ALA CA C 49 53.253 52.531 0.722 1
1 546 . 6 1 1 A 49 49 ALA CB C 49 20.131 18.936 1.195 1
1 547 . 6 1 1 A 49 49 ALA N N 49 118.050 120.568 -2.518 1
1 548 . 6 1 1 A 50 50 ASP H H 50 7.052 7.896 -0.844 1
1 549 . 6 1 1 A 50 50 ASP HA H 50 4.788 4.587 0.201 1
1 552 . 6 1 1 A 50 50 ASP C C 50 175.481 175.931 -0.450 1
1 553 . 6 1 1 A 50 50 ASP CA C 50 53.681 55.912 -2.231 1
1 554 . 6 1 1 A 50 50 ASP CB C 50 39.333 41.152 -1.819 1
1 555 . 6 1 1 A 50 50 ASP N N 50 116.997 117.875 -0.878 1
1 556 . 6 1 1 A 51 51 ASN H H 51 8.535 7.824 0.711 1
1 557 . 6 1 1 A 51 51 ASN HA H 51 4.628 5.315 -0.687 1
1 562 . 6 1 1 A 51 51 ASN C C 51 174.077 174.970 -0.893 1
1 563 . 6 1 1 A 51 51 ASN CA C 51 52.315 51.300 1.015 1
1 564 . 6 1 1 A 51 51 ASN CB C 51 41.928 40.296 1.632 1
1 565 . 6 1 1 A 51 51 ASN N N 51 118.626 114.189 4.437 1
1 567 . 6 1 1 A 52 52 TRP H H 52 8.555 8.648 -0.093 1
1 574 . 6 1 1 A 52 52 TRP C C 52 173.269 175.947 -2.678 1
1 575 . 6 1 1 A 52 52 TRP CA C 52 55.031 58.164 -3.133 1
1 576 . 6 1 1 A 52 52 TRP CB C 52 26.801 29.328 -2.527 1
1 582 . 6 1 1 A 52 52 TRP N N 52 120.693 121.525 -0.832 1
1 584 . 6 1 1 A 53 53 LEU H H 53 7.847 9.044 -1.197 1
1 585 . 6 1 1 A 53 53 LEU HA H 53 4.859 5.267 -0.408 1
1 595 . 6 1 1 A 53 53 LEU C C 53 177.397 175.258 2.139 1
1 596 . 6 1 1 A 53 53 LEU CA C 53 53.619 53.566 0.053 1
1 597 . 6 1 1 A 53 53 LEU CB C 53 41.812 46.270 -4.458 1
1 601 . 6 1 1 A 53 53 LEU N N 53 124.741 125.635 -0.894 1
1 602 . 6 1 1 A 54 54 THR H H 54 8.850 8.916 -0.066 1
1 603 . 6 1 1 A 54 54 THR HA H 54 4.598 4.643 -0.045 1
1 608 . 6 1 1 A 54 54 THR CA C 54 60.531 58.894 1.637 1
1 609 . 6 1 1 A 54 54 THR CB C 54 67.183 69.358 -2.175 1
1 611 . 6 1 1 A 54 54 THR N N 54 113.407 114.919 -1.512 1
1 612 . 6 1 1 A 55 55 PRO HA H 55 4.511 4.161 0.350 1
1 619 . 6 1 1 A 55 55 PRO C C 55 179.383 178.862 0.521 1
1 620 . 6 1 1 A 55 55 PRO CA C 55 67.159 64.608 2.551 1
1 621 . 6 1 1 A 55 55 PRO CB C 55 32.095 31.672 0.423 1
1 622 . 6 1 1 A 56 56 THR H H 56 8.575 7.655 0.920 1
1 623 . 6 1 1 A 56 56 THR HA H 56 4.229 4.089 0.140 1
1 628 . 6 1 1 A 56 56 THR C C 56 176.668 176.599 0.069 1
1 629 . 6 1 1 A 56 56 THR CA C 56 66.943 65.568 1.375 1
1 630 . 6 1 1 A 56 56 THR CB C 56 68.129 68.544 -0.415 1
1 632 . 6 1 1 A 56 56 THR N N 56 114.855 112.158 2.697 1
1 633 . 6 1 1 A 57 57 ASP H H 57 8.730 8.632 0.098 1
1 634 . 6 1 1 A 57 57 ASP HA H 57 4.425 4.867 -0.442 1
1 637 . 6 1 1 A 57 57 ASP C C 57 178.351 178.843 -0.492 1
1 638 . 6 1 1 A 57 57 ASP CA C 57 57.963 56.733 1.230 1
1 639 . 6 1 1 A 57 57 ASP CB C 57 40.134 39.623 0.511 1
1 640 . 6 1 1 A 57 57 ASP N N 57 126.239 119.853 6.386 1
1 641 . 6 1 1 A 58 58 TRP H H 58 8.244 8.371 -0.127 1
1 642 . 6 1 1 A 58 58 TRP HA H 58 4.030 4.524 -0.494 1
1 650 . 6 1 1 A 58 58 TRP C C 58 177.432 179.029 -1.597 1
1 651 . 6 1 1 A 58 58 TRP CA C 58 62.731 60.410 2.321 1
1 652 . 6 1 1 A 58 58 TRP CB C 58 29.122 29.224 -0.102 1
1 657 . 6 1 1 A 58 58 TRP N N 58 119.241 120.017 -0.776 1
1 659 . 6 1 1 A 59 59 ASN H H 59 8.098 8.370 -0.272 1
1 660 . 6 1 1 A 59 59 ASN HA H 59 4.424 4.505 -0.081 1
1 663 . 6 1 1 A 59 59 ASN C C 59 176.952 177.716 -0.764 1
1 664 . 6 1 1 A 59 59 ASN CA C 59 58.135 56.545 1.590 1
1 665 . 6 1 1 A 59 59 ASN CB C 59 40.168 39.945 0.223 1
1 666 . 6 1 1 A 59 59 ASN N N 59 115.747 118.057 -2.310 1
1 667 . 6 1 1 A 60 60 THR H H 60 8.712 7.911 0.801 1
1 668 . 6 1 1 A 60 60 THR HA H 60 3.717 4.027 -0.310 1
1 673 . 6 1 1 A 60 60 THR C C 60 176.044 176.819 -0.775 1
1 674 . 6 1 1 A 60 60 THR CA C 60 66.576 66.872 -0.296 1
1 675 . 6 1 1 A 60 60 THR CB C 60 69.251 68.013 1.238 1
1 677 . 6 1 1 A 60 60 THR N N 60 114.896 116.044 -1.148 1
1 678 . 6 1 1 A 61 61 LEU H H 61 8.485 8.340 0.145 1
1 679 . 6 1 1 A 61 61 LEU HA H 61 3.391 4.082 -0.691 1
1 689 . 6 1 1 A 61 61 LEU C C 61 177.433 178.606 -1.173 1
1 690 . 6 1 1 A 61 61 LEU CA C 61 58.354 58.562 -0.208 1
1 691 . 6 1 1 A 61 61 LEU CB C 61 41.761 42.289 -0.528 1
1 695 . 6 1 1 A 61 61 LEU N N 61 123.433 122.351 1.082 1
1 696 . 6 1 1 A 62 62 VAL H H 62 8.073 8.279 -0.206 1
1 697 . 6 1 1 A 62 62 VAL HA H 62 3.207 3.760 -0.553 1
1 705 . 6 1 1 A 62 62 VAL C C 62 177.585 177.930 -0.345 1
1 706 . 6 1 1 A 62 62 VAL CA C 62 67.345 65.161 2.184 1
1 707 . 6 1 1 A 62 62 VAL CB C 62 30.905 30.554 0.351 1
1 710 . 6 1 1 A 62 62 VAL N N 62 116.018 118.378 -2.360 1
1 711 . 6 1 1 A 63 63 ARG H H 63 7.765 7.749 0.016 1
1 712 . 6 1 1 A 63 63 ARG HA H 63 3.602 3.901 -0.299 1
1 719 . 6 1 1 A 63 63 ARG C C 63 177.818 177.982 -0.164 1
1 720 . 6 1 1 A 63 63 ARG CA C 63 58.049 59.326 -1.277 1
1 721 . 6 1 1 A 63 63 ARG CB C 63 29.955 30.006 -0.051 1
1 724 . 6 1 1 A 63 63 ARG N N 63 116.700 121.699 -4.999 1
1 725 . 6 1 1 A 64 64 ALA H H 64 7.574 7.592 -0.018 1
1 726 . 6 1 1 A 64 64 ALA HA H 64 4.158 4.392 -0.234 1
1 730 . 6 1 1 A 64 64 ALA C C 64 179.886 179.399 0.487 1
1 731 . 6 1 1 A 64 64 ALA CA C 64 54.007 53.732 0.275 1
1 732 . 6 1 1 A 64 64 ALA CB C 64 19.147 19.979 -0.832 1
1 733 . 6 1 1 A 64 64 ALA N N 64 117.555 121.398 -3.843 1
1 734 . 6 1 1 A 65 65 VAL H H 65 7.554 8.179 -0.625 1
1 735 . 6 1 1 A 65 65 VAL HA H 65 4.253 3.797 0.456 1
1 743 . 6 1 1 A 65 65 VAL C C 65 174.180 176.386 -2.206 1
1 744 . 6 1 1 A 65 65 VAL CA C 65 62.683 65.427 -2.744 1
1 745 . 6 1 1 A 65 65 VAL CB C 65 33.458 31.467 1.991 1
1 748 . 6 1 1 A 65 65 VAL N N 65 110.013 115.400 -5.387 1
1 749 . 6 1 1 A 66 66 LEU H H 66 7.792 7.304 0.488 1
1 750 . 6 1 1 A 66 66 LEU HA H 66 4.790 4.780 0.010 1
1 760 . 6 1 1 A 66 66 LEU C C 66 177.537 175.539 1.998 1
1 761 . 6 1 1 A 66 66 LEU CA C 66 52.823 52.722 0.101 1
1 762 . 6 1 1 A 66 66 LEU CB C 66 44.071 45.580 -1.509 1
1 766 . 6 1 1 A 66 66 LEU N N 66 118.967 121.369 -2.402 1
1 767 . 6 1 1 A 67 67 SER H H 67 9.208 8.437 0.771 1
1 768 . 6 1 1 A 67 67 SER HA H 67 4.414 5.008 -0.594 1
1 771 . 6 1 1 A 67 67 SER CA C 67 57.943 57.649 0.294 1
1 772 . 6 1 1 A 67 67 SER CB C 67 64.743 66.349 -1.606 1
1 773 . 6 1 1 A 67 67 SER N N 67 116.378 116.522 -0.144 1
1 774 . 6 1 1 A 69 69 GLY HA2 H 69 3.916 3.795 0.121 1
1 775 . 6 1 1 A 69 69 GLY HA3 H 69 3.867 3.828 0.039 1
1 776 . 6 1 1 A 69 69 GLY C C 69 176.783 175.517 1.266 1
1 777 . 6 1 1 A 69 69 GLY CA C 69 46.977 46.258 0.719 1
1 778 . 6 1 1 A 70 70 ASP H H 70 7.674 8.109 -0.435 1
1 779 . 6 1 1 A 70 70 ASP HA H 70 4.511 3.692 0.819 1
1 782 . 6 1 1 A 70 70 ASP C C 70 178.096 177.835 0.261 1
1 783 . 6 1 1 A 70 70 ASP CA C 70 57.262 56.526 0.736 1
1 784 . 6 1 1 A 70 70 ASP CB C 70 40.594 39.741 0.853 1
1 785 . 6 1 1 A 70 70 ASP N N 70 123.930 121.731 2.199 1
1 786 . 6 1 1 A 71 71 HIS H H 71 8.729 8.017 0.712 1
1 787 . 6 1 1 A 71 71 HIS HA H 71 4.235 4.021 0.214 1
1 790 . 6 1 1 A 71 71 HIS C C 71 176.769 176.762 0.007 1
1 791 . 6 1 1 A 71 71 HIS CA C 71 60.041 59.803 0.238 1
1 792 . 6 1 1 A 71 71 HIS CB C 71 30.682 29.645 1.037 1
1 793 . 6 1 1 A 71 71 HIS N N 71 121.003 120.074 0.929 1
1 794 . 6 1 1 A 72 72 LEU H H 72 7.620 8.010 -0.390 1
1 795 . 6 1 1 A 72 72 LEU HA H 72 3.769 3.845 -0.076 1
1 805 . 6 1 1 A 72 72 LEU C C 72 180.275 179.418 0.857 1
1 806 . 6 1 1 A 72 72 LEU CA C 72 58.192 58.013 0.179 1
1 807 . 6 1 1 A 72 72 LEU CB C 72 41.381 41.278 0.103 1
1 811 . 6 1 1 A 72 72 LEU N N 72 118.569 117.950 0.619 1
1 812 . 6 1 1 A 73 73 LEU H H 73 7.542 7.736 -0.194 1
1 813 . 6 1 1 A 73 73 LEU HA H 73 4.107 4.108 -0.001 1
1 823 . 6 1 1 A 73 73 LEU C C 73 179.436 179.164 0.272 1
1 824 . 6 1 1 A 73 73 LEU CA C 73 58.026 57.606 0.420 1
1 825 . 6 1 1 A 73 73 LEU CB C 73 41.638 41.987 -0.349 1
1 829 . 6 1 1 A 73 73 LEU N N 73 121.418 121.205 0.213 1
1 830 . 6 1 1 A 74 74 TRP H H 74 8.786 8.044 0.742 1
1 831 . 6 1 1 A 74 74 TRP HA H 74 3.589 5.279 -1.690 1
1 840 . 6 1 1 A 74 74 TRP C C 74 176.816 178.705 -1.889 1
1 841 . 6 1 1 A 74 74 TRP CA C 74 63.046 60.012 3.034 1
1 842 . 6 1 1 A 74 74 TRP CB C 74 28.065 29.145 -1.080 1
1 848 . 6 1 1 A 74 74 TRP N N 74 121.111 118.109 3.002 1
1 850 . 6 1 1 A 75 75 LYS H H 75 8.939 7.666 1.273 1
1 851 . 6 1 1 A 75 75 LYS HA H 75 3.055 4.147 -1.092 1
1 860 . 6 1 1 A 75 75 LYS C C 75 177.967 179.440 -1.473 1
1 861 . 6 1 1 A 75 75 LYS CA C 75 60.029 58.738 1.291 1
1 862 . 6 1 1 A 75 75 LYS CB C 75 32.533 32.795 -0.262 1
1 866 . 6 1 1 A 75 75 LYS N N 75 119.783 118.676 1.107 1
1 867 . 6 1 1 A 76 76 SER H H 76 7.832 8.027 -0.195 1
1 868 . 6 1 1 A 76 76 SER HA H 76 4.040 4.314 -0.274 1
1 871 . 6 1 1 A 76 76 SER C C 76 177.816 177.225 0.591 1
1 872 . 6 1 1 A 76 76 SER CA C 76 62.105 61.431 0.674 1
1 873 . 6 1 1 A 76 76 SER CB C 76 62.679 62.407 0.272 1
1 874 . 6 1 1 A 76 76 SER N N 76 113.395 114.458 -1.063 1
1 875 . 6 1 1 A 77 77 GLU H H 77 7.590 7.666 -0.076 1
1 876 . 6 1 1 A 77 77 GLU HA H 77 4.042 4.290 -0.248 1
1 881 . 6 1 1 A 77 77 GLU C C 77 177.809 178.536 -0.727 1
1 882 . 6 1 1 A 77 77 GLU CA C 77 58.270 58.627 -0.357 1
1 883 . 6 1 1 A 77 77 GLU CB C 77 29.208 29.343 -0.135 1
1 885 . 6 1 1 A 77 77 GLU N N 77 121.574 122.180 -0.606 1
1 886 . 6 1 1 A 78 78 PHE H H 78 9.081 7.873 1.208 1
1 887 . 6 1 1 A 78 78 PHE HA H 78 3.778 4.150 -0.372 1
1 895 . 6 1 1 A 78 78 PHE C C 78 178.114 177.354 0.760 1
1 896 . 6 1 1 A 78 78 PHE CA C 78 60.629 61.398 -0.769 1
1 897 . 6 1 1 A 78 78 PHE CB C 78 38.295 38.890 -0.595 1
1 902 . 6 1 1 A 78 78 PHE N N 78 122.682 122.547 0.135 1
1 903 . 6 1 1 A 79 79 PHE H H 79 8.890 7.956 0.934 1
1 904 . 6 1 1 A 79 79 PHE HA H 79 3.800 4.163 -0.363 1
1 912 . 6 1 1 A 79 79 PHE C C 79 178.354 178.202 0.152 1
1 913 . 6 1 1 A 79 79 PHE CA C 79 60.704 61.663 -0.959 1
1 914 . 6 1 1 A 79 79 PHE CB C 79 37.184 38.558 -1.374 1
1 920 . 6 1 1 A 79 79 PHE N N 79 121.056 117.762 3.294 1
1 921 . 6 1 1 A 80 80 GLU H H 80 7.793 8.218 -0.425 1
1 922 . 6 1 1 A 80 80 GLU HA H 80 4.082 3.993 0.089 1
1 927 . 6 1 1 A 80 80 GLU C C 80 179.068 179.163 -0.095 1
1 928 . 6 1 1 A 80 80 GLU CA C 80 59.735 59.763 -0.028 1
1 929 . 6 1 1 A 80 80 GLU CB C 80 28.722 29.370 -0.648 1
1 931 . 6 1 1 A 80 80 GLU N N 80 120.312 119.743 0.569 1
1 932 . 6 1 1 A 81 81 ASN H H 81 8.624 8.619 0.005 1
1 933 . 6 1 1 A 81 81 ASN HA H 81 4.521 4.469 0.052 1
1 938 . 6 1 1 A 81 81 ASN C C 81 179.262 178.001 1.261 1
1 939 . 6 1 1 A 81 81 ASN CA C 81 55.504 56.443 -0.939 1
1 940 . 6 1 1 A 81 81 ASN CB C 81 37.517 38.285 -0.768 1
1 941 . 6 1 1 A 81 81 ASN N N 81 119.338 118.535 0.803 1
1 943 . 6 1 1 A 82 82 CYS H H 82 8.554 7.973 0.581 1
1 944 . 6 1 1 A 82 82 CYS HA H 82 3.792 4.007 -0.215 1
1 947 . 6 1 1 A 82 82 CYS C C 82 176.478 177.194 -0.716 1
1 948 . 6 1 1 A 82 82 CYS CA C 82 65.232 63.100 2.132 1
1 949 . 6 1 1 A 82 82 CYS CB C 82 26.762 26.953 -0.191 1
1 950 . 6 1 1 A 82 82 CYS N N 82 120.576 117.810 2.766 1
1 951 . 6 1 1 A 83 83 ARG H H 83 8.522 7.974 0.548 1
1 952 . 6 1 1 A 83 83 ARG HA H 83 3.932 4.170 -0.238 1
1 960 . 6 1 1 A 83 83 ARG C C 83 179.138 178.725 0.413 1
1 961 . 6 1 1 A 83 83 ARG CA C 83 60.443 59.642 0.801 1
1 962 . 6 1 1 A 83 83 ARG CB C 83 29.550 29.804 -0.254 1
1 965 . 6 1 1 A 83 83 ARG N N 83 123.035 119.910 3.125 1
1 967 . 6 1 1 A 84 84 ASP H H 84 7.791 8.172 -0.381 1
1 968 . 6 1 1 A 84 84 ASP HA H 84 4.353 4.391 -0.038 1
1 971 . 6 1 1 A 84 84 ASP C C 84 178.649 178.727 -0.078 1
1 972 . 6 1 1 A 84 84 ASP CA C 84 57.767 57.589 0.178 1
1 973 . 6 1 1 A 84 84 ASP CB C 84 41.305 41.529 -0.224 1
1 974 . 6 1 1 A 84 84 ASP N N 84 120.332 119.261 1.071 1
1 975 . 6 1 1 A 85 85 THR H H 85 8.370 7.978 0.392 1
1 976 . 6 1 1 A 85 85 THR HA H 85 3.730 3.890 -0.160 1
1 981 . 6 1 1 A 85 85 THR C C 85 175.198 176.439 -1.241 1
1 982 . 6 1 1 A 85 85 THR CA C 85 66.830 65.836 0.994 1
1 983 . 6 1 1 A 85 85 THR CB C 85 68.533 68.393 0.140 1
1 985 . 6 1 1 A 85 85 THR N N 85 117.360 115.652 1.708 1
1 986 . 6 1 1 A 86 86 ALA H H 86 8.845 8.264 0.581 1
1 987 . 6 1 1 A 86 86 ALA HA H 86 3.991 4.040 -0.049 1
1 991 . 6 1 1 A 86 86 ALA C C 86 179.980 179.576 0.404 1
1 992 . 6 1 1 A 86 86 ALA CA C 86 55.769 55.146 0.623 1
1 993 . 6 1 1 A 86 86 ALA CB C 86 17.881 18.361 -0.480 1
1 994 . 6 1 1 A 86 86 ALA N N 86 123.613 123.824 -0.211 1
1 995 . 6 1 1 A 87 87 LYS H H 87 7.686 7.950 -0.264 1
1 996 . 6 1 1 A 87 87 LYS HA H 87 4.099 4.059 0.040 1
1 1005 . 6 1 1 A 87 87 LYS C C 87 179.592 179.255 0.337 1
1 1006 . 6 1 1 A 87 87 LYS CA C 87 59.708 59.419 0.289 1
1 1007 . 6 1 1 A 87 87 LYS CB C 87 32.054 32.177 -0.123 1
1 1011 . 6 1 1 A 87 87 LYS N N 87 119.623 117.938 1.685 1
1 1012 . 6 1 1 A 88 88 ARG H H 88 7.683 7.622 0.061 1
1 1013 . 6 1 1 A 88 88 ARG HA H 88 4.051 4.180 -0.129 1
1 1020 . 6 1 1 A 88 88 ARG C C 88 180.053 178.935 1.118 1
1 1021 . 6 1 1 A 88 88 ARG CA C 88 59.558 59.175 0.383 1
1 1022 . 6 1 1 A 88 88 ARG CB C 88 29.684 29.849 -0.165 1
1 1025 . 6 1 1 A 88 88 ARG N N 88 120.788 119.731 1.057 1
1 1026 . 6 1 1 A 89 89 ASN H H 89 8.973 8.136 0.837 1
1 1027 . 6 1 1 A 89 89 ASN HA H 89 4.354 4.634 -0.280 1
1 1032 . 6 1 1 A 89 89 ASN C C 89 178.382 178.483 -0.101 1
1 1033 . 6 1 1 A 89 89 ASN CA C 89 55.334 55.925 -0.591 1
1 1034 . 6 1 1 A 89 89 ASN CB C 89 37.864 38.404 -0.540 1
1 1035 . 6 1 1 A 89 89 ASN N N 89 121.012 118.016 2.996 1
1 1037 . 6 1 1 A 90 90 GLN H H 90 8.152 8.260 -0.108 1
1 1038 . 6 1 1 A 90 90 GLN HA H 90 4.020 4.137 -0.117 1
1 1045 . 6 1 1 A 90 90 GLN C C 90 179.075 178.862 0.213 1
1 1046 . 6 1 1 A 90 90 GLN CA C 90 59.318 58.934 0.384 1
1 1047 . 6 1 1 A 90 90 GLN CB C 90 28.049 28.687 -0.638 1
1 1049 . 6 1 1 A 90 90 GLN N N 90 122.122 120.865 1.257 1
1 1051 . 6 1 1 A 91 91 GLN H H 91 7.514 8.393 -0.879 1
1 1052 . 6 1 1 A 91 91 GLN HA H 91 4.053 4.097 -0.044 1
1 1059 . 6 1 1 A 91 91 GLN C C 91 177.081 177.055 0.026 1
1 1060 . 6 1 1 A 91 91 GLN CA C 91 58.031 58.236 -0.205 1
1 1061 . 6 1 1 A 91 91 GLN CB C 91 28.365 28.084 0.281 1
1 1063 . 6 1 1 A 91 91 GLN N N 91 118.124 117.846 0.278 1
1 1065 . 6 1 1 A 92 92 ALA H H 92 7.704 7.110 0.594 1
1 1066 . 6 1 1 A 92 92 ALA HA H 92 4.246 4.442 -0.196 1
1 1070 . 6 1 1 A 92 92 ALA C C 92 178.450 178.079 0.371 1
1 1071 . 6 1 1 A 92 92 ALA CA C 92 52.671 51.846 0.825 1
1 1072 . 6 1 1 A 92 92 ALA CB C 92 19.316 19.135 0.181 1
1 1073 . 6 1 1 A 92 92 ALA N N 92 119.880 120.186 -0.306 1
1 1074 . 6 1 1 A 93 93 GLY H H 93 7.693 8.066 -0.373 1
1 1075 . 6 1 1 A 93 93 GLY HA2 H 93 3.941 3.895 0.046 1
1 1076 . 6 1 1 A 93 93 GLY HA3 H 93 3.744 3.909 -0.165 1
1 1077 . 6 1 1 A 93 93 GLY C C 93 174.344 175.339 -0.995 1
1 1078 . 6 1 1 A 93 93 GLY CA C 93 45.949 46.899 -0.950 1
1 1079 . 6 1 1 A 93 93 GLY N N 93 105.347 107.565 -2.218 1
1 1080 . 6 1 1 A 94 94 ASN H H 94 7.076 8.831 -1.755 1
1 1081 . 6 1 1 A 94 94 ASN HA H 94 4.115 4.648 -0.533 1
1 1085 . 6 1 1 A 94 94 ASN C C 94 175.410 175.402 0.008 1
1 1086 . 6 1 1 A 94 94 ASN CA C 94 52.651 52.826 -0.175 1
1 1087 . 6 1 1 A 94 94 ASN CB C 94 38.330 39.093 -0.763 1
1 1088 . 6 1 1 A 94 94 ASN N N 94 115.747 116.896 -1.149 1
1 1090 . 6 1 1 A 95 95 GLY H H 95 8.236 8.339 -0.103 1
1 1091 . 6 1 1 A 95 95 GLY HA2 H 95 3.633 3.577 0.056 1
1 1092 . 6 1 1 A 95 95 GLY HA3 H 95 3.633 3.762 -0.129 1
1 1093 . 6 1 1 A 95 95 GLY C C 95 174.450 173.658 0.792 1
1 1094 . 6 1 1 A 95 95 GLY CA C 95 45.522 45.451 0.071 1
1 1095 . 6 1 1 A 95 95 GLY N N 95 109.166 107.802 1.364 1
1 1096 . 6 1 1 A 96 96 TRP H H 96 7.899 7.866 0.033 1
1 1097 . 6 1 1 A 96 96 TRP HA H 96 5.241 5.022 0.219 1
1 1106 . 6 1 1 A 96 96 TRP C C 96 175.661 175.162 0.499 1
1 1107 . 6 1 1 A 96 96 TRP CA C 96 55.090 56.813 -1.723 1
1 1108 . 6 1 1 A 96 96 TRP CB C 96 27.138 33.682 -6.544 1
1 1114 . 6 1 1 A 96 96 TRP N N 96 122.840 120.531 2.309 1
1 1116 . 6 1 1 A 97 97 ASP H H 97 7.344 8.999 -1.655 1
1 1117 . 6 1 1 A 97 97 ASP HA H 97 4.829 5.383 -0.554 1
1 1120 . 6 1 1 A 97 97 ASP C C 97 175.019 175.904 -0.885 1
1 1121 . 6 1 1 A 97 97 ASP CA C 97 52.149 53.610 -1.461 1
1 1122 . 6 1 1 A 97 97 ASP CB C 97 42.697 44.521 -1.824 1
1 1123 . 6 1 1 A 97 97 ASP N N 97 126.861 120.984 5.877 1
1 1124 . 6 1 1 A 98 98 PHE H H 98 8.566 9.229 -0.663 1
1 1125 . 6 1 1 A 98 98 PHE HA H 98 3.727 4.366 -0.639 1
1 1133 . 6 1 1 A 98 98 PHE C C 98 177.443 176.922 0.521 1
1 1134 . 6 1 1 A 98 98 PHE CA C 98 62.471 59.900 2.571 1
1 1135 . 6 1 1 A 98 98 PHE CB C 98 39.919 38.017 1.902 1
1 1141 . 6 1 1 A 98 98 PHE N N 98 117.781 121.668 -3.887 1
1 1142 . 6 1 1 A 99 99 ASP H H 99 8.259 8.408 -0.149 1
1 1143 . 6 1 1 A 99 99 ASP HA H 99 3.960 4.219 -0.259 1
1 1146 . 6 1 1 A 99 99 ASP C C 99 178.132 178.243 -0.111 1
1 1147 . 6 1 1 A 99 99 ASP CA C 99 57.658 57.062 0.596 1
1 1148 . 6 1 1 A 99 99 ASP CB C 99 38.572 40.602 -2.030 1
1 1149 . 6 1 1 A 99 99 ASP N N 99 121.709 120.794 0.915 1
1 1150 . 6 1 1 A 100 100 MET H H 100 8.008 8.001 0.007 1
1 1151 . 6 1 1 A 100 100 MET HA H 100 3.644 4.057 -0.413 1
1 1156 . 6 1 1 A 100 100 MET C C 100 180.008 177.505 2.503 1
1 1157 . 6 1 1 A 100 100 MET CA C 100 58.598 58.477 0.121 1
1 1158 . 6 1 1 A 100 100 MET CB C 100 33.423 33.068 0.355 1
1 1160 . 6 1 1 A 100 100 MET N N 100 119.668 118.202 1.466 1
1 1161 . 6 1 1 A 101 101 LEU H H 101 7.961 8.369 -0.408 1
1 1162 . 6 1 1 A 101 101 LEU HA H 101 3.523 4.225 -0.702 1
1 1172 . 6 1 1 A 101 101 LEU C C 101 173.873 176.879 -3.006 1
1 1173 . 6 1 1 A 101 101 LEU CA C 101 58.743 54.306 4.437 1
1 1174 . 6 1 1 A 101 101 LEU CB C 101 42.632 41.159 1.473 1
1 1178 . 6 1 1 A 101 101 LEU N N 101 119.752 119.038 0.714 1
1 1179 . 6 1 1 A 102 102 THR H H 102 6.955 8.192 -1.237 1
1 1180 . 6 1 1 A 102 102 THR HA H 102 4.134 4.326 -0.192 1
1 1185 . 6 1 1 A 102 102 THR C C 102 176.513 175.009 1.504 1
1 1186 . 6 1 1 A 102 102 THR CA C 102 61.125 62.413 -1.288 1
1 1187 . 6 1 1 A 102 102 THR CB C 102 71.415 70.993 0.422 1
1 1189 . 6 1 1 A 102 102 THR N N 102 124.665 117.675 6.990 1
1 1190 . 6 1 1 A 103 103 GLY H H 103 7.816 7.657 0.159 1
1 1191 . 6 1 1 A 103 103 GLY HA2 H 103 3.824 3.899 -0.075 1
1 1192 . 6 1 1 A 103 103 GLY HA3 H 103 3.824 3.961 -0.137 1
1 1193 . 6 1 1 A 103 103 GLY C C 103 174.126 173.904 0.222 1
1 1194 . 6 1 1 A 103 103 GLY CA C 103 47.805 46.603 1.202 1
1 1195 . 6 1 1 A 103 103 GLY N N 103 114.191 110.624 3.567 1
1 1196 . 6 1 1 A 104 104 SER H H 104 8.860 7.780 1.080 1
1 1197 . 6 1 1 A 104 104 SER HA H 104 4.758 5.116 -0.358 1
1 1200 . 6 1 1 A 104 104 SER C C 104 174.591 173.383 1.208 1
1 1201 . 6 1 1 A 104 104 SER CA C 104 56.755 57.608 -0.853 1
1 1202 . 6 1 1 A 104 104 SER CB C 104 65.050 65.875 -0.825 1
1 1203 . 6 1 1 A 104 104 SER N N 104 114.771 115.192 -0.421 1
1 1204 . 6 1 1 A 105 105 GLY H H 105 8.788 8.290 0.498 1
1 1205 . 6 1 1 A 105 105 GLY HA2 H 105 3.733 4.032 -0.299 1
1 1206 . 6 1 1 A 105 105 GLY HA3 H 105 3.733 4.165 -0.432 1
1 1207 . 6 1 1 A 105 105 GLY CA C 105 47.247 45.679 1.568 1
1 1208 . 6 1 1 A 105 105 GLY N N 105 110.394 111.118 -0.724 1
1 1209 . 6 1 1 A 106 106 ASN HA H 106 4.454 4.946 -0.492 1
1 1212 . 6 1 1 A 106 106 ASN C C 106 175.180 175.931 -0.751 1
1 1213 . 6 1 1 A 106 106 ASN CA C 106 54.492 54.473 0.019 1
1 1214 . 6 1 1 A 106 106 ASN CB C 106 37.282 40.746 -3.464 1
1 1215 . 6 1 1 A 107 107 TYR H H 107 8.241 7.391 0.850 1
1 1216 . 6 1 1 A 107 107 TYR HA H 107 4.335 4.796 -0.461 1
1 1223 . 6 1 1 A 107 107 TYR C C 107 173.954 176.717 -2.763 1
1 1224 . 6 1 1 A 107 107 TYR CA C 107 57.727 57.476 0.251 1
1 1225 . 6 1 1 A 107 107 TYR CB C 107 37.063 39.301 -2.238 1
1 1230 . 6 1 1 A 107 107 TYR N N 107 120.708 116.852 3.856 1
1 1231 . 6 1 1 A 108 108 SER H H 108 7.117 7.737 -0.620 1
1 1232 . 6 1 1 A 108 108 SER HA H 108 4.221 4.147 0.074 1
1 1235 . 6 1 1 A 108 108 SER C C 108 174.834 174.069 0.765 1
1 1236 . 6 1 1 A 108 108 SER CA C 108 59.859 60.281 -0.422 1
1 1237 . 6 1 1 A 108 108 SER CB C 108 63.846 63.264 0.582 1
1 1238 . 6 1 1 A 108 108 SER N N 108 113.362 116.174 -2.812 1
1 1239 . 6 1 1 A 109 109 SER H H 109 8.053 7.750 0.303 1
1 1240 . 6 1 1 A 109 109 SER HA H 109 4.560 4.142 0.418 1
1 1243 . 6 1 1 A 109 109 SER CA C 109 57.141 60.646 -3.505 1
1 1244 . 6 1 1 A 109 109 SER CB C 109 64.874 61.785 3.089 1
1 1245 . 6 1 1 A 109 109 SER N N 109 116.657 115.339 1.318 1
1 1246 . 6 1 1 A 110 110 THR HA H 110 3.541 3.868 -0.327 1
1 1251 . 6 1 1 A 110 110 THR C C 110 175.477 176.041 -0.564 1
1 1252 . 6 1 1 A 110 110 THR CA C 110 66.443 65.648 0.795 1
1 1253 . 6 1 1 A 110 110 THR CB C 110 68.091 68.401 -0.310 1
1 1255 . 6 1 1 A 111 111 ASP H H 111 8.224 8.162 0.062 1
1 1256 . 6 1 1 A 111 111 ASP HA H 111 4.237 4.273 -0.036 1
1 1259 . 6 1 1 A 111 111 ASP C C 111 177.520 178.604 -1.084 1
1 1260 . 6 1 1 A 111 111 ASP CA C 111 57.559 57.343 0.216 1
1 1261 . 6 1 1 A 111 111 ASP CB C 111 40.292 40.612 -0.320 1
1 1262 . 6 1 1 A 111 111 ASP N N 111 119.490 119.515 -0.025 1
1 1263 . 6 1 1 A 112 112 ALA H H 112 7.431 8.207 -0.776 1
1 1264 . 6 1 1 A 112 112 ALA HA H 112 4.191 4.012 0.179 1
1 1268 . 6 1 1 A 112 112 ALA C C 112 180.646 179.642 1.004 1
1 1269 . 6 1 1 A 112 112 ALA CA C 112 54.534 54.783 -0.249 1
1 1270 . 6 1 1 A 112 112 ALA CB C 112 18.992 18.144 0.848 1
1 1271 . 6 1 1 A 112 112 ALA N N 112 119.710 122.375 -2.665 1
1 1272 . 6 1 1 A 113 113 GLN H H 113 7.576 7.450 0.126 1
1 1273 . 6 1 1 A 113 113 GLN HA H 113 3.562 4.004 -0.442 1
1 1278 . 6 1 1 A 113 113 GLN C C 113 176.756 177.846 -1.090 1
1 1279 . 6 1 1 A 113 113 GLN CA C 113 57.736 58.373 -0.637 1
1 1280 . 6 1 1 A 113 113 GLN CB C 113 29.110 28.460 0.650 1
1 1281 . 6 1 1 A 113 113 GLN N N 113 117.518 118.036 -0.518 1
1 1283 . 6 1 1 A 114 114 MET H H 114 8.192 8.195 -0.003 1
1 1284 . 6 1 1 A 114 114 MET HA H 114 4.231 3.793 0.438 1
1 1289 . 6 1 1 A 114 114 MET C C 114 175.648 177.468 -1.820 1
1 1290 . 6 1 1 A 114 114 MET CA C 114 57.446 57.861 -0.415 1
1 1291 . 6 1 1 A 114 114 MET CB C 114 33.570 32.390 1.180 1
1 1293 . 6 1 1 A 114 114 MET N N 114 111.509 119.149 -7.640 1
1 1294 . 6 1 1 A 115 115 GLN H H 115 6.940 7.390 -0.450 1
1 1295 . 6 1 1 A 115 115 GLN HA H 115 4.307 4.463 -0.156 1
1 1302 . 6 1 1 A 115 115 GLN C C 115 176.270 175.384 0.886 1
1 1303 . 6 1 1 A 115 115 GLN CA C 115 54.680 55.339 -0.659 1
1 1304 . 6 1 1 A 115 115 GLN CB C 115 28.233 28.821 -0.588 1
1 1306 . 6 1 1 A 115 115 GLN N N 115 114.300 117.366 -3.066 1
1 1308 . 6 1 1 A 116 116 TYR H H 116 6.677 8.108 -1.431 1
1 1309 . 6 1 1 A 116 116 TYR HA H 116 4.193 4.229 -0.036 1
1 1312 . 6 1 1 A 116 116 TYR C C 116 175.268 175.180 0.088 1
1 1313 . 6 1 1 A 116 116 TYR CA C 116 54.357 60.991 -6.634 1
1 1314 . 6 1 1 A 116 116 TYR CB C 116 35.498 37.789 -2.291 1
1 1315 . 6 1 1 A 116 116 TYR N N 116 117.919 118.262 -0.343 1
1 1316 . 6 1 1 A 117 117 ASP H H 117 8.081 7.696 0.385 1
1 1317 . 6 1 1 A 117 117 ASP HA H 117 4.665 4.098 0.567 1
1 1320 . 6 1 1 A 117 117 ASP CA C 117 52.422 54.604 -2.182 1
1 1321 . 6 1 1 A 117 117 ASP CB C 117 42.416 39.605 2.811 1
1 1322 . 6 1 1 A 117 117 ASP N N 117 120.887 119.460 1.427 1
1 1323 . 6 1 1 A 118 118 PRO C C 118 179.180 178.839 0.341 1
1 1324 . 6 1 1 A 118 118 PRO CA C 118 65.942 65.946 -0.004 1
1 1325 . 6 1 1 A 118 118 PRO CB C 118 32.197 31.938 0.259 1
1 1326 . 6 1 1 A 119 119 GLY H H 119 9.742 8.315 1.427 1
1 1327 . 6 1 1 A 119 119 GLY C C 119 175.622 175.016 0.606 1
1 1328 . 6 1 1 A 119 119 GLY CA C 119 46.785 46.006 0.779 1
1 1329 . 6 1 1 A 119 119 GLY N N 119 106.412 105.912 0.500 1
1 1330 . 6 1 1 A 120 120 LEU H H 120 6.666 7.671 -1.005 1
1 1331 . 6 1 1 A 120 120 LEU HA H 120 3.365 3.384 -0.019 1
1 1341 . 6 1 1 A 120 120 LEU C C 120 179.262 178.285 0.977 1
1 1342 . 6 1 1 A 120 120 LEU CA C 120 56.605 56.792 -0.187 1
1 1343 . 6 1 1 A 120 120 LEU CB C 120 39.262 41.423 -2.161 1
1 1347 . 6 1 1 A 120 120 LEU N N 120 126.226 122.886 3.340 1
1 1348 . 6 1 1 A 121 121 PHE H H 121 7.356 8.646 -1.290 1
1 1349 . 6 1 1 A 121 121 PHE HA H 121 4.459 3.899 0.560 1
1 1352 . 6 1 1 A 121 121 PHE C C 121 179.716 177.715 2.001 1
1 1353 . 6 1 1 A 121 121 PHE CA C 121 62.838 62.019 0.819 1
1 1354 . 6 1 1 A 121 121 PHE CB C 121 37.603 39.381 -1.778 1
1 1355 . 6 1 1 A 121 121 PHE N N 121 117.437 119.357 -1.920 1
1 1356 . 6 1 1 A 122 122 ALA H H 122 7.926 8.027 -0.101 1
1 1357 . 6 1 1 A 122 122 ALA HA H 122 4.523 3.973 0.550 1
1 1361 . 6 1 1 A 122 122 ALA C C 122 180.435 179.333 1.102 1
1 1362 . 6 1 1 A 122 122 ALA CA C 122 55.527 55.385 0.142 1
1 1363 . 6 1 1 A 122 122 ALA CB C 122 17.814 18.145 -0.331 1
1 1364 . 6 1 1 A 122 122 ALA N N 122 121.068 121.791 -0.723 1
1 1365 . 6 1 1 A 123 123 GLN H H 123 7.507 7.367 0.140 1
1 1366 . 6 1 1 A 123 123 GLN HA H 123 4.153 4.058 0.095 1
1 1371 . 6 1 1 A 123 123 GLN C C 123 180.561 178.731 1.830 1
1 1372 . 6 1 1 A 123 123 GLN CA C 123 59.948 58.463 1.485 1
1 1373 . 6 1 1 A 123 123 GLN CB C 123 29.135 28.039 1.096 1
1 1375 . 6 1 1 A 123 123 GLN N N 123 120.324 117.445 2.879 1
1 1376 . 6 1 1 A 124 124 ILE H H 124 8.318 7.803 0.515 1
1 1377 . 6 1 1 A 124 124 ILE HA H 124 3.635 3.760 -0.125 1
1 1387 . 6 1 1 A 124 124 ILE C C 124 176.481 177.623 -1.142 1
1 1388 . 6 1 1 A 124 124 ILE CA C 124 66.432 64.329 2.103 1
1 1389 . 6 1 1 A 124 124 ILE CB C 124 39.168 37.725 1.443 1
1 1393 . 6 1 1 A 124 124 ILE N N 124 123.747 117.983 5.764 1
1 1394 . 6 1 1 A 125 125 GLN H H 125 8.474 7.749 0.725 1
1 1395 . 6 1 1 A 125 125 GLN HA H 125 4.264 3.936 0.328 1
1 1402 . 6 1 1 A 125 125 GLN C C 125 178.947 177.929 1.018 1
1 1403 . 6 1 1 A 125 125 GLN CA C 125 59.651 58.167 1.484 1
1 1404 . 6 1 1 A 125 125 GLN CB C 125 28.880 27.915 0.965 1
1 1406 . 6 1 1 A 125 125 GLN N N 125 120.368 121.554 -1.186 1
1 1408 . 6 1 1 A 126 126 ALA H H 126 8.002 7.459 0.543 1
1 1409 . 6 1 1 A 126 126 ALA HA H 126 4.144 4.059 0.085 1
1 1413 . 6 1 1 A 126 126 ALA C C 126 179.316 179.659 -0.343 1
1 1414 . 6 1 1 A 126 126 ALA CA C 126 55.036 54.730 0.306 1
1 1415 . 6 1 1 A 126 126 ALA CB C 126 18.087 18.034 0.053 1
1 1416 . 6 1 1 A 126 126 ALA N N 126 121.661 122.796 -1.135 1
1 1417 . 6 1 1 A 127 127 ALA H H 127 7.823 7.986 -0.163 1
1 1418 . 6 1 1 A 127 127 ALA HA H 127 4.162 4.017 0.145 1
1 1422 . 6 1 1 A 127 127 ALA C C 127 180.707 179.492 1.215 1
1 1423 . 6 1 1 A 127 127 ALA CA C 127 55.080 54.794 0.286 1
1 1424 . 6 1 1 A 127 127 ALA CB C 127 19.354 18.339 1.015 1
1 1425 . 6 1 1 A 127 127 ALA N N 127 119.853 120.072 -0.219 1
1 1426 . 6 1 1 A 128 128 ALA H H 128 8.936 7.802 1.134 1
1 1427 . 6 1 1 A 128 128 ALA HA H 128 3.928 3.781 0.147 1
1 1431 . 6 1 1 A 128 128 ALA C C 128 181.031 179.366 1.665 1
1 1432 . 6 1 1 A 128 128 ALA CA C 128 55.502 54.630 0.872 1
1 1433 . 6 1 1 A 128 128 ALA CB C 128 16.609 17.781 -1.172 1
1 1434 . 6 1 1 A 128 128 ALA N N 128 121.355 120.608 0.747 1
1 1435 . 6 1 1 A 129 129 THR H H 129 8.543 7.524 1.019 1
1 1436 . 6 1 1 A 129 129 THR HA H 129 4.015 3.648 0.367 1
1 1441 . 6 1 1 A 129 129 THR C C 129 177.332 176.222 1.110 1
1 1442 . 6 1 1 A 129 129 THR CA C 129 65.893 64.907 0.986 1
1 1443 . 6 1 1 A 129 129 THR CB C 129 68.566 68.444 0.122 1
1 1445 . 6 1 1 A 129 129 THR N N 129 112.709 112.185 0.524 1
1 1446 . 6 1 1 A 130 130 LYS H H 130 8.126 7.507 0.619 1
1 1447 . 6 1 1 A 130 130 LYS HA H 130 4.000 4.016 -0.016 1
1 1456 . 6 1 1 A 130 130 LYS C C 130 179.082 178.511 0.571 1
1 1457 . 6 1 1 A 130 130 LYS CA C 130 60.299 58.523 1.776 1
1 1458 . 6 1 1 A 130 130 LYS CB C 130 32.767 32.034 0.733 1
1 1462 . 6 1 1 A 130 130 LYS N N 130 123.879 120.452 3.427 1
1 1463 . 6 1 1 A 131 131 ALA H H 131 7.184 7.668 -0.484 1
1 1464 . 6 1 1 A 131 131 ALA HA H 131 4.005 4.241 -0.236 1
1 1468 . 6 1 1 A 131 131 ALA C C 131 178.482 179.547 -1.065 1
1 1469 . 6 1 1 A 131 131 ALA CA C 131 55.027 55.194 -0.167 1
1 1470 . 6 1 1 A 131 131 ALA CB C 131 18.669 19.622 -0.953 1
1 1471 . 6 1 1 A 131 131 ALA N N 131 118.590 121.156 -2.566 1
1 1472 . 6 1 1 A 132 132 TRP H H 132 7.977 8.577 -0.600 1
1 1473 . 6 1 1 A 132 132 TRP HA H 132 4.001 4.195 -0.194 1
1 1480 . 6 1 1 A 132 132 TRP C C 132 177.332 175.652 1.680 1
1 1481 . 6 1 1 A 132 132 TRP CA C 132 60.431 57.358 3.073 1
1 1482 . 6 1 1 A 132 132 TRP CB C 132 27.786 27.689 0.097 1
1 1486 . 6 1 1 A 132 132 TRP N N 132 119.168 117.008 2.160 1
1 1488 . 6 1 1 A 133 133 ARG H H 133 8.006 8.059 -0.053 1
1 1489 . 6 1 1 A 133 133 ARG HA H 133 4.027 4.305 -0.278 1
1 1497 . 6 1 1 A 133 133 ARG C C 133 176.664 177.995 -1.331 1
1 1498 . 6 1 1 A 133 133 ARG CA C 133 59.355 57.227 2.128 1
1 1499 . 6 1 1 A 133 133 ARG CB C 133 30.451 32.370 -1.919 1
1 1502 . 6 1 1 A 133 133 ARG N N 133 113.062 120.616 -7.554 1
1 1504 . 6 1 1 A 134 134 LYS H H 134 7.322 7.767 -0.445 1
1 1505 . 6 1 1 A 134 134 LYS HA H 134 4.313 4.322 -0.009 1
1 1514 . 6 1 1 A 134 134 LYS C C 134 176.282 176.579 -0.297 1
1 1515 . 6 1 1 A 134 134 LYS CA C 134 54.922 56.817 -1.895 1
1 1516 . 6 1 1 A 134 134 LYS CB C 134 32.633 32.127 0.506 1
1 1520 . 6 1 1 A 134 134 LYS N N 134 118.170 115.913 2.257 1
1 1521 . 6 1 1 A 135 135 LEU H H 135 7.440 7.368 0.072 1
1 1522 . 6 1 1 A 135 135 LEU HA H 135 4.174 4.464 -0.290 1
1 1532 . 6 1 1 A 135 135 LEU CA C 135 54.408 53.283 1.125 1
1 1533 . 6 1 1 A 135 135 LEU CB C 135 40.407 42.102 -1.695 1
1 1537 . 6 1 1 A 135 135 LEU N N 135 123.358 123.169 0.189 1
1 1538 . 6 1 1 A 136 136 PRO HA H 136 4.437 4.403 0.034 1
1 1545 . 6 1 1 A 136 136 PRO C C 136 177.106 176.505 0.601 1
1 1546 . 6 1 1 A 136 136 PRO CA C 136 62.889 65.260 -2.371 1
1 1547 . 6 1 1 A 136 136 PRO CB C 136 32.192 31.990 0.202 1
1 1550 . 6 1 1 A 137 137 VAL H H 137 8.219 7.915 0.304 1
1 1551 . 6 1 1 A 137 137 VAL HA H 137 4.077 4.572 -0.495 1
1 1559 . 6 1 1 A 137 137 VAL C C 137 176.305 174.934 1.371 1
1 1560 . 6 1 1 A 137 137 VAL CA C 137 61.958 60.922 1.036 1
1 1561 . 6 1 1 A 137 137 VAL CB C 137 32.755 33.876 -1.121 1
1 1564 . 6 1 1 A 137 137 VAL N N 137 120.079 117.893 2.186 1
1 1565 . 6 1 1 A 138 138 LYS H H 138 8.444 8.776 -0.332 1
1 1566 . 6 1 1 A 138 138 LYS HA H 138 4.316 4.750 -0.434 1
1 1575 . 6 1 1 A 138 138 LYS C C 138 176.790 176.575 0.215 1
1 1576 . 6 1 1 A 138 138 LYS CA C 138 56.792 55.325 1.467 1
1 1577 . 6 1 1 A 138 138 LYS CB C 138 33.205 33.809 -0.604 1
1 1581 . 6 1 1 A 138 138 LYS N N 138 126.449 126.430 0.019 1
1 1582 . 6 1 1 A 139 139 GLY H H 139 8.518 8.900 -0.382 1
1 1583 . 6 1 1 A 139 139 GLY HA2 H 139 4.070 4.135 -0.065 1
1 1584 . 6 1 1 A 139 139 GLY HA3 H 139 3.897 4.137 -0.240 1
1 1585 . 6 1 1 A 139 139 GLY C C 139 172.874 173.439 -0.565 1
1 1586 . 6 1 1 A 139 139 GLY CA C 139 45.157 45.479 -0.322 1
1 1587 . 6 1 1 A 139 139 GLY N N 139 112.617 115.065 -2.448 1
1 6 . 7 1 1 A 2 2 VAL H H 2 8.992 8.844 0.148 1
1 7 . 7 1 1 A 2 2 VAL HA H 2 5.370 4.926 0.444 1
1 15 . 7 1 1 A 2 2 VAL C C 2 174.325 174.697 -0.372 1
1 16 . 7 1 1 A 2 2 VAL CA C 2 61.267 60.577 0.690 1
1 17 . 7 1 1 A 2 2 VAL CB C 2 33.890 34.491 -0.601 1
1 20 . 7 1 1 A 2 2 VAL N N 2 126.939 120.028 6.911 1
1 21 . 7 1 1 A 3 3 THR H H 3 8.912 9.289 -0.377 1
1 22 . 7 1 1 A 3 3 THR HA H 3 4.505 5.186 -0.681 1
1 27 . 7 1 1 A 3 3 THR C C 3 172.710 173.030 -0.320 1
1 28 . 7 1 1 A 3 3 THR CA C 3 59.689 59.608 0.081 1
1 29 . 7 1 1 A 3 3 THR CB C 3 72.398 71.836 0.562 1
1 31 . 7 1 1 A 3 3 THR N N 3 118.091 122.670 -4.579 1
1 32 . 7 1 1 A 4 4 GLU H H 4 8.631 8.891 -0.260 1
1 33 . 7 1 1 A 4 4 GLU HA H 4 5.788 5.101 0.687 1
1 38 . 7 1 1 A 4 4 GLU C C 4 175.758 174.789 0.969 1
1 39 . 7 1 1 A 4 4 GLU CA C 4 54.902 54.118 0.784 1
1 40 . 7 1 1 A 4 4 GLU CB C 4 35.097 32.805 2.292 1
1 42 . 7 1 1 A 4 4 GLU N N 4 120.966 120.220 0.746 1
1 43 . 7 1 1 A 5 5 THR H H 5 9.188 8.473 0.715 1
1 44 . 7 1 1 A 5 5 THR HA H 5 4.739 4.720 0.019 1
1 49 . 7 1 1 A 5 5 THR C C 5 172.757 172.507 0.250 1
1 50 . 7 1 1 A 5 5 THR CA C 5 60.382 61.359 -0.977 1
1 51 . 7 1 1 A 5 5 THR CB C 5 71.558 71.582 -0.024 1
1 53 . 7 1 1 A 5 5 THR N N 5 119.366 114.036 5.330 1
1 54 . 7 1 1 A 6 6 VAL H H 6 8.476 8.919 -0.443 1
1 55 . 7 1 1 A 6 6 VAL HA H 6 5.026 5.218 -0.192 1
1 63 . 7 1 1 A 6 6 VAL C C 6 176.674 173.899 2.775 1
1 64 . 7 1 1 A 6 6 VAL CA C 6 61.008 58.970 2.038 1
1 65 . 7 1 1 A 6 6 VAL CB C 6 33.861 34.325 -0.464 1
1 68 . 7 1 1 A 6 6 VAL N N 6 121.384 122.913 -1.529 1
1 69 . 7 1 1 A 7 7 ASP H H 7 8.848 9.123 -0.275 1
1 70 . 7 1 1 A 7 7 ASP HA H 7 4.797 5.007 -0.210 1
1 73 . 7 1 1 A 7 7 ASP CA C 7 52.834 53.859 -1.025 1
1 74 . 7 1 1 A 7 7 ASP CB C 7 42.219 42.691 -0.472 1
1 75 . 7 1 1 A 7 7 ASP N N 7 127.061 124.779 2.282 1
1 76 . 7 1 1 A 8 8 GLY C C 8 175.143 175.174 -0.031 1
1 77 . 7 1 1 A 8 8 GLY CA C 8 46.553 47.031 -0.478 1
1 78 . 7 1 1 A 9 9 GLN H H 9 8.408 7.785 0.623 1
1 79 . 7 1 1 A 9 9 GLN HA H 9 4.541 4.263 0.278 1
1 86 . 7 1 1 A 9 9 GLN C C 9 176.463 176.336 0.127 1
1 87 . 7 1 1 A 9 9 GLN CA C 9 55.167 55.419 -0.252 1
1 88 . 7 1 1 A 9 9 GLN CB C 9 29.376 27.884 1.492 1
1 90 . 7 1 1 A 9 9 GLN N N 9 118.300 117.287 1.013 1
1 92 . 7 1 1 A 10 10 GLY H H 10 8.162 8.822 -0.660 1
1 93 . 7 1 1 A 10 10 GLY HA2 H 10 4.174 3.935 0.239 1
1 94 . 7 1 1 A 10 10 GLY HA3 H 10 3.521 3.942 -0.421 1
1 95 . 7 1 1 A 10 10 GLY C C 10 174.092 173.706 0.386 1
1 96 . 7 1 1 A 10 10 GLY CA C 10 45.558 45.991 -0.433 1
1 97 . 7 1 1 A 10 10 GLY N N 10 108.747 111.057 -2.310 1
1 98 . 7 1 1 A 11 11 GLN H H 11 8.507 7.264 1.243 1
1 99 . 7 1 1 A 11 11 GLN HA H 11 4.202 4.952 -0.750 1
1 106 . 7 1 1 A 11 11 GLN C C 11 173.992 174.106 -0.114 1
1 107 . 7 1 1 A 11 11 GLN CA C 11 55.098 53.725 1.373 1
1 108 . 7 1 1 A 11 11 GLN CB C 11 29.097 31.992 -2.895 1
1 110 . 7 1 1 A 11 11 GLN N N 11 122.979 115.497 7.482 1
1 112 . 7 1 1 A 12 12 ALA H H 12 8.259 8.691 -0.432 1
1 113 . 7 1 1 A 12 12 ALA HA H 12 5.156 5.530 -0.374 1
1 117 . 7 1 1 A 12 12 ALA C C 12 177.284 176.517 0.767 1
1 118 . 7 1 1 A 12 12 ALA CA C 12 51.087 50.056 1.031 1
1 119 . 7 1 1 A 12 12 ALA CB C 12 20.500 22.698 -2.198 1
1 120 . 7 1 1 A 12 12 ALA N N 12 127.100 122.755 4.345 1
1 121 . 7 1 1 A 13 13 TRP H H 13 9.245 9.327 -0.082 1
1 122 . 7 1 1 A 13 13 TRP HA H 13 4.717 5.298 -0.581 1
1 131 . 7 1 1 A 13 13 TRP C C 13 175.108 175.106 0.002 1
1 132 . 7 1 1 A 13 13 TRP CA C 13 55.966 55.651 0.315 1
1 133 . 7 1 1 A 13 13 TRP CB C 13 31.912 34.203 -2.291 1
1 139 . 7 1 1 A 13 13 TRP N N 13 123.088 120.134 2.954 1
1 141 . 7 1 1 A 14 14 ARG H H 14 8.575 8.811 -0.236 1
1 142 . 7 1 1 A 14 14 ARG HA H 14 5.335 4.855 0.480 1
1 150 . 7 1 1 A 14 14 ARG C C 14 175.191 174.453 0.738 1
1 151 . 7 1 1 A 14 14 ARG CA C 14 53.106 54.984 -1.878 1
1 152 . 7 1 1 A 14 14 ARG CB C 14 32.749 34.326 -1.577 1
1 154 . 7 1 1 A 14 14 ARG N N 14 121.163 121.252 -0.089 1
1 156 . 7 1 1 A 15 15 HIS H H 15 8.595 9.079 -0.484 1
1 157 . 7 1 1 A 15 15 HIS HA H 15 4.790 4.964 -0.174 1
1 161 . 7 1 1 A 15 15 HIS C C 15 173.770 173.880 -0.110 1
1 162 . 7 1 1 A 15 15 HIS CA C 15 55.289 54.600 0.689 1
1 163 . 7 1 1 A 15 15 HIS CB C 15 33.208 33.793 -0.585 1
1 165 . 7 1 1 A 15 15 HIS N N 15 117.643 120.328 -2.685 1
1 166 . 7 1 1 A 16 16 HIS H H 16 8.993 8.980 0.013 1
1 167 . 7 1 1 A 16 16 HIS HA H 16 5.158 4.925 0.233 1
1 171 . 7 1 1 A 16 16 HIS C C 16 173.608 174.062 -0.454 1
1 172 . 7 1 1 A 16 16 HIS CA C 16 56.450 54.990 1.460 1
1 173 . 7 1 1 A 16 16 HIS CB C 16 34.171 31.725 2.446 1
1 175 . 7 1 1 A 16 16 HIS N N 16 123.520 123.610 -0.090 1
1 176 . 7 1 1 A 17 17 ASN H H 17 7.829 8.874 -1.045 1
1 177 . 7 1 1 A 17 17 ASN HA H 17 4.713 5.195 -0.482 1
1 182 . 7 1 1 A 17 17 ASN C C 17 173.682 175.373 -1.691 1
1 183 . 7 1 1 A 17 17 ASN CA C 17 51.822 51.675 0.147 1
1 184 . 7 1 1 A 17 17 ASN CB C 17 43.176 40.593 2.583 1
1 185 . 7 1 1 A 17 17 ASN N N 17 122.213 124.611 -2.398 1
1 187 . 7 1 1 A 18 18 GLY H H 18 8.423 8.255 0.168 1
1 188 . 7 1 1 A 18 18 GLY HA2 H 18 3.931 3.608 0.323 1
1 189 . 7 1 1 A 18 18 GLY HA3 H 18 3.707 3.861 -0.154 1
1 190 . 7 1 1 A 18 18 GLY C C 18 173.985 172.958 1.027 1
1 191 . 7 1 1 A 18 18 GLY CA C 18 43.949 43.975 -0.026 1
1 192 . 7 1 1 A 18 18 GLY N N 18 106.991 107.557 -0.566 1
1 193 . 7 1 1 A 19 19 PHE H H 19 8.338 8.108 0.230 1
1 194 . 7 1 1 A 19 19 PHE HA H 19 4.068 4.753 -0.685 1
1 197 . 7 1 1 A 19 19 PHE C C 19 176.568 174.733 1.835 1
1 198 . 7 1 1 A 19 19 PHE CA C 19 59.338 57.721 1.617 1
1 199 . 7 1 1 A 19 19 PHE CB C 19 40.201 39.043 1.158 1
1 200 . 7 1 1 A 19 19 PHE N N 19 116.857 118.524 -1.667 1
1 201 . 7 1 1 A 20 20 ASP H H 20 8.794 8.986 -0.192 1
1 202 . 7 1 1 A 20 20 ASP HA H 20 4.485 4.755 -0.270 1
1 205 . 7 1 1 A 20 20 ASP C C 20 177.379 177.261 0.118 1
1 206 . 7 1 1 A 20 20 ASP CA C 20 54.140 54.895 -0.755 1
1 207 . 7 1 1 A 20 20 ASP CB C 20 41.915 40.873 1.042 1
1 208 . 7 1 1 A 20 20 ASP N N 20 123.025 125.663 -2.638 1
1 209 . 7 1 1 A 21 21 PHE H H 21 8.862 9.114 -0.252 1
1 210 . 7 1 1 A 21 21 PHE HA H 21 4.087 4.067 0.020 1
1 218 . 7 1 1 A 21 21 PHE C C 21 176.952 177.263 -0.311 1
1 219 . 7 1 1 A 21 21 PHE CA C 21 61.095 62.453 -1.358 1
1 220 . 7 1 1 A 21 21 PHE CB C 21 38.678 39.480 -0.802 1
1 226 . 7 1 1 A 21 21 PHE N N 21 127.163 125.501 1.662 1
1 227 . 7 1 1 A 22 22 ALA H H 22 8.561 8.324 0.237 1
1 228 . 7 1 1 A 22 22 ALA HA H 22 3.878 3.905 -0.027 1
1 232 . 7 1 1 A 22 22 ALA C C 22 180.710 179.995 0.715 1
1 233 . 7 1 1 A 22 22 ALA CA C 22 55.211 55.144 0.067 1
1 234 . 7 1 1 A 22 22 ALA CB C 22 18.321 18.433 -0.112 1
1 235 . 7 1 1 A 22 22 ALA N N 22 120.293 121.123 -0.830 1
1 236 . 7 1 1 A 23 23 VAL H H 23 7.241 7.956 -0.715 1
1 237 . 7 1 1 A 23 23 VAL HA H 23 3.684 3.519 0.165 1
1 245 . 7 1 1 A 23 23 VAL C C 23 177.101 177.880 -0.779 1
1 246 . 7 1 1 A 23 23 VAL CA C 23 65.237 66.999 -1.762 1
1 247 . 7 1 1 A 23 23 VAL CB C 23 31.780 31.604 0.176 1
1 250 . 7 1 1 A 23 23 VAL N N 23 118.775 117.565 1.210 1
1 251 . 7 1 1 A 24 24 ILE H H 24 6.761 7.945 -1.184 1
1 252 . 7 1 1 A 24 24 ILE HA H 24 3.196 3.526 -0.330 1
1 262 . 7 1 1 A 24 24 ILE C C 24 177.287 178.152 -0.865 1
1 263 . 7 1 1 A 24 24 ILE CA C 24 63.404 65.582 -2.178 1
1 264 . 7 1 1 A 24 24 ILE CB C 24 36.294 37.862 -1.568 1
1 268 . 7 1 1 A 24 24 ILE N N 24 119.036 119.780 -0.744 1
1 269 . 7 1 1 A 25 25 LYS H H 25 8.032 8.237 -0.205 1
1 270 . 7 1 1 A 25 25 LYS HA H 25 3.809 3.664 0.145 1
1 279 . 7 1 1 A 25 25 LYS C C 25 179.450 178.786 0.664 1
1 280 . 7 1 1 A 25 25 LYS CA C 25 59.621 59.487 0.134 1
1 281 . 7 1 1 A 25 25 LYS CB C 25 32.259 31.855 0.404 1
1 285 . 7 1 1 A 25 25 LYS N N 25 118.368 120.332 -1.964 1
1 286 . 7 1 1 A 26 26 GLU H H 26 7.845 8.075 -0.230 1
1 287 . 7 1 1 A 26 26 GLU HA H 26 4.021 4.043 -0.022 1
1 292 . 7 1 1 A 26 26 GLU C C 26 179.191 178.880 0.311 1
1 293 . 7 1 1 A 26 26 GLU CA C 26 59.530 59.069 0.461 1
1 294 . 7 1 1 A 26 26 GLU CB C 26 29.449 29.448 0.001 1
1 296 . 7 1 1 A 26 26 GLU N N 26 120.522 118.919 1.603 1
1 297 . 7 1 1 A 27 27 LEU H H 27 8.165 8.133 0.032 1
1 298 . 7 1 1 A 27 27 LEU HA H 27 4.163 4.104 0.059 1
1 308 . 7 1 1 A 27 27 LEU C C 27 177.256 178.366 -1.110 1
1 309 . 7 1 1 A 27 27 LEU CA C 27 58.049 57.624 0.425 1
1 310 . 7 1 1 A 27 27 LEU CB C 27 41.365 41.439 -0.074 1
1 314 . 7 1 1 A 27 27 LEU N N 27 120.879 120.993 -0.114 1
1 315 . 7 1 1 A 28 28 LYS H H 28 8.902 7.913 0.989 1
1 316 . 7 1 1 A 28 28 LYS HA H 28 4.199 4.217 -0.018 1
1 317 . 7 1 1 A 28 28 LYS C C 28 179.707 179.349 0.358 1
1 318 . 7 1 1 A 28 28 LYS CA C 28 60.097 58.951 1.146 1
1 319 . 7 1 1 A 28 28 LYS CB C 28 33.420 31.681 1.739 1
1 320 . 7 1 1 A 28 28 LYS N N 28 120.050 119.431 0.619 1
1 321 . 7 1 1 A 29 29 THR H H 29 8.294 8.079 0.215 1
1 322 . 7 1 1 A 29 29 THR HA H 29 3.892 3.942 -0.050 1
1 327 . 7 1 1 A 29 29 THR C C 29 175.711 176.159 -0.448 1
1 328 . 7 1 1 A 29 29 THR CA C 29 66.846 66.570 0.276 1
1 329 . 7 1 1 A 29 29 THR CB C 29 68.794 68.831 -0.037 1
1 331 . 7 1 1 A 29 29 THR N N 29 115.933 116.773 -0.840 1
1 332 . 7 1 1 A 30 30 ALA H H 30 8.244 8.613 -0.369 1
1 333 . 7 1 1 A 30 30 ALA HA H 30 4.241 4.254 -0.013 1
1 337 . 7 1 1 A 30 30 ALA C C 30 179.128 179.564 -0.436 1
1 338 . 7 1 1 A 30 30 ALA CA C 30 55.714 55.733 -0.019 1
1 339 . 7 1 1 A 30 30 ALA CB C 30 18.955 18.000 0.955 1
1 340 . 7 1 1 A 30 30 ALA N N 30 124.617 123.134 1.483 1
1 341 . 7 1 1 A 31 31 ALA H H 31 8.968 8.683 0.285 1
1 342 . 7 1 1 A 31 31 ALA HA H 31 3.890 4.096 -0.206 1
1 346 . 7 1 1 A 31 31 ALA C C 31 180.352 179.395 0.957 1
1 347 . 7 1 1 A 31 31 ALA CA C 31 55.454 55.322 0.132 1
1 348 . 7 1 1 A 31 31 ALA CB C 31 17.124 18.292 -1.168 1
1 349 . 7 1 1 A 31 31 ALA N N 31 119.327 120.440 -1.113 1
1 350 . 7 1 1 A 32 32 SER H H 32 7.995 8.029 -0.034 1
1 351 . 7 1 1 A 32 32 SER HA H 32 4.238 4.345 -0.107 1
1 354 . 7 1 1 A 32 32 SER C C 32 175.612 175.937 -0.325 1
1 355 . 7 1 1 A 32 32 SER CA C 32 61.203 61.349 -0.146 1
1 356 . 7 1 1 A 32 32 SER CB C 32 63.406 63.603 -0.197 1
1 357 . 7 1 1 A 32 32 SER N N 32 111.962 114.141 -2.179 1
1 358 . 7 1 1 A 33 33 GLN H H 33 8.333 8.184 0.149 1
1 359 . 7 1 1 A 33 33 GLN HA H 33 3.992 4.218 -0.226 1
1 366 . 7 1 1 A 33 33 GLN C C 33 177.486 176.642 0.844 1
1 367 . 7 1 1 A 33 33 GLN CA C 33 58.277 57.717 0.560 1
1 368 . 7 1 1 A 33 33 GLN CB C 33 29.140 29.291 -0.151 1
1 370 . 7 1 1 A 33 33 GLN N N 33 119.527 120.448 -0.921 1
1 372 . 7 1 1 A 34 34 TYR H H 34 8.587 8.281 0.306 1
1 373 . 7 1 1 A 34 34 TYR HA H 34 4.792 4.726 0.066 1
1 380 . 7 1 1 A 34 34 TYR C C 34 176.499 176.616 -0.117 1
1 381 . 7 1 1 A 34 34 TYR CA C 34 57.711 58.379 -0.668 1
1 382 . 7 1 1 A 34 34 TYR CB C 34 39.561 39.815 -0.254 1
1 387 . 7 1 1 A 34 34 TYR N N 34 114.610 115.173 -0.563 1
1 388 . 7 1 1 A 35 35 GLY H H 35 7.346 8.329 -0.983 1
1 389 . 7 1 1 A 35 35 GLY HA2 H 35 4.785 4.144 0.641 1
1 390 . 7 1 1 A 35 35 GLY HA3 H 35 4.007 4.146 -0.139 1
1 391 . 7 1 1 A 35 35 GLY C C 35 175.796 173.314 2.482 1
1 392 . 7 1 1 A 35 35 GLY CA C 35 44.355 44.798 -0.443 1
1 393 . 7 1 1 A 35 35 GLY N N 35 108.501 106.914 1.587 1
1 394 . 7 1 1 A 36 36 ALA H H 36 9.363 8.319 1.044 1
1 395 . 7 1 1 A 36 36 ALA HA H 36 4.217 4.499 -0.282 1
1 399 . 7 1 1 A 36 36 ALA C C 36 178.039 178.304 -0.265 1
1 400 . 7 1 1 A 36 36 ALA CA C 36 56.114 51.844 4.270 1
1 401 . 7 1 1 A 36 36 ALA CB C 36 19.179 19.909 -0.730 1
1 402 . 7 1 1 A 36 36 ALA N N 36 125.811 123.068 2.743 1
1 403 . 7 1 1 A 37 37 THR H H 37 8.070 8.676 -0.606 1
1 404 . 7 1 1 A 37 37 THR HA H 37 4.570 4.001 0.569 1
1 409 . 7 1 1 A 37 37 THR C C 37 173.685 173.866 -0.181 1
1 410 . 7 1 1 A 37 37 THR CA C 37 59.822 65.503 -5.681 1
1 411 . 7 1 1 A 37 37 THR CB C 37 68.267 66.774 1.493 1
1 413 . 7 1 1 A 37 37 THR N N 37 129.410 109.380 20.030 1
1 414 . 7 1 1 A 38 38 ALA H H 38 6.853 7.845 -0.992 1
1 415 . 7 1 1 A 38 38 ALA HA H 38 4.601 4.603 -0.002 1
1 419 . 7 1 1 A 38 38 ALA CA C 38 50.758 50.617 0.141 1
1 420 . 7 1 1 A 38 38 ALA CB C 38 18.325 19.852 -1.527 1
1 421 . 7 1 1 A 38 38 ALA N N 38 124.674 125.225 -0.551 1
1 422 . 7 1 1 A 40 40 TYR HA H 40 4.032 4.036 -0.004 1
1 429 . 7 1 1 A 40 40 TYR C C 40 176.456 177.461 -1.005 1
1 430 . 7 1 1 A 40 40 TYR CA C 40 61.010 61.722 -0.712 1
1 431 . 7 1 1 A 40 40 TYR CB C 40 39.286 38.624 0.662 1
1 436 . 7 1 1 A 41 41 THR H H 41 6.874 7.969 -1.095 1
1 437 . 7 1 1 A 41 41 THR HA H 41 3.616 3.697 -0.081 1
1 442 . 7 1 1 A 41 41 THR C C 41 176.930 176.524 0.406 1
1 443 . 7 1 1 A 41 41 THR CA C 41 65.557 65.461 0.096 1
1 444 . 7 1 1 A 41 41 THR CB C 41 68.228 69.225 -0.997 1
1 446 . 7 1 1 A 41 41 THR N N 41 115.143 113.836 1.307 1
1 447 . 7 1 1 A 42 42 LEU H H 42 8.623 7.286 1.337 1
1 448 . 7 1 1 A 42 42 LEU HA H 42 3.708 4.017 -0.309 1
1 458 . 7 1 1 A 42 42 LEU C C 42 178.206 179.049 -0.843 1
1 459 . 7 1 1 A 42 42 LEU CA C 42 57.417 57.779 -0.362 1
1 460 . 7 1 1 A 42 42 LEU CB C 42 41.342 41.212 0.130 1
1 464 . 7 1 1 A 42 42 LEU N N 42 120.418 118.730 1.688 1
1 465 . 7 1 1 A 43 43 ALA H H 43 7.735 7.852 -0.117 1
1 466 . 7 1 1 A 43 43 ALA HA H 43 4.020 3.939 0.081 1
1 470 . 7 1 1 A 43 43 ALA C C 43 180.826 180.433 0.393 1
1 471 . 7 1 1 A 43 43 ALA CA C 43 54.925 55.015 -0.090 1
1 472 . 7 1 1 A 43 43 ALA CB C 43 17.506 18.280 -0.774 1
1 473 . 7 1 1 A 43 43 ALA N N 43 120.203 121.769 -1.566 1
1 474 . 7 1 1 A 44 44 ILE H H 44 7.149 7.338 -0.189 1
1 475 . 7 1 1 A 44 44 ILE HA H 44 3.603 3.580 0.023 1
1 485 . 7 1 1 A 44 44 ILE C C 44 178.594 178.265 0.329 1
1 486 . 7 1 1 A 44 44 ILE CA C 44 64.782 64.302 0.480 1
1 487 . 7 1 1 A 44 44 ILE CB C 44 37.472 37.369 0.103 1
1 491 . 7 1 1 A 44 44 ILE N N 44 118.881 119.235 -0.354 1
1 492 . 7 1 1 A 45 45 VAL H H 45 7.968 7.763 0.205 1
1 493 . 7 1 1 A 45 45 VAL HA H 45 2.925 3.299 -0.374 1
1 501 . 7 1 1 A 45 45 VAL C C 45 177.023 177.709 -0.686 1
1 502 . 7 1 1 A 45 45 VAL CA C 45 67.081 66.932 0.149 1
1 503 . 7 1 1 A 45 45 VAL CB C 45 30.854 31.163 -0.309 1
1 506 . 7 1 1 A 45 45 VAL N N 45 120.764 119.646 1.118 1
1 507 . 7 1 1 A 46 46 GLU H H 46 8.399 8.082 0.317 1
1 508 . 7 1 1 A 46 46 GLU HA H 46 3.848 3.949 -0.101 1
1 513 . 7 1 1 A 46 46 GLU C C 46 178.656 178.338 0.318 1
1 514 . 7 1 1 A 46 46 GLU CA C 46 59.491 58.808 0.683 1
1 515 . 7 1 1 A 46 46 GLU CB C 46 28.991 28.852 0.139 1
1 517 . 7 1 1 A 46 46 GLU N N 46 116.599 119.482 -2.883 1
1 518 . 7 1 1 A 47 47 SER H H 47 7.273 7.807 -0.534 1
1 519 . 7 1 1 A 47 47 SER HA H 47 4.287 4.199 0.088 1
1 521 . 7 1 1 A 47 47 SER CA C 47 61.047 62.037 -0.990 1
1 522 . 7 1 1 A 47 47 SER CB C 47 63.016 63.015 0.001 1
1 523 . 7 1 1 A 47 47 SER N N 47 113.609 117.952 -4.343 1
1 524 . 7 1 1 A 48 48 VAL H H 48 8.006 8.087 -0.081 1
1 525 . 7 1 1 A 48 48 VAL HA H 48 3.556 3.614 -0.058 1
1 533 . 7 1 1 A 48 48 VAL C C 48 177.257 177.636 -0.379 1
1 534 . 7 1 1 A 48 48 VAL CA C 48 65.025 66.444 -1.419 1
1 535 . 7 1 1 A 48 48 VAL CB C 48 31.841 31.604 0.237 1
1 538 . 7 1 1 A 48 48 VAL N N 48 122.327 121.459 0.868 1
1 539 . 7 1 1 A 49 49 ALA H H 49 8.369 7.796 0.573 1
1 540 . 7 1 1 A 49 49 ALA HA H 49 4.115 4.215 -0.100 1
1 544 . 7 1 1 A 49 49 ALA C C 49 177.307 177.077 0.230 1
1 545 . 7 1 1 A 49 49 ALA CA C 49 53.253 53.345 -0.092 1
1 546 . 7 1 1 A 49 49 ALA CB C 49 20.131 17.811 2.320 1
1 547 . 7 1 1 A 49 49 ALA N N 49 118.050 120.908 -2.858 1
1 548 . 7 1 1 A 50 50 ASP H H 50 7.052 7.825 -0.773 1
1 549 . 7 1 1 A 50 50 ASP HA H 50 4.788 4.521 0.267 1
1 552 . 7 1 1 A 50 50 ASP C C 50 175.481 175.996 -0.515 1
1 553 . 7 1 1 A 50 50 ASP CA C 50 53.681 55.292 -1.611 1
1 554 . 7 1 1 A 50 50 ASP CB C 50 39.333 41.169 -1.836 1
1 555 . 7 1 1 A 50 50 ASP N N 50 116.997 117.262 -0.265 1
1 556 . 7 1 1 A 51 51 ASN H H 51 8.535 7.724 0.811 1
1 557 . 7 1 1 A 51 51 ASN HA H 51 4.628 4.696 -0.068 1
1 562 . 7 1 1 A 51 51 ASN C C 51 174.077 175.072 -0.995 1
1 563 . 7 1 1 A 51 51 ASN CA C 51 52.315 51.704 0.611 1
1 564 . 7 1 1 A 51 51 ASN CB C 51 41.928 40.974 0.954 1
1 565 . 7 1 1 A 51 51 ASN N N 51 118.626 116.968 1.658 1
1 567 . 7 1 1 A 52 52 TRP H H 52 8.555 8.513 0.042 1
1 574 . 7 1 1 A 52 52 TRP C C 52 173.269 176.661 -3.392 1
1 575 . 7 1 1 A 52 52 TRP CA C 52 55.031 57.910 -2.879 1
1 576 . 7 1 1 A 52 52 TRP CB C 52 26.801 29.477 -2.676 1
1 582 . 7 1 1 A 52 52 TRP N N 52 120.693 120.606 0.087 1
1 584 . 7 1 1 A 53 53 LEU H H 53 7.847 9.328 -1.481 1
1 585 . 7 1 1 A 53 53 LEU HA H 53 4.859 5.213 -0.354 1
1 595 . 7 1 1 A 53 53 LEU C C 53 177.397 176.190 1.207 1
1 596 . 7 1 1 A 53 53 LEU CA C 53 53.619 53.791 -0.172 1
1 597 . 7 1 1 A 53 53 LEU CB C 53 41.812 46.340 -4.528 1
1 601 . 7 1 1 A 53 53 LEU N N 53 124.741 125.502 -0.761 1
1 602 . 7 1 1 A 54 54 THR H H 54 8.850 8.888 -0.038 1
1 603 . 7 1 1 A 54 54 THR HA H 54 4.598 4.573 0.025 1
1 608 . 7 1 1 A 54 54 THR CA C 54 60.531 58.376 2.155 1
1 609 . 7 1 1 A 54 54 THR CB C 54 67.183 69.962 -2.779 1
1 611 . 7 1 1 A 54 54 THR N N 54 113.407 112.480 0.927 1
1 612 . 7 1 1 A 55 55 PRO HA H 55 4.511 4.081 0.430 1
1 619 . 7 1 1 A 55 55 PRO C C 55 179.383 177.949 1.434 1
1 620 . 7 1 1 A 55 55 PRO CA C 55 67.159 65.568 1.591 1
1 621 . 7 1 1 A 55 55 PRO CB C 55 32.095 31.709 0.386 1
1 622 . 7 1 1 A 56 56 THR H H 56 8.575 7.705 0.870 1
1 623 . 7 1 1 A 56 56 THR HA H 56 4.229 4.163 0.066 1
1 628 . 7 1 1 A 56 56 THR C C 56 176.668 176.933 -0.265 1
1 629 . 7 1 1 A 56 56 THR CA C 56 66.943 65.261 1.682 1
1 630 . 7 1 1 A 56 56 THR CB C 56 68.129 68.779 -0.650 1
1 632 . 7 1 1 A 56 56 THR N N 56 114.855 110.653 4.202 1
1 633 . 7 1 1 A 57 57 ASP H H 57 8.730 8.205 0.525 1
1 634 . 7 1 1 A 57 57 ASP HA H 57 4.425 4.751 -0.326 1
1 637 . 7 1 1 A 57 57 ASP C C 57 178.351 179.539 -1.188 1
1 638 . 7 1 1 A 57 57 ASP CA C 57 57.963 57.711 0.252 1
1 639 . 7 1 1 A 57 57 ASP CB C 57 40.134 40.873 -0.739 1
1 640 . 7 1 1 A 57 57 ASP N N 57 126.239 121.985 4.254 1
1 641 . 7 1 1 A 58 58 TRP H H 58 8.244 8.476 -0.232 1
1 642 . 7 1 1 A 58 58 TRP HA H 58 4.030 4.431 -0.401 1
1 650 . 7 1 1 A 58 58 TRP C C 58 177.432 179.358 -1.926 1
1 651 . 7 1 1 A 58 58 TRP CA C 58 62.731 60.214 2.517 1
1 652 . 7 1 1 A 58 58 TRP CB C 58 29.122 29.313 -0.191 1
1 657 . 7 1 1 A 58 58 TRP N N 58 119.241 120.727 -1.486 1
1 659 . 7 1 1 A 59 59 ASN H H 59 8.098 9.087 -0.989 1
1 660 . 7 1 1 A 59 59 ASN HA H 59 4.424 4.473 -0.049 1
1 663 . 7 1 1 A 59 59 ASN C C 59 176.952 177.986 -1.034 1
1 664 . 7 1 1 A 59 59 ASN CA C 59 58.135 56.502 1.633 1
1 665 . 7 1 1 A 59 59 ASN CB C 59 40.168 38.291 1.877 1
1 666 . 7 1 1 A 59 59 ASN N N 59 115.747 118.019 -2.272 1
1 667 . 7 1 1 A 60 60 THR H H 60 8.712 7.915 0.797 1
1 668 . 7 1 1 A 60 60 THR HA H 60 3.717 3.893 -0.176 1
1 673 . 7 1 1 A 60 60 THR C C 60 176.044 176.873 -0.829 1
1 674 . 7 1 1 A 60 60 THR CA C 60 66.576 66.785 -0.209 1
1 675 . 7 1 1 A 60 60 THR CB C 60 69.251 67.404 1.847 1
1 677 . 7 1 1 A 60 60 THR N N 60 114.896 118.066 -3.170 1
1 678 . 7 1 1 A 61 61 LEU H H 61 8.485 8.271 0.214 1
1 679 . 7 1 1 A 61 61 LEU HA H 61 3.391 3.926 -0.535 1
1 689 . 7 1 1 A 61 61 LEU C C 61 177.433 178.930 -1.497 1
1 690 . 7 1 1 A 61 61 LEU CA C 61 58.354 58.442 -0.088 1
1 691 . 7 1 1 A 61 61 LEU CB C 61 41.761 41.933 -0.172 1
1 695 . 7 1 1 A 61 61 LEU N N 61 123.433 121.662 1.771 1
1 696 . 7 1 1 A 62 62 VAL H H 62 8.073 8.156 -0.083 1
1 697 . 7 1 1 A 62 62 VAL HA H 62 3.207 3.522 -0.315 1
1 705 . 7 1 1 A 62 62 VAL C C 62 177.585 177.212 0.373 1
1 706 . 7 1 1 A 62 62 VAL CA C 62 67.345 65.092 2.253 1
1 707 . 7 1 1 A 62 62 VAL CB C 62 30.905 30.603 0.302 1
1 710 . 7 1 1 A 62 62 VAL N N 62 116.018 118.781 -2.763 1
1 711 . 7 1 1 A 63 63 ARG H H 63 7.765 8.114 -0.349 1
1 712 . 7 1 1 A 63 63 ARG HA H 63 3.602 3.992 -0.390 1
1 719 . 7 1 1 A 63 63 ARG C C 63 177.818 178.092 -0.274 1
1 720 . 7 1 1 A 63 63 ARG CA C 63 58.049 58.371 -0.322 1
1 721 . 7 1 1 A 63 63 ARG CB C 63 29.955 29.682 0.273 1
1 724 . 7 1 1 A 63 63 ARG N N 63 116.700 120.699 -3.999 1
1 725 . 7 1 1 A 64 64 ALA H H 64 7.574 7.426 0.148 1
1 726 . 7 1 1 A 64 64 ALA HA H 64 4.158 4.385 -0.227 1
1 730 . 7 1 1 A 64 64 ALA C C 64 179.886 179.195 0.691 1
1 731 . 7 1 1 A 64 64 ALA CA C 64 54.007 53.733 0.274 1
1 732 . 7 1 1 A 64 64 ALA CB C 64 19.147 19.915 -0.768 1
1 733 . 7 1 1 A 64 64 ALA N N 64 117.555 121.384 -3.829 1
1 734 . 7 1 1 A 65 65 VAL H H 65 7.554 7.926 -0.372 1
1 735 . 7 1 1 A 65 65 VAL HA H 65 4.253 3.609 0.644 1
1 743 . 7 1 1 A 65 65 VAL C C 65 174.180 175.863 -1.683 1
1 744 . 7 1 1 A 65 65 VAL CA C 65 62.683 66.811 -4.128 1
1 745 . 7 1 1 A 65 65 VAL CB C 65 33.458 32.111 1.347 1
1 748 . 7 1 1 A 65 65 VAL N N 65 110.013 117.994 -7.981 1
1 749 . 7 1 1 A 66 66 LEU H H 66 7.792 7.050 0.742 1
1 750 . 7 1 1 A 66 66 LEU HA H 66 4.790 4.803 -0.013 1
1 760 . 7 1 1 A 66 66 LEU C C 66 177.537 175.308 2.229 1
1 761 . 7 1 1 A 66 66 LEU CA C 66 52.823 52.665 0.158 1
1 762 . 7 1 1 A 66 66 LEU CB C 66 44.071 45.772 -1.701 1
1 766 . 7 1 1 A 66 66 LEU N N 66 118.967 118.220 0.747 1
1 767 . 7 1 1 A 67 67 SER H H 67 9.208 8.616 0.592 1
1 768 . 7 1 1 A 67 67 SER HA H 67 4.414 5.083 -0.669 1
1 771 . 7 1 1 A 67 67 SER CA C 67 57.943 56.669 1.274 1
1 772 . 7 1 1 A 67 67 SER CB C 67 64.743 66.198 -1.455 1
1 773 . 7 1 1 A 67 67 SER N N 67 116.378 115.564 0.814 1
1 774 . 7 1 1 A 69 69 GLY HA2 H 69 3.916 3.806 0.110 1
1 775 . 7 1 1 A 69 69 GLY HA3 H 69 3.867 3.829 0.038 1
1 776 . 7 1 1 A 69 69 GLY C C 69 176.783 175.556 1.227 1
1 777 . 7 1 1 A 69 69 GLY CA C 69 46.977 46.212 0.765 1
1 778 . 7 1 1 A 70 70 ASP H H 70 7.674 8.126 -0.452 1
1 779 . 7 1 1 A 70 70 ASP HA H 70 4.511 3.764 0.747 1
1 782 . 7 1 1 A 70 70 ASP C C 70 178.096 178.334 -0.238 1
1 783 . 7 1 1 A 70 70 ASP CA C 70 57.262 56.524 0.738 1
1 784 . 7 1 1 A 70 70 ASP CB C 70 40.594 39.720 0.874 1
1 785 . 7 1 1 A 70 70 ASP N N 70 123.930 121.889 2.041 1
1 786 . 7 1 1 A 71 71 HIS H H 71 8.729 7.760 0.969 1
1 787 . 7 1 1 A 71 71 HIS HA H 71 4.235 4.230 0.005 1
1 790 . 7 1 1 A 71 71 HIS C C 71 176.769 176.887 -0.118 1
1 791 . 7 1 1 A 71 71 HIS CA C 71 60.041 59.594 0.447 1
1 792 . 7 1 1 A 71 71 HIS CB C 71 30.682 30.351 0.331 1
1 793 . 7 1 1 A 71 71 HIS N N 71 121.003 119.322 1.681 1
1 794 . 7 1 1 A 72 72 LEU H H 72 7.620 7.969 -0.349 1
1 795 . 7 1 1 A 72 72 LEU HA H 72 3.769 3.952 -0.183 1
1 805 . 7 1 1 A 72 72 LEU C C 72 180.275 178.993 1.282 1
1 806 . 7 1 1 A 72 72 LEU CA C 72 58.192 57.964 0.228 1
1 807 . 7 1 1 A 72 72 LEU CB C 72 41.381 41.292 0.089 1
1 811 . 7 1 1 A 72 72 LEU N N 72 118.569 118.375 0.194 1
1 812 . 7 1 1 A 73 73 LEU H H 73 7.542 7.447 0.095 1
1 813 . 7 1 1 A 73 73 LEU HA H 73 4.107 4.245 -0.138 1
1 823 . 7 1 1 A 73 73 LEU C C 73 179.436 179.234 0.202 1
1 824 . 7 1 1 A 73 73 LEU CA C 73 58.026 57.204 0.822 1
1 825 . 7 1 1 A 73 73 LEU CB C 73 41.638 42.056 -0.418 1
1 829 . 7 1 1 A 73 73 LEU N N 73 121.418 120.259 1.159 1
1 830 . 7 1 1 A 74 74 TRP H H 74 8.786 7.958 0.828 1
1 831 . 7 1 1 A 74 74 TRP HA H 74 3.589 5.235 -1.646 1
1 840 . 7 1 1 A 74 74 TRP C C 74 176.816 178.663 -1.847 1
1 841 . 7 1 1 A 74 74 TRP CA C 74 63.046 59.934 3.112 1
1 842 . 7 1 1 A 74 74 TRP CB C 74 28.065 28.950 -0.885 1
1 848 . 7 1 1 A 74 74 TRP N N 74 121.111 118.214 2.897 1
1 850 . 7 1 1 A 75 75 LYS H H 75 8.939 7.517 1.422 1
1 851 . 7 1 1 A 75 75 LYS HA H 75 3.055 4.096 -1.041 1
1 860 . 7 1 1 A 75 75 LYS C C 75 177.967 179.099 -1.132 1
1 861 . 7 1 1 A 75 75 LYS CA C 75 60.029 58.446 1.583 1
1 862 . 7 1 1 A 75 75 LYS CB C 75 32.533 32.732 -0.199 1
1 866 . 7 1 1 A 75 75 LYS N N 75 119.783 118.488 1.295 1
1 867 . 7 1 1 A 76 76 SER H H 76 7.832 7.807 0.025 1
1 868 . 7 1 1 A 76 76 SER HA H 76 4.040 4.435 -0.395 1
1 871 . 7 1 1 A 76 76 SER C C 76 177.816 177.280 0.536 1
1 872 . 7 1 1 A 76 76 SER CA C 76 62.105 61.393 0.712 1
1 873 . 7 1 1 A 76 76 SER CB C 76 62.679 63.182 -0.503 1
1 874 . 7 1 1 A 76 76 SER N N 76 113.395 114.768 -1.373 1
1 875 . 7 1 1 A 77 77 GLU H H 77 7.590 7.642 -0.052 1
1 876 . 7 1 1 A 77 77 GLU HA H 77 4.042 4.180 -0.138 1
1 881 . 7 1 1 A 77 77 GLU C C 77 177.809 178.765 -0.956 1
1 882 . 7 1 1 A 77 77 GLU CA C 77 58.270 58.947 -0.677 1
1 883 . 7 1 1 A 77 77 GLU CB C 77 29.208 29.532 -0.324 1
1 885 . 7 1 1 A 77 77 GLU N N 77 121.574 122.107 -0.533 1
1 886 . 7 1 1 A 78 78 PHE H H 78 9.081 7.843 1.238 1
1 887 . 7 1 1 A 78 78 PHE HA H 78 3.778 4.295 -0.517 1
1 895 . 7 1 1 A 78 78 PHE C C 78 178.114 177.519 0.595 1
1 896 . 7 1 1 A 78 78 PHE CA C 78 60.629 61.325 -0.696 1
1 897 . 7 1 1 A 78 78 PHE CB C 78 38.295 38.349 -0.054 1
1 902 . 7 1 1 A 78 78 PHE N N 78 122.682 121.612 1.070 1
1 903 . 7 1 1 A 79 79 PHE H H 79 8.890 8.167 0.723 1
1 904 . 7 1 1 A 79 79 PHE HA H 79 3.800 4.124 -0.324 1
1 912 . 7 1 1 A 79 79 PHE C C 79 178.354 178.327 0.027 1
1 913 . 7 1 1 A 79 79 PHE CA C 79 60.704 61.988 -1.284 1
1 914 . 7 1 1 A 79 79 PHE CB C 79 37.184 38.518 -1.334 1
1 920 . 7 1 1 A 79 79 PHE N N 79 121.056 118.157 2.899 1
1 921 . 7 1 1 A 80 80 GLU H H 80 7.793 8.246 -0.453 1
1 922 . 7 1 1 A 80 80 GLU HA H 80 4.082 4.078 0.004 1
1 927 . 7 1 1 A 80 80 GLU C C 80 179.068 178.822 0.246 1
1 928 . 7 1 1 A 80 80 GLU CA C 80 59.735 59.355 0.380 1
1 929 . 7 1 1 A 80 80 GLU CB C 80 28.722 29.293 -0.571 1
1 931 . 7 1 1 A 80 80 GLU N N 80 120.312 118.571 1.741 1
1 932 . 7 1 1 A 81 81 ASN H H 81 8.624 8.949 -0.325 1
1 933 . 7 1 1 A 81 81 ASN HA H 81 4.521 4.442 0.079 1
1 938 . 7 1 1 A 81 81 ASN C C 81 179.262 177.627 1.635 1
1 939 . 7 1 1 A 81 81 ASN CA C 81 55.504 56.051 -0.547 1
1 940 . 7 1 1 A 81 81 ASN CB C 81 37.517 37.436 0.081 1
1 941 . 7 1 1 A 81 81 ASN N N 81 119.338 117.272 2.066 1
1 943 . 7 1 1 A 82 82 CYS H H 82 8.554 7.842 0.712 1
1 944 . 7 1 1 A 82 82 CYS HA H 82 3.792 4.128 -0.336 1
1 947 . 7 1 1 A 82 82 CYS C C 82 176.478 176.990 -0.512 1
1 948 . 7 1 1 A 82 82 CYS CA C 82 65.232 63.588 1.644 1
1 949 . 7 1 1 A 82 82 CYS CB C 82 26.762 27.242 -0.480 1
1 950 . 7 1 1 A 82 82 CYS N N 82 120.576 117.500 3.076 1
1 951 . 7 1 1 A 83 83 ARG H H 83 8.522 7.937 0.585 1
1 952 . 7 1 1 A 83 83 ARG HA H 83 3.932 4.143 -0.211 1
1 960 . 7 1 1 A 83 83 ARG C C 83 179.138 178.560 0.578 1
1 961 . 7 1 1 A 83 83 ARG CA C 83 60.443 58.898 1.545 1
1 962 . 7 1 1 A 83 83 ARG CB C 83 29.550 29.914 -0.364 1
1 965 . 7 1 1 A 83 83 ARG N N 83 123.035 119.646 3.389 1
1 967 . 7 1 1 A 84 84 ASP H H 84 7.791 8.169 -0.378 1
1 968 . 7 1 1 A 84 84 ASP HA H 84 4.353 4.431 -0.078 1
1 971 . 7 1 1 A 84 84 ASP C C 84 178.649 178.576 0.073 1
1 972 . 7 1 1 A 84 84 ASP CA C 84 57.767 57.368 0.399 1
1 973 . 7 1 1 A 84 84 ASP CB C 84 41.305 41.405 -0.100 1
1 974 . 7 1 1 A 84 84 ASP N N 84 120.332 119.641 0.691 1
1 975 . 7 1 1 A 85 85 THR H H 85 8.370 8.056 0.314 1
1 976 . 7 1 1 A 85 85 THR HA H 85 3.730 3.901 -0.171 1
1 981 . 7 1 1 A 85 85 THR C C 85 175.198 176.449 -1.251 1
1 982 . 7 1 1 A 85 85 THR CA C 85 66.830 65.273 1.557 1
1 983 . 7 1 1 A 85 85 THR CB C 85 68.533 68.409 0.124 1
1 985 . 7 1 1 A 85 85 THR N N 85 117.360 116.056 1.304 1
1 986 . 7 1 1 A 86 86 ALA H H 86 8.845 8.213 0.632 1
1 987 . 7 1 1 A 86 86 ALA HA H 86 3.991 4.051 -0.060 1
1 991 . 7 1 1 A 86 86 ALA C C 86 179.980 179.951 0.029 1
1 992 . 7 1 1 A 86 86 ALA CA C 86 55.769 55.616 0.153 1
1 993 . 7 1 1 A 86 86 ALA CB C 86 17.881 18.619 -0.738 1
1 994 . 7 1 1 A 86 86 ALA N N 86 123.613 123.545 0.068 1
1 995 . 7 1 1 A 87 87 LYS H H 87 7.686 8.520 -0.834 1
1 996 . 7 1 1 A 87 87 LYS HA H 87 4.099 4.031 0.068 1
1 1005 . 7 1 1 A 87 87 LYS C C 87 179.592 179.503 0.089 1
1 1006 . 7 1 1 A 87 87 LYS CA C 87 59.708 59.811 -0.103 1
1 1007 . 7 1 1 A 87 87 LYS CB C 87 32.054 32.203 -0.149 1
1 1011 . 7 1 1 A 87 87 LYS N N 87 119.623 117.312 2.311 1
1 1012 . 7 1 1 A 88 88 ARG H H 88 7.683 7.783 -0.100 1
1 1013 . 7 1 1 A 88 88 ARG HA H 88 4.051 4.153 -0.102 1
1 1020 . 7 1 1 A 88 88 ARG C C 88 180.053 178.791 1.262 1
1 1021 . 7 1 1 A 88 88 ARG CA C 88 59.558 58.909 0.649 1
1 1022 . 7 1 1 A 88 88 ARG CB C 88 29.684 29.863 -0.179 1
1 1025 . 7 1 1 A 88 88 ARG N N 88 120.788 119.347 1.441 1
1 1026 . 7 1 1 A 89 89 ASN H H 89 8.973 7.942 1.031 1
1 1027 . 7 1 1 A 89 89 ASN HA H 89 4.354 4.622 -0.268 1
1 1032 . 7 1 1 A 89 89 ASN C C 89 178.382 178.512 -0.130 1
1 1033 . 7 1 1 A 89 89 ASN CA C 89 55.334 55.835 -0.501 1
1 1034 . 7 1 1 A 89 89 ASN CB C 89 37.864 38.288 -0.424 1
1 1035 . 7 1 1 A 89 89 ASN N N 89 121.012 117.819 3.193 1
1 1037 . 7 1 1 A 90 90 GLN H H 90 8.152 8.270 -0.118 1
1 1038 . 7 1 1 A 90 90 GLN HA H 90 4.020 4.120 -0.100 1
1 1045 . 7 1 1 A 90 90 GLN C C 90 179.075 178.923 0.152 1
1 1046 . 7 1 1 A 90 90 GLN CA C 90 59.318 58.711 0.607 1
1 1047 . 7 1 1 A 90 90 GLN CB C 90 28.049 28.616 -0.567 1
1 1049 . 7 1 1 A 90 90 GLN N N 90 122.122 120.979 1.143 1
1 1051 . 7 1 1 A 91 91 GLN H H 91 7.514 8.539 -1.025 1
1 1052 . 7 1 1 A 91 91 GLN HA H 91 4.053 4.137 -0.084 1
1 1059 . 7 1 1 A 91 91 GLN C C 91 177.081 177.578 -0.497 1
1 1060 . 7 1 1 A 91 91 GLN CA C 91 58.031 58.108 -0.077 1
1 1061 . 7 1 1 A 91 91 GLN CB C 91 28.365 27.356 1.009 1
1 1063 . 7 1 1 A 91 91 GLN N N 91 118.124 117.877 0.247 1
1 1065 . 7 1 1 A 92 92 ALA H H 92 7.704 7.454 0.250 1
1 1066 . 7 1 1 A 92 92 ALA HA H 92 4.246 4.343 -0.097 1
1 1070 . 7 1 1 A 92 92 ALA C C 92 178.450 178.061 0.389 1
1 1071 . 7 1 1 A 92 92 ALA CA C 92 52.671 52.891 -0.220 1
1 1072 . 7 1 1 A 92 92 ALA CB C 92 19.316 19.808 -0.492 1
1 1073 . 7 1 1 A 92 92 ALA N N 92 119.880 121.084 -1.204 1
1 1074 . 7 1 1 A 93 93 GLY H H 93 7.693 7.805 -0.112 1
1 1075 . 7 1 1 A 93 93 GLY HA2 H 93 3.941 3.911 0.030 1
1 1076 . 7 1 1 A 93 93 GLY HA3 H 93 3.744 3.922 -0.178 1
1 1077 . 7 1 1 A 93 93 GLY C C 93 174.344 175.120 -0.776 1
1 1078 . 7 1 1 A 93 93 GLY CA C 93 45.949 46.630 -0.681 1
1 1079 . 7 1 1 A 93 93 GLY N N 93 105.347 106.777 -1.430 1
1 1080 . 7 1 1 A 94 94 ASN H H 94 7.076 8.210 -1.134 1
1 1081 . 7 1 1 A 94 94 ASN HA H 94 4.115 4.642 -0.527 1
1 1085 . 7 1 1 A 94 94 ASN C C 94 175.410 175.277 0.133 1
1 1086 . 7 1 1 A 94 94 ASN CA C 94 52.651 53.915 -1.264 1
1 1087 . 7 1 1 A 94 94 ASN CB C 94 38.330 39.205 -0.875 1
1 1088 . 7 1 1 A 94 94 ASN N N 94 115.747 120.311 -4.564 1
1 1090 . 7 1 1 A 95 95 GLY H H 95 8.236 8.046 0.190 1
1 1091 . 7 1 1 A 95 95 GLY HA2 H 95 3.633 3.585 0.048 1
1 1092 . 7 1 1 A 95 95 GLY HA3 H 95 3.633 3.813 -0.180 1
1 1093 . 7 1 1 A 95 95 GLY C C 95 174.450 173.519 0.931 1
1 1094 . 7 1 1 A 95 95 GLY CA C 95 45.522 44.927 0.595 1
1 1095 . 7 1 1 A 95 95 GLY N N 95 109.166 106.198 2.968 1
1 1096 . 7 1 1 A 96 96 TRP H H 96 7.899 7.890 0.009 1
1 1097 . 7 1 1 A 96 96 TRP HA H 96 5.241 5.194 0.047 1
1 1106 . 7 1 1 A 96 96 TRP C C 96 175.661 174.283 1.378 1
1 1107 . 7 1 1 A 96 96 TRP CA C 96 55.090 56.029 -0.939 1
1 1108 . 7 1 1 A 96 96 TRP CB C 96 27.138 33.089 -5.951 1
1 1114 . 7 1 1 A 96 96 TRP N N 96 122.840 120.401 2.439 1
1 1116 . 7 1 1 A 97 97 ASP H H 97 7.344 9.052 -1.708 1
1 1117 . 7 1 1 A 97 97 ASP HA H 97 4.829 5.301 -0.472 1
1 1120 . 7 1 1 A 97 97 ASP C C 97 175.019 177.427 -2.408 1
1 1121 . 7 1 1 A 97 97 ASP CA C 97 52.149 52.832 -0.683 1
1 1122 . 7 1 1 A 97 97 ASP CB C 97 42.697 43.674 -0.977 1
1 1123 . 7 1 1 A 97 97 ASP N N 97 126.861 123.634 3.227 1
1 1124 . 7 1 1 A 98 98 PHE H H 98 8.566 9.544 -0.978 1
1 1125 . 7 1 1 A 98 98 PHE HA H 98 3.727 4.281 -0.554 1
1 1133 . 7 1 1 A 98 98 PHE C C 98 177.443 177.050 0.393 1
1 1134 . 7 1 1 A 98 98 PHE CA C 98 62.471 60.841 1.630 1
1 1135 . 7 1 1 A 98 98 PHE CB C 98 39.919 38.525 1.394 1
1 1141 . 7 1 1 A 98 98 PHE N N 98 117.781 123.218 -5.437 1
1 1142 . 7 1 1 A 99 99 ASP H H 99 8.259 8.405 -0.146 1
1 1143 . 7 1 1 A 99 99 ASP HA H 99 3.960 3.710 0.250 1
1 1146 . 7 1 1 A 99 99 ASP C C 99 178.132 177.508 0.624 1
1 1147 . 7 1 1 A 99 99 ASP CA C 99 57.658 56.769 0.889 1
1 1148 . 7 1 1 A 99 99 ASP CB C 99 38.572 40.282 -1.710 1
1 1149 . 7 1 1 A 99 99 ASP N N 99 121.709 121.565 0.144 1
1 1150 . 7 1 1 A 100 100 MET H H 100 8.008 7.540 0.468 1
1 1151 . 7 1 1 A 100 100 MET HA H 100 3.644 4.343 -0.699 1
1 1156 . 7 1 1 A 100 100 MET C C 100 180.008 176.713 3.295 1
1 1157 . 7 1 1 A 100 100 MET CA C 100 58.598 57.488 1.110 1
1 1158 . 7 1 1 A 100 100 MET CB C 100 33.423 33.514 -0.091 1
1 1160 . 7 1 1 A 100 100 MET N N 100 119.668 116.249 3.419 1
1 1161 . 7 1 1 A 101 101 LEU H H 101 7.961 7.936 0.025 1
1 1162 . 7 1 1 A 101 101 LEU HA H 101 3.523 4.447 -0.924 1
1 1172 . 7 1 1 A 101 101 LEU C C 101 173.873 175.069 -1.196 1
1 1173 . 7 1 1 A 101 101 LEU CA C 101 58.743 53.862 4.881 1
1 1174 . 7 1 1 A 101 101 LEU CB C 101 42.632 41.657 0.975 1
1 1178 . 7 1 1 A 101 101 LEU N N 101 119.752 120.336 -0.584 1
1 1179 . 7 1 1 A 102 102 THR H H 102 6.955 7.781 -0.826 1
1 1180 . 7 1 1 A 102 102 THR HA H 102 4.134 4.705 -0.571 1
1 1185 . 7 1 1 A 102 102 THR C C 102 176.513 173.929 2.584 1
1 1186 . 7 1 1 A 102 102 THR CA C 102 61.125 61.169 -0.044 1
1 1187 . 7 1 1 A 102 102 THR CB C 102 71.415 70.836 0.579 1
1 1189 . 7 1 1 A 102 102 THR N N 102 124.665 116.524 8.141 1
1 1190 . 7 1 1 A 103 103 GLY H H 103 7.816 9.106 -1.290 1
1 1191 . 7 1 1 A 103 103 GLY HA2 H 103 3.824 3.969 -0.145 1
1 1192 . 7 1 1 A 103 103 GLY HA3 H 103 3.824 4.147 -0.323 1
1 1193 . 7 1 1 A 103 103 GLY C C 103 174.126 174.095 0.031 1
1 1194 . 7 1 1 A 103 103 GLY CA C 103 47.805 46.772 1.033 1
1 1195 . 7 1 1 A 103 103 GLY N N 103 114.191 109.781 4.410 1
1 1196 . 7 1 1 A 104 104 SER H H 104 8.860 7.628 1.232 1
1 1197 . 7 1 1 A 104 104 SER HA H 104 4.758 4.998 -0.240 1
1 1200 . 7 1 1 A 104 104 SER C C 104 174.591 173.822 0.769 1
1 1201 . 7 1 1 A 104 104 SER CA C 104 56.755 57.530 -0.775 1
1 1202 . 7 1 1 A 104 104 SER CB C 104 65.050 65.120 -0.070 1
1 1203 . 7 1 1 A 104 104 SER N N 104 114.771 115.272 -0.501 1
1 1204 . 7 1 1 A 105 105 GLY H H 105 8.788 8.460 0.328 1
1 1205 . 7 1 1 A 105 105 GLY HA2 H 105 3.733 4.186 -0.453 1
1 1206 . 7 1 1 A 105 105 GLY HA3 H 105 3.733 4.263 -0.530 1
1 1207 . 7 1 1 A 105 105 GLY CA C 105 47.247 45.719 1.528 1
1 1208 . 7 1 1 A 105 105 GLY N N 105 110.394 111.077 -0.683 1
1 1209 . 7 1 1 A 106 106 ASN HA H 106 4.454 4.562 -0.108 1
1 1212 . 7 1 1 A 106 106 ASN C C 106 175.180 176.249 -1.069 1
1 1213 . 7 1 1 A 106 106 ASN CA C 106 54.492 55.648 -1.156 1
1 1214 . 7 1 1 A 106 106 ASN CB C 106 37.282 39.185 -1.903 1
1 1215 . 7 1 1 A 107 107 TYR H H 107 8.241 7.492 0.749 1
1 1216 . 7 1 1 A 107 107 TYR HA H 107 4.335 4.763 -0.428 1
1 1223 . 7 1 1 A 107 107 TYR C C 107 173.954 177.369 -3.415 1
1 1224 . 7 1 1 A 107 107 TYR CA C 107 57.727 58.056 -0.329 1
1 1225 . 7 1 1 A 107 107 TYR CB C 107 37.063 39.804 -2.741 1
1 1230 . 7 1 1 A 107 107 TYR N N 107 120.708 114.868 5.840 1
1 1231 . 7 1 1 A 108 108 SER H H 108 7.117 7.572 -0.455 1
1 1232 . 7 1 1 A 108 108 SER HA H 108 4.221 4.066 0.155 1
1 1235 . 7 1 1 A 108 108 SER C C 108 174.834 174.923 -0.089 1
1 1236 . 7 1 1 A 108 108 SER CA C 108 59.859 61.983 -2.124 1
1 1237 . 7 1 1 A 108 108 SER CB C 108 63.846 62.719 1.127 1
1 1238 . 7 1 1 A 108 108 SER N N 108 113.362 117.048 -3.686 1
1 1239 . 7 1 1 A 109 109 SER H H 109 8.053 7.741 0.312 1
1 1240 . 7 1 1 A 109 109 SER HA H 109 4.560 4.353 0.207 1
1 1243 . 7 1 1 A 109 109 SER CA C 109 57.141 58.989 -1.848 1
1 1244 . 7 1 1 A 109 109 SER CB C 109 64.874 62.824 2.050 1
1 1245 . 7 1 1 A 109 109 SER N N 109 116.657 115.010 1.647 1
1 1246 . 7 1 1 A 110 110 THR HA H 110 3.541 3.788 -0.247 1
1 1251 . 7 1 1 A 110 110 THR C C 110 175.477 175.689 -0.212 1
1 1252 . 7 1 1 A 110 110 THR CA C 110 66.443 66.052 0.391 1
1 1253 . 7 1 1 A 110 110 THR CB C 110 68.091 68.784 -0.693 1
1 1255 . 7 1 1 A 111 111 ASP H H 111 8.224 8.294 -0.070 1
1 1256 . 7 1 1 A 111 111 ASP HA H 111 4.237 4.316 -0.079 1
1 1259 . 7 1 1 A 111 111 ASP C C 111 177.520 178.443 -0.923 1
1 1260 . 7 1 1 A 111 111 ASP CA C 111 57.559 57.082 0.477 1
1 1261 . 7 1 1 A 111 111 ASP CB C 111 40.292 40.621 -0.329 1
1 1262 . 7 1 1 A 111 111 ASP N N 111 119.490 120.114 -0.624 1
1 1263 . 7 1 1 A 112 112 ALA H H 112 7.431 8.038 -0.607 1
1 1264 . 7 1 1 A 112 112 ALA HA H 112 4.191 4.031 0.160 1
1 1268 . 7 1 1 A 112 112 ALA C C 112 180.646 179.647 0.999 1
1 1269 . 7 1 1 A 112 112 ALA CA C 112 54.534 54.852 -0.318 1
1 1270 . 7 1 1 A 112 112 ALA CB C 112 18.992 18.878 0.114 1
1 1271 . 7 1 1 A 112 112 ALA N N 112 119.710 121.772 -2.062 1
1 1272 . 7 1 1 A 113 113 GLN H H 113 7.576 7.224 0.352 1
1 1273 . 7 1 1 A 113 113 GLN HA H 113 3.562 4.225 -0.663 1
1 1278 . 7 1 1 A 113 113 GLN C C 113 176.756 178.666 -1.910 1
1 1279 . 7 1 1 A 113 113 GLN CA C 113 57.736 58.276 -0.540 1
1 1280 . 7 1 1 A 113 113 GLN CB C 113 29.110 27.882 1.228 1
1 1281 . 7 1 1 A 113 113 GLN N N 113 117.518 117.949 -0.431 1
1 1283 . 7 1 1 A 114 114 MET H H 114 8.192 7.954 0.238 1
1 1284 . 7 1 1 A 114 114 MET HA H 114 4.231 4.169 0.062 1
1 1289 . 7 1 1 A 114 114 MET C C 114 175.648 178.272 -2.624 1
1 1290 . 7 1 1 A 114 114 MET CA C 114 57.446 58.209 -0.763 1
1 1291 . 7 1 1 A 114 114 MET CB C 114 33.570 31.939 1.631 1
1 1293 . 7 1 1 A 114 114 MET N N 114 111.509 119.938 -8.429 1
1 1294 . 7 1 1 A 115 115 GLN H H 115 6.940 7.356 -0.416 1
1 1295 . 7 1 1 A 115 115 GLN HA H 115 4.307 4.226 0.081 1
1 1302 . 7 1 1 A 115 115 GLN C C 115 176.270 175.672 0.598 1
1 1303 . 7 1 1 A 115 115 GLN CA C 115 54.680 55.877 -1.197 1
1 1304 . 7 1 1 A 115 115 GLN CB C 115 28.233 28.874 -0.641 1
1 1306 . 7 1 1 A 115 115 GLN N N 115 114.300 115.478 -1.178 1
1 1308 . 7 1 1 A 116 116 TYR H H 116 6.677 7.934 -1.257 1
1 1309 . 7 1 1 A 116 116 TYR HA H 116 4.193 4.255 -0.062 1
1 1312 . 7 1 1 A 116 116 TYR C C 116 175.268 174.349 0.919 1
1 1313 . 7 1 1 A 116 116 TYR CA C 116 54.357 58.784 -4.427 1
1 1314 . 7 1 1 A 116 116 TYR CB C 116 35.498 36.848 -1.350 1
1 1315 . 7 1 1 A 116 116 TYR N N 116 117.919 118.567 -0.648 1
1 1316 . 7 1 1 A 117 117 ASP H H 117 8.081 8.826 -0.745 1
1 1317 . 7 1 1 A 117 117 ASP HA H 117 4.665 4.940 -0.275 1
1 1320 . 7 1 1 A 117 117 ASP CA C 117 52.422 50.661 1.761 1
1 1321 . 7 1 1 A 117 117 ASP CB C 117 42.416 41.499 0.917 1
1 1322 . 7 1 1 A 117 117 ASP N N 117 120.887 126.093 -5.206 1
1 1323 . 7 1 1 A 118 118 PRO C C 118 179.180 178.384 0.796 1
1 1324 . 7 1 1 A 118 118 PRO CA C 118 65.942 65.643 0.299 1
1 1325 . 7 1 1 A 118 118 PRO CB C 118 32.197 31.744 0.453 1
1 1326 . 7 1 1 A 119 119 GLY H H 119 9.742 7.988 1.754 1
1 1327 . 7 1 1 A 119 119 GLY C C 119 175.622 174.920 0.702 1
1 1328 . 7 1 1 A 119 119 GLY CA C 119 46.785 45.615 1.170 1
1 1329 . 7 1 1 A 119 119 GLY N N 119 106.412 105.685 0.727 1
1 1330 . 7 1 1 A 120 120 LEU H H 120 6.666 6.997 -0.331 1
1 1331 . 7 1 1 A 120 120 LEU HA H 120 3.365 3.582 -0.217 1
1 1341 . 7 1 1 A 120 120 LEU C C 120 179.262 178.359 0.903 1
1 1342 . 7 1 1 A 120 120 LEU CA C 120 56.605 57.083 -0.478 1
1 1343 . 7 1 1 A 120 120 LEU CB C 120 39.262 41.346 -2.084 1
1 1347 . 7 1 1 A 120 120 LEU N N 120 126.226 122.592 3.634 1
1 1348 . 7 1 1 A 121 121 PHE H H 121 7.356 8.454 -1.098 1
1 1349 . 7 1 1 A 121 121 PHE HA H 121 4.459 4.270 0.189 1
1 1352 . 7 1 1 A 121 121 PHE C C 121 179.716 177.077 2.639 1
1 1353 . 7 1 1 A 121 121 PHE CA C 121 62.838 62.048 0.790 1
1 1354 . 7 1 1 A 121 121 PHE CB C 121 37.603 39.447 -1.844 1
1 1355 . 7 1 1 A 121 121 PHE N N 121 117.437 119.468 -2.031 1
1 1356 . 7 1 1 A 122 122 ALA H H 122 7.926 8.000 -0.074 1
1 1357 . 7 1 1 A 122 122 ALA HA H 122 4.523 3.900 0.623 1
1 1361 . 7 1 1 A 122 122 ALA C C 122 180.435 179.377 1.058 1
1 1362 . 7 1 1 A 122 122 ALA CA C 122 55.527 55.264 0.263 1
1 1363 . 7 1 1 A 122 122 ALA CB C 122 17.814 18.210 -0.396 1
1 1364 . 7 1 1 A 122 122 ALA N N 122 121.068 121.340 -0.272 1
1 1365 . 7 1 1 A 123 123 GLN H H 123 7.507 7.563 -0.056 1
1 1366 . 7 1 1 A 123 123 GLN HA H 123 4.153 4.054 0.099 1
1 1371 . 7 1 1 A 123 123 GLN C C 123 180.561 178.822 1.739 1
1 1372 . 7 1 1 A 123 123 GLN CA C 123 59.948 58.520 1.428 1
1 1373 . 7 1 1 A 123 123 GLN CB C 123 29.135 28.291 0.844 1
1 1375 . 7 1 1 A 123 123 GLN N N 123 120.324 117.169 3.155 1
1 1376 . 7 1 1 A 124 124 ILE H H 124 8.318 7.552 0.766 1
1 1377 . 7 1 1 A 124 124 ILE HA H 124 3.635 3.808 -0.173 1
1 1387 . 7 1 1 A 124 124 ILE C C 124 176.481 177.792 -1.311 1
1 1388 . 7 1 1 A 124 124 ILE CA C 124 66.432 64.279 2.153 1
1 1389 . 7 1 1 A 124 124 ILE CB C 124 39.168 37.765 1.403 1
1 1393 . 7 1 1 A 124 124 ILE N N 124 123.747 118.014 5.733 1
1 1394 . 7 1 1 A 125 125 GLN H H 125 8.474 8.135 0.339 1
1 1395 . 7 1 1 A 125 125 GLN HA H 125 4.264 3.909 0.355 1
1 1402 . 7 1 1 A 125 125 GLN C C 125 178.947 177.824 1.123 1
1 1403 . 7 1 1 A 125 125 GLN CA C 125 59.651 58.349 1.302 1
1 1404 . 7 1 1 A 125 125 GLN CB C 125 28.880 27.386 1.494 1
1 1406 . 7 1 1 A 125 125 GLN N N 125 120.368 121.611 -1.243 1
1 1408 . 7 1 1 A 126 126 ALA H H 126 8.002 7.469 0.533 1
1 1409 . 7 1 1 A 126 126 ALA HA H 126 4.144 3.992 0.152 1
1 1413 . 7 1 1 A 126 126 ALA C C 126 179.316 179.522 -0.206 1
1 1414 . 7 1 1 A 126 126 ALA CA C 126 55.036 54.943 0.093 1
1 1415 . 7 1 1 A 126 126 ALA CB C 126 18.087 18.342 -0.255 1
1 1416 . 7 1 1 A 126 126 ALA N N 126 121.661 122.667 -1.006 1
1 1417 . 7 1 1 A 127 127 ALA H H 127 7.823 8.033 -0.210 1
1 1418 . 7 1 1 A 127 127 ALA HA H 127 4.162 3.962 0.200 1
1 1422 . 7 1 1 A 127 127 ALA C C 127 180.707 179.489 1.218 1
1 1423 . 7 1 1 A 127 127 ALA CA C 127 55.080 54.864 0.216 1
1 1424 . 7 1 1 A 127 127 ALA CB C 127 19.354 18.269 1.085 1
1 1425 . 7 1 1 A 127 127 ALA N N 127 119.853 119.900 -0.047 1
1 1426 . 7 1 1 A 128 128 ALA H H 128 8.936 8.152 0.784 1
1 1427 . 7 1 1 A 128 128 ALA HA H 128 3.928 3.950 -0.022 1
1 1431 . 7 1 1 A 128 128 ALA C C 128 181.031 179.267 1.764 1
1 1432 . 7 1 1 A 128 128 ALA CA C 128 55.502 54.684 0.818 1
1 1433 . 7 1 1 A 128 128 ALA CB C 128 16.609 17.808 -1.199 1
1 1434 . 7 1 1 A 128 128 ALA N N 128 121.355 120.381 0.974 1
1 1435 . 7 1 1 A 129 129 THR H H 129 8.543 7.606 0.937 1
1 1436 . 7 1 1 A 129 129 THR HA H 129 4.015 3.635 0.380 1
1 1441 . 7 1 1 A 129 129 THR C C 129 177.332 176.934 0.398 1
1 1442 . 7 1 1 A 129 129 THR CA C 129 65.893 65.414 0.479 1
1 1443 . 7 1 1 A 129 129 THR CB C 129 68.566 68.194 0.372 1
1 1445 . 7 1 1 A 129 129 THR N N 129 112.709 110.928 1.781 1
1 1446 . 7 1 1 A 130 130 LYS H H 130 8.126 7.444 0.682 1
1 1447 . 7 1 1 A 130 130 LYS HA H 130 4.000 4.093 -0.093 1
1 1456 . 7 1 1 A 130 130 LYS C C 130 179.082 178.399 0.683 1
1 1457 . 7 1 1 A 130 130 LYS CA C 130 60.299 58.627 1.672 1
1 1458 . 7 1 1 A 130 130 LYS CB C 130 32.767 31.995 0.772 1
1 1462 . 7 1 1 A 130 130 LYS N N 130 123.879 121.603 2.276 1
1 1463 . 7 1 1 A 131 131 ALA H H 131 7.184 7.737 -0.553 1
1 1464 . 7 1 1 A 131 131 ALA HA H 131 4.005 4.284 -0.279 1
1 1468 . 7 1 1 A 131 131 ALA C C 131 178.482 179.527 -1.045 1
1 1469 . 7 1 1 A 131 131 ALA CA C 131 55.027 55.089 -0.062 1
1 1470 . 7 1 1 A 131 131 ALA CB C 131 18.669 19.625 -0.956 1
1 1471 . 7 1 1 A 131 131 ALA N N 131 118.590 122.193 -3.603 1
1 1472 . 7 1 1 A 132 132 TRP H H 132 7.977 8.703 -0.726 1
1 1473 . 7 1 1 A 132 132 TRP HA H 132 4.001 4.294 -0.293 1
1 1480 . 7 1 1 A 132 132 TRP C C 132 177.332 175.768 1.564 1
1 1481 . 7 1 1 A 132 132 TRP CA C 132 60.431 57.391 3.040 1
1 1482 . 7 1 1 A 132 132 TRP CB C 132 27.786 27.657 0.129 1
1 1486 . 7 1 1 A 132 132 TRP N N 132 119.168 117.002 2.166 1
1 1488 . 7 1 1 A 133 133 ARG H H 133 8.006 7.984 0.022 1
1 1489 . 7 1 1 A 133 133 ARG HA H 133 4.027 4.365 -0.338 1
1 1497 . 7 1 1 A 133 133 ARG C C 133 176.664 178.435 -1.771 1
1 1498 . 7 1 1 A 133 133 ARG CA C 133 59.355 57.415 1.940 1
1 1499 . 7 1 1 A 133 133 ARG CB C 133 30.451 32.071 -1.620 1
1 1502 . 7 1 1 A 133 133 ARG N N 133 113.062 120.728 -7.666 1
1 1504 . 7 1 1 A 134 134 LYS H H 134 7.322 7.717 -0.395 1
1 1505 . 7 1 1 A 134 134 LYS HA H 134 4.313 4.323 -0.010 1
1 1514 . 7 1 1 A 134 134 LYS C C 134 176.282 176.477 -0.195 1
1 1515 . 7 1 1 A 134 134 LYS CA C 134 54.922 57.685 -2.763 1
1 1516 . 7 1 1 A 134 134 LYS CB C 134 32.633 32.130 0.503 1
1 1520 . 7 1 1 A 134 134 LYS N N 134 118.170 119.361 -1.191 1
1 1521 . 7 1 1 A 135 135 LEU H H 135 7.440 8.206 -0.766 1
1 1522 . 7 1 1 A 135 135 LEU HA H 135 4.174 4.486 -0.312 1
1 1532 . 7 1 1 A 135 135 LEU CA C 135 54.408 52.264 2.144 1
1 1533 . 7 1 1 A 135 135 LEU CB C 135 40.407 41.611 -1.204 1
1 1537 . 7 1 1 A 135 135 LEU N N 135 123.358 121.761 1.597 1
1 1538 . 7 1 1 A 136 136 PRO HA H 136 4.437 4.406 0.031 1
1 1545 . 7 1 1 A 136 136 PRO C C 136 177.106 175.952 1.154 1
1 1546 . 7 1 1 A 136 136 PRO CA C 136 62.889 65.250 -2.361 1
1 1547 . 7 1 1 A 136 136 PRO CB C 136 32.192 31.993 0.199 1
1 1550 . 7 1 1 A 137 137 VAL H H 137 8.219 7.419 0.800 1
1 1551 . 7 1 1 A 137 137 VAL HA H 137 4.077 4.656 -0.579 1
1 1559 . 7 1 1 A 137 137 VAL C C 137 176.305 174.895 1.410 1
1 1560 . 7 1 1 A 137 137 VAL CA C 137 61.958 59.351 2.607 1
1 1561 . 7 1 1 A 137 137 VAL CB C 137 32.755 35.072 -2.317 1
1 1564 . 7 1 1 A 137 137 VAL N N 137 120.079 112.211 7.868 1
1 1565 . 7 1 1 A 138 138 LYS H H 138 8.444 8.620 -0.176 1
1 1566 . 7 1 1 A 138 138 LYS HA H 138 4.316 4.553 -0.237 1
1 1575 . 7 1 1 A 138 138 LYS C C 138 176.790 177.699 -0.909 1
1 1576 . 7 1 1 A 138 138 LYS CA C 138 56.792 56.817 -0.025 1
1 1577 . 7 1 1 A 138 138 LYS CB C 138 33.205 34.448 -1.243 1
1 1581 . 7 1 1 A 138 138 LYS N N 138 126.449 120.983 5.466 1
1 1582 . 7 1 1 A 139 139 GLY H H 139 8.518 8.287 0.231 1
1 1583 . 7 1 1 A 139 139 GLY HA2 H 139 4.070 3.955 0.115 1
1 1584 . 7 1 1 A 139 139 GLY HA3 H 139 3.897 3.956 -0.059 1
1 1585 . 7 1 1 A 139 139 GLY C C 139 172.874 173.050 -0.176 1
1 1586 . 7 1 1 A 139 139 GLY CA C 139 45.157 47.288 -2.131 1
1 1587 . 7 1 1 A 139 139 GLY N N 139 112.617 108.092 4.525 1
1 6 . 8 1 1 A 2 2 VAL H H 2 8.992 9.161 -0.169 1
1 7 . 8 1 1 A 2 2 VAL HA H 2 5.370 4.610 0.760 1
1 15 . 8 1 1 A 2 2 VAL C C 2 174.325 176.049 -1.724 1
1 16 . 8 1 1 A 2 2 VAL CA C 2 61.267 61.392 -0.125 1
1 17 . 8 1 1 A 2 2 VAL CB C 2 33.890 33.341 0.549 1
1 20 . 8 1 1 A 2 2 VAL N N 2 126.939 120.795 6.144 1
1 21 . 8 1 1 A 3 3 THR H H 3 8.912 8.857 0.055 1
1 22 . 8 1 1 A 3 3 THR HA H 3 4.505 5.279 -0.774 1
1 27 . 8 1 1 A 3 3 THR C C 3 172.710 174.018 -1.308 1
1 28 . 8 1 1 A 3 3 THR CA C 3 59.689 59.824 -0.135 1
1 29 . 8 1 1 A 3 3 THR CB C 3 72.398 71.350 1.048 1
1 31 . 8 1 1 A 3 3 THR N N 3 118.091 118.692 -0.601 1
1 32 . 8 1 1 A 4 4 GLU H H 4 8.631 9.109 -0.478 1
1 33 . 8 1 1 A 4 4 GLU HA H 4 5.788 5.421 0.367 1
1 38 . 8 1 1 A 4 4 GLU C C 4 175.758 174.615 1.143 1
1 39 . 8 1 1 A 4 4 GLU CA C 4 54.902 54.433 0.469 1
1 40 . 8 1 1 A 4 4 GLU CB C 4 35.097 33.210 1.887 1
1 42 . 8 1 1 A 4 4 GLU N N 4 120.966 118.817 2.149 1
1 43 . 8 1 1 A 5 5 THR H H 5 9.188 8.544 0.644 1
1 44 . 8 1 1 A 5 5 THR HA H 5 4.739 4.861 -0.122 1
1 49 . 8 1 1 A 5 5 THR C C 5 172.757 172.299 0.458 1
1 50 . 8 1 1 A 5 5 THR CA C 5 60.382 60.912 -0.530 1
1 51 . 8 1 1 A 5 5 THR CB C 5 71.558 70.991 0.567 1
1 53 . 8 1 1 A 5 5 THR N N 5 119.366 114.298 5.068 1
1 54 . 8 1 1 A 6 6 VAL H H 6 8.476 8.891 -0.415 1
1 55 . 8 1 1 A 6 6 VAL HA H 6 5.026 5.324 -0.298 1
1 63 . 8 1 1 A 6 6 VAL C C 6 176.674 173.439 3.235 1
1 64 . 8 1 1 A 6 6 VAL CA C 6 61.008 58.865 2.143 1
1 65 . 8 1 1 A 6 6 VAL CB C 6 33.861 35.597 -1.736 1
1 68 . 8 1 1 A 6 6 VAL N N 6 121.384 120.315 1.069 1
1 69 . 8 1 1 A 7 7 ASP H H 7 8.848 9.322 -0.474 1
1 70 . 8 1 1 A 7 7 ASP HA H 7 4.797 5.168 -0.371 1
1 73 . 8 1 1 A 7 7 ASP CA C 7 52.834 52.989 -0.155 1
1 74 . 8 1 1 A 7 7 ASP CB C 7 42.219 43.557 -1.338 1
1 75 . 8 1 1 A 7 7 ASP N N 7 127.061 123.779 3.282 1
1 76 . 8 1 1 A 8 8 GLY C C 8 175.143 175.003 0.140 1
1 77 . 8 1 1 A 8 8 GLY CA C 8 46.553 46.564 -0.011 1
1 78 . 8 1 1 A 9 9 GLN H H 9 8.408 7.236 1.172 1
1 79 . 8 1 1 A 9 9 GLN HA H 9 4.541 4.405 0.136 1
1 86 . 8 1 1 A 9 9 GLN C C 9 176.463 176.219 0.244 1
1 87 . 8 1 1 A 9 9 GLN CA C 9 55.167 55.184 -0.017 1
1 88 . 8 1 1 A 9 9 GLN CB C 9 29.376 29.426 -0.050 1
1 90 . 8 1 1 A 9 9 GLN N N 9 118.300 117.895 0.405 1
1 92 . 8 1 1 A 10 10 GLY H H 10 8.162 8.500 -0.338 1
1 93 . 8 1 1 A 10 10 GLY HA2 H 10 4.174 3.935 0.239 1
1 94 . 8 1 1 A 10 10 GLY HA3 H 10 3.521 3.946 -0.425 1
1 95 . 8 1 1 A 10 10 GLY C C 10 174.092 173.827 0.265 1
1 96 . 8 1 1 A 10 10 GLY CA C 10 45.558 46.113 -0.555 1
1 97 . 8 1 1 A 10 10 GLY N N 10 108.747 108.745 0.002 1
1 98 . 8 1 1 A 11 11 GLN H H 11 8.507 7.383 1.124 1
1 99 . 8 1 1 A 11 11 GLN HA H 11 4.202 4.860 -0.658 1
1 106 . 8 1 1 A 11 11 GLN C C 11 173.992 174.158 -0.166 1
1 107 . 8 1 1 A 11 11 GLN CA C 11 55.098 53.681 1.417 1
1 108 . 8 1 1 A 11 11 GLN CB C 11 29.097 31.861 -2.764 1
1 110 . 8 1 1 A 11 11 GLN N N 11 122.979 115.572 7.407 1
1 112 . 8 1 1 A 12 12 ALA H H 12 8.259 8.741 -0.482 1
1 113 . 8 1 1 A 12 12 ALA HA H 12 5.156 5.707 -0.551 1
1 117 . 8 1 1 A 12 12 ALA C C 12 177.284 176.203 1.081 1
1 118 . 8 1 1 A 12 12 ALA CA C 12 51.087 49.994 1.093 1
1 119 . 8 1 1 A 12 12 ALA CB C 12 20.500 21.716 -1.216 1
1 120 . 8 1 1 A 12 12 ALA N N 12 127.100 123.636 3.464 1
1 121 . 8 1 1 A 13 13 TRP H H 13 9.245 9.549 -0.304 1
1 122 . 8 1 1 A 13 13 TRP HA H 13 4.717 5.339 -0.622 1
1 131 . 8 1 1 A 13 13 TRP C C 13 175.108 175.308 -0.200 1
1 132 . 8 1 1 A 13 13 TRP CA C 13 55.966 56.163 -0.197 1
1 133 . 8 1 1 A 13 13 TRP CB C 13 31.912 33.025 -1.113 1
1 139 . 8 1 1 A 13 13 TRP N N 13 123.088 121.862 1.226 1
1 141 . 8 1 1 A 14 14 ARG H H 14 8.575 8.949 -0.374 1
1 142 . 8 1 1 A 14 14 ARG HA H 14 5.335 5.320 0.015 1
1 150 . 8 1 1 A 14 14 ARG C C 14 175.191 174.636 0.555 1
1 151 . 8 1 1 A 14 14 ARG CA C 14 53.106 54.592 -1.486 1
1 152 . 8 1 1 A 14 14 ARG CB C 14 32.749 34.550 -1.801 1
1 154 . 8 1 1 A 14 14 ARG N N 14 121.163 120.655 0.508 1
1 156 . 8 1 1 A 15 15 HIS H H 15 8.595 9.292 -0.697 1
1 157 . 8 1 1 A 15 15 HIS HA H 15 4.790 5.439 -0.649 1
1 161 . 8 1 1 A 15 15 HIS C C 15 173.770 174.130 -0.360 1
1 162 . 8 1 1 A 15 15 HIS CA C 15 55.289 53.623 1.666 1
1 163 . 8 1 1 A 15 15 HIS CB C 15 33.208 33.167 0.041 1
1 165 . 8 1 1 A 15 15 HIS N N 15 117.643 119.679 -2.036 1
1 166 . 8 1 1 A 16 16 HIS H H 16 8.993 9.215 -0.222 1
1 167 . 8 1 1 A 16 16 HIS HA H 16 5.158 5.024 0.134 1
1 171 . 8 1 1 A 16 16 HIS C C 16 173.608 174.078 -0.470 1
1 172 . 8 1 1 A 16 16 HIS CA C 16 56.450 55.495 0.955 1
1 173 . 8 1 1 A 16 16 HIS CB C 16 34.171 30.885 3.286 1
1 175 . 8 1 1 A 16 16 HIS N N 16 123.520 121.456 2.064 1
1 176 . 8 1 1 A 17 17 ASN H H 17 7.829 8.790 -0.961 1
1 177 . 8 1 1 A 17 17 ASN HA H 17 4.713 5.384 -0.671 1
1 182 . 8 1 1 A 17 17 ASN C C 17 173.682 174.722 -1.040 1
1 183 . 8 1 1 A 17 17 ASN CA C 17 51.822 51.599 0.223 1
1 184 . 8 1 1 A 17 17 ASN CB C 17 43.176 42.955 0.221 1
1 185 . 8 1 1 A 17 17 ASN N N 17 122.213 121.902 0.311 1
1 187 . 8 1 1 A 18 18 GLY H H 18 8.423 8.529 -0.106 1
1 188 . 8 1 1 A 18 18 GLY HA2 H 18 3.931 4.013 -0.082 1
1 189 . 8 1 1 A 18 18 GLY HA3 H 18 3.707 4.137 -0.430 1
1 190 . 8 1 1 A 18 18 GLY C C 18 173.985 172.887 1.098 1
1 191 . 8 1 1 A 18 18 GLY CA C 18 43.949 44.313 -0.364 1
1 192 . 8 1 1 A 18 18 GLY N N 18 106.991 110.609 -3.618 1
1 193 . 8 1 1 A 19 19 PHE H H 19 8.338 8.477 -0.139 1
1 194 . 8 1 1 A 19 19 PHE HA H 19 4.068 4.806 -0.738 1
1 197 . 8 1 1 A 19 19 PHE C C 19 176.568 175.268 1.300 1
1 198 . 8 1 1 A 19 19 PHE CA C 19 59.338 58.274 1.064 1
1 199 . 8 1 1 A 19 19 PHE CB C 19 40.201 39.818 0.383 1
1 200 . 8 1 1 A 19 19 PHE N N 19 116.857 118.723 -1.866 1
1 201 . 8 1 1 A 20 20 ASP H H 20 8.794 9.001 -0.207 1
1 202 . 8 1 1 A 20 20 ASP HA H 20 4.485 4.747 -0.262 1
1 205 . 8 1 1 A 20 20 ASP C C 20 177.379 177.564 -0.185 1
1 206 . 8 1 1 A 20 20 ASP CA C 20 54.140 54.766 -0.626 1
1 207 . 8 1 1 A 20 20 ASP CB C 20 41.915 41.528 0.387 1
1 208 . 8 1 1 A 20 20 ASP N N 20 123.025 124.145 -1.120 1
1 209 . 8 1 1 A 21 21 PHE H H 21 8.862 9.135 -0.273 1
1 210 . 8 1 1 A 21 21 PHE HA H 21 4.087 4.110 -0.023 1
1 218 . 8 1 1 A 21 21 PHE C C 21 176.952 177.244 -0.292 1
1 219 . 8 1 1 A 21 21 PHE CA C 21 61.095 62.479 -1.384 1
1 220 . 8 1 1 A 21 21 PHE CB C 21 38.678 39.356 -0.678 1
1 226 . 8 1 1 A 21 21 PHE N N 21 127.163 124.768 2.395 1
1 227 . 8 1 1 A 22 22 ALA H H 22 8.561 8.347 0.214 1
1 228 . 8 1 1 A 22 22 ALA HA H 22 3.878 3.973 -0.095 1
1 232 . 8 1 1 A 22 22 ALA C C 22 180.710 179.996 0.714 1
1 233 . 8 1 1 A 22 22 ALA CA C 22 55.211 55.181 0.030 1
1 234 . 8 1 1 A 22 22 ALA CB C 22 18.321 18.614 -0.293 1
1 235 . 8 1 1 A 22 22 ALA N N 22 120.293 121.194 -0.901 1
1 236 . 8 1 1 A 23 23 VAL H H 23 7.241 7.748 -0.507 1
1 237 . 8 1 1 A 23 23 VAL HA H 23 3.684 3.476 0.208 1
1 245 . 8 1 1 A 23 23 VAL C C 23 177.101 178.256 -1.155 1
1 246 . 8 1 1 A 23 23 VAL CA C 23 65.237 66.965 -1.728 1
1 247 . 8 1 1 A 23 23 VAL CB C 23 31.780 31.498 0.282 1
1 250 . 8 1 1 A 23 23 VAL N N 23 118.775 117.618 1.157 1
1 251 . 8 1 1 A 24 24 ILE H H 24 6.761 7.901 -1.140 1
1 252 . 8 1 1 A 24 24 ILE HA H 24 3.196 3.363 -0.167 1
1 262 . 8 1 1 A 24 24 ILE C C 24 177.287 177.970 -0.683 1
1 263 . 8 1 1 A 24 24 ILE CA C 24 63.404 65.688 -2.284 1
1 264 . 8 1 1 A 24 24 ILE CB C 24 36.294 37.520 -1.226 1
1 268 . 8 1 1 A 24 24 ILE N N 24 119.036 120.194 -1.158 1
1 269 . 8 1 1 A 25 25 LYS H H 25 8.032 8.127 -0.095 1
1 270 . 8 1 1 A 25 25 LYS HA H 25 3.809 3.561 0.248 1
1 279 . 8 1 1 A 25 25 LYS C C 25 179.450 178.988 0.462 1
1 280 . 8 1 1 A 25 25 LYS CA C 25 59.621 59.470 0.151 1
1 281 . 8 1 1 A 25 25 LYS CB C 25 32.259 31.995 0.264 1
1 285 . 8 1 1 A 25 25 LYS N N 25 118.368 120.392 -2.024 1
1 286 . 8 1 1 A 26 26 GLU H H 26 7.845 7.964 -0.119 1
1 287 . 8 1 1 A 26 26 GLU HA H 26 4.021 4.082 -0.061 1
1 292 . 8 1 1 A 26 26 GLU C C 26 179.191 179.423 -0.232 1
1 293 . 8 1 1 A 26 26 GLU CA C 26 59.530 59.324 0.206 1
1 294 . 8 1 1 A 26 26 GLU CB C 26 29.449 29.027 0.422 1
1 296 . 8 1 1 A 26 26 GLU N N 26 120.522 119.176 1.346 1
1 297 . 8 1 1 A 27 27 LEU H H 27 8.165 8.187 -0.022 1
1 298 . 8 1 1 A 27 27 LEU HA H 27 4.163 4.172 -0.009 1
1 308 . 8 1 1 A 27 27 LEU C C 27 177.256 178.384 -1.128 1
1 309 . 8 1 1 A 27 27 LEU CA C 27 58.049 57.627 0.422 1
1 310 . 8 1 1 A 27 27 LEU CB C 27 41.365 41.670 -0.305 1
1 314 . 8 1 1 A 27 27 LEU N N 27 120.879 122.050 -1.171 1
1 315 . 8 1 1 A 28 28 LYS H H 28 8.902 8.062 0.840 1
1 316 . 8 1 1 A 28 28 LYS HA H 28 4.199 4.471 -0.272 1
1 317 . 8 1 1 A 28 28 LYS C C 28 179.707 179.090 0.617 1
1 318 . 8 1 1 A 28 28 LYS CA C 28 60.097 59.111 0.986 1
1 319 . 8 1 1 A 28 28 LYS CB C 28 33.420 31.917 1.503 1
1 320 . 8 1 1 A 28 28 LYS N N 28 120.050 119.434 0.616 1
1 321 . 8 1 1 A 29 29 THR H H 29 8.294 8.055 0.239 1
1 322 . 8 1 1 A 29 29 THR HA H 29 3.892 3.896 -0.004 1
1 327 . 8 1 1 A 29 29 THR C C 29 175.711 176.384 -0.673 1
1 328 . 8 1 1 A 29 29 THR CA C 29 66.846 66.593 0.253 1
1 329 . 8 1 1 A 29 29 THR CB C 29 68.794 68.661 0.133 1
1 331 . 8 1 1 A 29 29 THR N N 29 115.933 116.618 -0.685 1
1 332 . 8 1 1 A 30 30 ALA H H 30 8.244 8.867 -0.623 1
1 333 . 8 1 1 A 30 30 ALA HA H 30 4.241 4.122 0.119 1
1 337 . 8 1 1 A 30 30 ALA C C 30 179.128 179.635 -0.507 1
1 338 . 8 1 1 A 30 30 ALA CA C 30 55.714 55.670 0.044 1
1 339 . 8 1 1 A 30 30 ALA CB C 30 18.955 18.092 0.863 1
1 340 . 8 1 1 A 30 30 ALA N N 30 124.617 123.012 1.605 1
1 341 . 8 1 1 A 31 31 ALA H H 31 8.968 8.477 0.491 1
1 342 . 8 1 1 A 31 31 ALA HA H 31 3.890 4.025 -0.135 1
1 346 . 8 1 1 A 31 31 ALA C C 31 180.352 179.679 0.673 1
1 347 . 8 1 1 A 31 31 ALA CA C 31 55.454 55.645 -0.191 1
1 348 . 8 1 1 A 31 31 ALA CB C 31 17.124 18.841 -1.717 1
1 349 . 8 1 1 A 31 31 ALA N N 31 119.327 120.208 -0.881 1
1 350 . 8 1 1 A 32 32 SER H H 32 7.995 7.972 0.023 1
1 351 . 8 1 1 A 32 32 SER HA H 32 4.238 4.309 -0.071 1
1 354 . 8 1 1 A 32 32 SER C C 32 175.612 176.572 -0.960 1
1 355 . 8 1 1 A 32 32 SER CA C 32 61.203 60.837 0.366 1
1 356 . 8 1 1 A 32 32 SER CB C 32 63.406 63.023 0.383 1
1 357 . 8 1 1 A 32 32 SER N N 32 111.962 112.519 -0.557 1
1 358 . 8 1 1 A 33 33 GLN H H 33 8.333 7.760 0.573 1
1 359 . 8 1 1 A 33 33 GLN HA H 33 3.992 4.304 -0.312 1
1 366 . 8 1 1 A 33 33 GLN C C 33 177.486 177.423 0.063 1
1 367 . 8 1 1 A 33 33 GLN CA C 33 58.277 58.150 0.127 1
1 368 . 8 1 1 A 33 33 GLN CB C 33 29.140 29.726 -0.586 1
1 370 . 8 1 1 A 33 33 GLN N N 33 119.527 121.172 -1.645 1
1 372 . 8 1 1 A 34 34 TYR H H 34 8.587 8.254 0.333 1
1 373 . 8 1 1 A 34 34 TYR HA H 34 4.792 4.352 0.440 1
1 380 . 8 1 1 A 34 34 TYR C C 34 176.499 176.659 -0.160 1
1 381 . 8 1 1 A 34 34 TYR CA C 34 57.711 60.429 -2.718 1
1 382 . 8 1 1 A 34 34 TYR CB C 34 39.561 38.907 0.654 1
1 387 . 8 1 1 A 34 34 TYR N N 34 114.610 115.699 -1.089 1
1 388 . 8 1 1 A 35 35 GLY H H 35 7.346 8.443 -1.097 1
1 389 . 8 1 1 A 35 35 GLY HA2 H 35 4.785 4.096 0.689 1
1 390 . 8 1 1 A 35 35 GLY HA3 H 35 4.007 4.099 -0.092 1
1 391 . 8 1 1 A 35 35 GLY C C 35 175.796 173.327 2.469 1
1 392 . 8 1 1 A 35 35 GLY CA C 35 44.355 44.744 -0.389 1
1 393 . 8 1 1 A 35 35 GLY N N 35 108.501 105.978 2.523 1
1 394 . 8 1 1 A 36 36 ALA H H 36 9.363 8.576 0.787 1
1 395 . 8 1 1 A 36 36 ALA HA H 36 4.217 4.624 -0.407 1
1 399 . 8 1 1 A 36 36 ALA C C 36 178.039 177.447 0.592 1
1 400 . 8 1 1 A 36 36 ALA CA C 36 56.114 51.614 4.500 1
1 401 . 8 1 1 A 36 36 ALA CB C 36 19.179 18.752 0.427 1
1 402 . 8 1 1 A 36 36 ALA N N 36 125.811 123.202 2.609 1
1 403 . 8 1 1 A 37 37 THR H H 37 8.070 8.259 -0.189 1
1 404 . 8 1 1 A 37 37 THR HA H 37 4.570 4.514 0.056 1
1 409 . 8 1 1 A 37 37 THR C C 37 173.685 174.239 -0.554 1
1 410 . 8 1 1 A 37 37 THR CA C 37 59.822 62.830 -3.008 1
1 411 . 8 1 1 A 37 37 THR CB C 37 68.267 71.716 -3.449 1
1 413 . 8 1 1 A 37 37 THR N N 37 129.410 118.349 11.061 1
1 414 . 8 1 1 A 38 38 ALA H H 38 6.853 7.621 -0.768 1
1 415 . 8 1 1 A 38 38 ALA HA H 38 4.601 4.588 0.013 1
1 419 . 8 1 1 A 38 38 ALA CA C 38 50.758 50.478 0.280 1
1 420 . 8 1 1 A 38 38 ALA CB C 38 18.325 19.841 -1.516 1
1 421 . 8 1 1 A 38 38 ALA N N 38 124.674 124.731 -0.057 1
1 422 . 8 1 1 A 40 40 TYR HA H 40 4.032 4.014 0.018 1
1 429 . 8 1 1 A 40 40 TYR C C 40 176.456 177.310 -0.854 1
1 430 . 8 1 1 A 40 40 TYR CA C 40 61.010 61.910 -0.900 1
1 431 . 8 1 1 A 40 40 TYR CB C 40 39.286 38.556 0.730 1
1 436 . 8 1 1 A 41 41 THR H H 41 6.874 7.888 -1.014 1
1 437 . 8 1 1 A 41 41 THR HA H 41 3.616 3.983 -0.367 1
1 442 . 8 1 1 A 41 41 THR C C 41 176.930 176.717 0.213 1
1 443 . 8 1 1 A 41 41 THR CA C 41 65.557 65.619 -0.062 1
1 444 . 8 1 1 A 41 41 THR CB C 41 68.228 69.033 -0.805 1
1 446 . 8 1 1 A 41 41 THR N N 41 115.143 113.884 1.259 1
1 447 . 8 1 1 A 42 42 LEU H H 42 8.623 7.309 1.314 1
1 448 . 8 1 1 A 42 42 LEU HA H 42 3.708 4.133 -0.425 1
1 458 . 8 1 1 A 42 42 LEU C C 42 178.206 179.132 -0.926 1
1 459 . 8 1 1 A 42 42 LEU CA C 42 57.417 57.612 -0.195 1
1 460 . 8 1 1 A 42 42 LEU CB C 42 41.342 41.268 0.074 1
1 464 . 8 1 1 A 42 42 LEU N N 42 120.418 119.510 0.908 1
1 465 . 8 1 1 A 43 43 ALA H H 43 7.735 8.103 -0.368 1
1 466 . 8 1 1 A 43 43 ALA HA H 43 4.020 3.962 0.058 1
1 470 . 8 1 1 A 43 43 ALA C C 43 180.826 180.568 0.258 1
1 471 . 8 1 1 A 43 43 ALA CA C 43 54.925 55.034 -0.109 1
1 472 . 8 1 1 A 43 43 ALA CB C 43 17.506 18.235 -0.729 1
1 473 . 8 1 1 A 43 43 ALA N N 43 120.203 121.961 -1.758 1
1 474 . 8 1 1 A 44 44 ILE H H 44 7.149 7.364 -0.215 1
1 475 . 8 1 1 A 44 44 ILE HA H 44 3.603 3.561 0.042 1
1 485 . 8 1 1 A 44 44 ILE C C 44 178.594 178.257 0.337 1
1 486 . 8 1 1 A 44 44 ILE CA C 44 64.782 64.550 0.232 1
1 487 . 8 1 1 A 44 44 ILE CB C 44 37.472 37.711 -0.239 1
1 491 . 8 1 1 A 44 44 ILE N N 44 118.881 119.463 -0.582 1
1 492 . 8 1 1 A 45 45 VAL H H 45 7.968 7.787 0.181 1
1 493 . 8 1 1 A 45 45 VAL HA H 45 2.925 3.359 -0.434 1
1 501 . 8 1 1 A 45 45 VAL C C 45 177.023 176.966 0.057 1
1 502 . 8 1 1 A 45 45 VAL CA C 45 67.081 66.920 0.161 1
1 503 . 8 1 1 A 45 45 VAL CB C 45 30.854 31.141 -0.287 1
1 506 . 8 1 1 A 45 45 VAL N N 45 120.764 119.681 1.083 1
1 507 . 8 1 1 A 46 46 GLU H H 46 8.399 8.453 -0.054 1
1 508 . 8 1 1 A 46 46 GLU HA H 46 3.848 3.885 -0.037 1
1 513 . 8 1 1 A 46 46 GLU C C 46 178.656 179.204 -0.548 1
1 514 . 8 1 1 A 46 46 GLU CA C 46 59.491 59.226 0.265 1
1 515 . 8 1 1 A 46 46 GLU CB C 46 28.991 29.088 -0.097 1
1 517 . 8 1 1 A 46 46 GLU N N 46 116.599 119.974 -3.375 1
1 518 . 8 1 1 A 47 47 SER H H 47 7.273 7.827 -0.554 1
1 519 . 8 1 1 A 47 47 SER HA H 47 4.287 4.144 0.143 1
1 521 . 8 1 1 A 47 47 SER CA C 47 61.047 62.095 -1.048 1
1 522 . 8 1 1 A 47 47 SER CB C 47 63.016 63.032 -0.016 1
1 523 . 8 1 1 A 47 47 SER N N 47 113.609 118.009 -4.400 1
1 524 . 8 1 1 A 48 48 VAL H H 48 8.006 7.990 0.016 1
1 525 . 8 1 1 A 48 48 VAL HA H 48 3.556 3.579 -0.023 1
1 533 . 8 1 1 A 48 48 VAL C C 48 177.257 177.887 -0.630 1
1 534 . 8 1 1 A 48 48 VAL CA C 48 65.025 66.448 -1.423 1
1 535 . 8 1 1 A 48 48 VAL CB C 48 31.841 31.489 0.352 1
1 538 . 8 1 1 A 48 48 VAL N N 48 122.327 121.693 0.634 1
1 539 . 8 1 1 A 49 49 ALA H H 49 8.369 8.054 0.315 1
1 540 . 8 1 1 A 49 49 ALA HA H 49 4.115 4.227 -0.112 1
1 544 . 8 1 1 A 49 49 ALA C C 49 177.307 177.950 -0.643 1
1 545 . 8 1 1 A 49 49 ALA CA C 49 53.253 53.384 -0.131 1
1 546 . 8 1 1 A 49 49 ALA CB C 49 20.131 18.291 1.840 1
1 547 . 8 1 1 A 49 49 ALA N N 49 118.050 120.869 -2.819 1
1 548 . 8 1 1 A 50 50 ASP H H 50 7.052 7.829 -0.777 1
1 549 . 8 1 1 A 50 50 ASP HA H 50 4.788 4.471 0.317 1
1 552 . 8 1 1 A 50 50 ASP C C 50 175.481 175.823 -0.342 1
1 553 . 8 1 1 A 50 50 ASP CA C 50 53.681 54.789 -1.108 1
1 554 . 8 1 1 A 50 50 ASP CB C 50 39.333 40.942 -1.609 1
1 555 . 8 1 1 A 50 50 ASP N N 50 116.997 117.478 -0.481 1
1 556 . 8 1 1 A 51 51 ASN H H 51 8.535 7.559 0.976 1
1 557 . 8 1 1 A 51 51 ASN HA H 51 4.628 4.691 -0.063 1
1 562 . 8 1 1 A 51 51 ASN C C 51 174.077 174.599 -0.522 1
1 563 . 8 1 1 A 51 51 ASN CA C 51 52.315 51.680 0.635 1
1 564 . 8 1 1 A 51 51 ASN CB C 51 41.928 39.989 1.939 1
1 565 . 8 1 1 A 51 51 ASN N N 51 118.626 117.324 1.302 1
1 567 . 8 1 1 A 52 52 TRP H H 52 8.555 8.554 0.001 1
1 574 . 8 1 1 A 52 52 TRP C C 52 173.269 176.195 -2.926 1
1 575 . 8 1 1 A 52 52 TRP CA C 52 55.031 56.177 -1.146 1
1 576 . 8 1 1 A 52 52 TRP CB C 52 26.801 30.363 -3.562 1
1 582 . 8 1 1 A 52 52 TRP N N 52 120.693 120.534 0.159 1
1 584 . 8 1 1 A 53 53 LEU H H 53 7.847 8.572 -0.725 1
1 585 . 8 1 1 A 53 53 LEU HA H 53 4.859 4.912 -0.053 1
1 595 . 8 1 1 A 53 53 LEU C C 53 177.397 174.819 2.578 1
1 596 . 8 1 1 A 53 53 LEU CA C 53 53.619 53.090 0.529 1
1 597 . 8 1 1 A 53 53 LEU CB C 53 41.812 45.449 -3.637 1
1 601 . 8 1 1 A 53 53 LEU N N 53 124.741 120.835 3.906 1
1 602 . 8 1 1 A 54 54 THR H H 54 8.850 8.534 0.316 1
1 603 . 8 1 1 A 54 54 THR HA H 54 4.598 4.426 0.172 1
1 608 . 8 1 1 A 54 54 THR CA C 54 60.531 61.327 -0.796 1
1 609 . 8 1 1 A 54 54 THR CB C 54 67.183 68.698 -1.515 1
1 611 . 8 1 1 A 54 54 THR N N 54 113.407 116.967 -3.560 1
1 612 . 8 1 1 A 55 55 PRO HA H 55 4.511 4.696 -0.185 1
1 619 . 8 1 1 A 55 55 PRO C C 55 179.383 178.196 1.187 1
1 620 . 8 1 1 A 55 55 PRO CA C 55 67.159 65.975 1.184 1
1 621 . 8 1 1 A 55 55 PRO CB C 55 32.095 32.092 0.003 1
1 622 . 8 1 1 A 56 56 THR H H 56 8.575 7.837 0.738 1
1 623 . 8 1 1 A 56 56 THR HA H 56 4.229 4.196 0.033 1
1 628 . 8 1 1 A 56 56 THR C C 56 176.668 176.313 0.355 1
1 629 . 8 1 1 A 56 56 THR CA C 56 66.943 65.110 1.833 1
1 630 . 8 1 1 A 56 56 THR CB C 56 68.129 68.786 -0.657 1
1 632 . 8 1 1 A 56 56 THR N N 56 114.855 110.592 4.263 1
1 633 . 8 1 1 A 57 57 ASP H H 57 8.730 8.076 0.654 1
1 634 . 8 1 1 A 57 57 ASP HA H 57 4.425 4.548 -0.123 1
1 637 . 8 1 1 A 57 57 ASP C C 57 178.351 178.555 -0.204 1
1 638 . 8 1 1 A 57 57 ASP CA C 57 57.963 57.344 0.619 1
1 639 . 8 1 1 A 57 57 ASP CB C 57 40.134 40.953 -0.819 1
1 640 . 8 1 1 A 57 57 ASP N N 57 126.239 121.057 5.182 1
1 641 . 8 1 1 A 58 58 TRP H H 58 8.244 8.717 -0.473 1
1 642 . 8 1 1 A 58 58 TRP HA H 58 4.030 4.459 -0.429 1
1 650 . 8 1 1 A 58 58 TRP C C 58 177.432 179.200 -1.768 1
1 651 . 8 1 1 A 58 58 TRP CA C 58 62.731 61.504 1.227 1
1 652 . 8 1 1 A 58 58 TRP CB C 58 29.122 29.808 -0.686 1
1 657 . 8 1 1 A 58 58 TRP N N 58 119.241 121.823 -2.582 1
1 659 . 8 1 1 A 59 59 ASN H H 59 8.098 8.981 -0.883 1
1 660 . 8 1 1 A 59 59 ASN HA H 59 4.424 4.354 0.070 1
1 663 . 8 1 1 A 59 59 ASN C C 59 176.952 177.963 -1.011 1
1 664 . 8 1 1 A 59 59 ASN CA C 59 58.135 56.534 1.601 1
1 665 . 8 1 1 A 59 59 ASN CB C 59 40.168 38.061 2.107 1
1 666 . 8 1 1 A 59 59 ASN N N 59 115.747 117.178 -1.431 1
1 667 . 8 1 1 A 60 60 THR H H 60 8.712 7.945 0.767 1
1 668 . 8 1 1 A 60 60 THR HA H 60 3.717 4.064 -0.347 1
1 673 . 8 1 1 A 60 60 THR C C 60 176.044 176.558 -0.514 1
1 674 . 8 1 1 A 60 60 THR CA C 60 66.576 67.504 -0.928 1
1 675 . 8 1 1 A 60 60 THR CB C 60 69.251 68.008 1.243 1
1 677 . 8 1 1 A 60 60 THR N N 60 114.896 118.324 -3.428 1
1 678 . 8 1 1 A 61 61 LEU H H 61 8.485 8.307 0.178 1
1 679 . 8 1 1 A 61 61 LEU HA H 61 3.391 3.640 -0.249 1
1 689 . 8 1 1 A 61 61 LEU C C 61 177.433 178.648 -1.215 1
1 690 . 8 1 1 A 61 61 LEU CA C 61 58.354 58.544 -0.190 1
1 691 . 8 1 1 A 61 61 LEU CB C 61 41.761 42.241 -0.480 1
1 695 . 8 1 1 A 61 61 LEU N N 61 123.433 121.832 1.601 1
1 696 . 8 1 1 A 62 62 VAL H H 62 8.073 8.162 -0.089 1
1 697 . 8 1 1 A 62 62 VAL HA H 62 3.207 3.798 -0.591 1
1 705 . 8 1 1 A 62 62 VAL C C 62 177.585 177.393 0.192 1
1 706 . 8 1 1 A 62 62 VAL CA C 62 67.345 65.146 2.199 1
1 707 . 8 1 1 A 62 62 VAL CB C 62 30.905 30.754 0.151 1
1 710 . 8 1 1 A 62 62 VAL N N 62 116.018 118.284 -2.266 1
1 711 . 8 1 1 A 63 63 ARG H H 63 7.765 7.956 -0.191 1
1 712 . 8 1 1 A 63 63 ARG HA H 63 3.602 4.053 -0.451 1
1 719 . 8 1 1 A 63 63 ARG C C 63 177.818 178.266 -0.448 1
1 720 . 8 1 1 A 63 63 ARG CA C 63 58.049 57.962 0.087 1
1 721 . 8 1 1 A 63 63 ARG CB C 63 29.955 29.197 0.758 1
1 724 . 8 1 1 A 63 63 ARG N N 63 116.700 120.741 -4.041 1
1 725 . 8 1 1 A 64 64 ALA H H 64 7.574 7.442 0.132 1
1 726 . 8 1 1 A 64 64 ALA HA H 64 4.158 4.345 -0.187 1
1 730 . 8 1 1 A 64 64 ALA C C 64 179.886 179.273 0.613 1
1 731 . 8 1 1 A 64 64 ALA CA C 64 54.007 54.068 -0.061 1
1 732 . 8 1 1 A 64 64 ALA CB C 64 19.147 19.695 -0.548 1
1 733 . 8 1 1 A 64 64 ALA N N 64 117.555 122.106 -4.551 1
1 734 . 8 1 1 A 65 65 VAL H H 65 7.554 7.904 -0.350 1
1 735 . 8 1 1 A 65 65 VAL HA H 65 4.253 3.782 0.471 1
1 743 . 8 1 1 A 65 65 VAL C C 65 174.180 176.380 -2.200 1
1 744 . 8 1 1 A 65 65 VAL CA C 65 62.683 65.484 -2.801 1
1 745 . 8 1 1 A 65 65 VAL CB C 65 33.458 31.353 2.105 1
1 748 . 8 1 1 A 65 65 VAL N N 65 110.013 115.477 -5.464 1
1 749 . 8 1 1 A 66 66 LEU H H 66 7.792 7.331 0.461 1
1 750 . 8 1 1 A 66 66 LEU HA H 66 4.790 4.808 -0.018 1
1 760 . 8 1 1 A 66 66 LEU C C 66 177.537 175.792 1.745 1
1 761 . 8 1 1 A 66 66 LEU CA C 66 52.823 52.700 0.123 1
1 762 . 8 1 1 A 66 66 LEU CB C 66 44.071 45.126 -1.055 1
1 766 . 8 1 1 A 66 66 LEU N N 66 118.967 121.362 -2.395 1
1 767 . 8 1 1 A 67 67 SER H H 67 9.208 8.473 0.735 1
1 768 . 8 1 1 A 67 67 SER HA H 67 4.414 4.771 -0.357 1
1 771 . 8 1 1 A 67 67 SER CA C 67 57.943 57.442 0.501 1
1 772 . 8 1 1 A 67 67 SER CB C 67 64.743 65.221 -0.478 1
1 773 . 8 1 1 A 67 67 SER N N 67 116.378 116.752 -0.374 1
1 774 . 8 1 1 A 69 69 GLY HA2 H 69 3.916 3.747 0.169 1
1 775 . 8 1 1 A 69 69 GLY HA3 H 69 3.867 3.781 0.086 1
1 776 . 8 1 1 A 69 69 GLY C C 69 176.783 175.385 1.398 1
1 777 . 8 1 1 A 69 69 GLY CA C 69 46.977 46.941 0.036 1
1 778 . 8 1 1 A 70 70 ASP H H 70 7.674 8.114 -0.440 1
1 779 . 8 1 1 A 70 70 ASP HA H 70 4.511 3.465 1.046 1
1 782 . 8 1 1 A 70 70 ASP C C 70 178.096 177.898 0.198 1
1 783 . 8 1 1 A 70 70 ASP CA C 70 57.262 56.303 0.959 1
1 784 . 8 1 1 A 70 70 ASP CB C 70 40.594 39.471 1.123 1
1 785 . 8 1 1 A 70 70 ASP N N 70 123.930 121.921 2.009 1
1 786 . 8 1 1 A 71 71 HIS H H 71 8.729 7.980 0.749 1
1 787 . 8 1 1 A 71 71 HIS HA H 71 4.235 4.128 0.107 1
1 790 . 8 1 1 A 71 71 HIS C C 71 176.769 176.716 0.053 1
1 791 . 8 1 1 A 71 71 HIS CA C 71 60.041 59.928 0.113 1
1 792 . 8 1 1 A 71 71 HIS CB C 71 30.682 29.948 0.734 1
1 793 . 8 1 1 A 71 71 HIS N N 71 121.003 119.218 1.785 1
1 794 . 8 1 1 A 72 72 LEU H H 72 7.620 7.985 -0.365 1
1 795 . 8 1 1 A 72 72 LEU HA H 72 3.769 3.979 -0.210 1
1 805 . 8 1 1 A 72 72 LEU C C 72 180.275 179.182 1.093 1
1 806 . 8 1 1 A 72 72 LEU CA C 72 58.192 58.037 0.155 1
1 807 . 8 1 1 A 72 72 LEU CB C 72 41.381 41.400 -0.019 1
1 811 . 8 1 1 A 72 72 LEU N N 72 118.569 118.200 0.369 1
1 812 . 8 1 1 A 73 73 LEU H H 73 7.542 7.660 -0.118 1
1 813 . 8 1 1 A 73 73 LEU HA H 73 4.107 4.129 -0.022 1
1 823 . 8 1 1 A 73 73 LEU C C 73 179.436 179.159 0.277 1
1 824 . 8 1 1 A 73 73 LEU CA C 73 58.026 57.441 0.585 1
1 825 . 8 1 1 A 73 73 LEU CB C 73 41.638 41.983 -0.345 1
1 829 . 8 1 1 A 73 73 LEU N N 73 121.418 120.184 1.234 1
1 830 . 8 1 1 A 74 74 TRP H H 74 8.786 8.029 0.757 1
1 831 . 8 1 1 A 74 74 TRP HA H 74 3.589 5.421 -1.832 1
1 840 . 8 1 1 A 74 74 TRP C C 74 176.816 178.712 -1.896 1
1 841 . 8 1 1 A 74 74 TRP CA C 74 63.046 59.990 3.056 1
1 842 . 8 1 1 A 74 74 TRP CB C 74 28.065 29.139 -1.074 1
1 848 . 8 1 1 A 74 74 TRP N N 74 121.111 118.205 2.906 1
1 850 . 8 1 1 A 75 75 LYS H H 75 8.939 7.676 1.263 1
1 851 . 8 1 1 A 75 75 LYS HA H 75 3.055 4.103 -1.048 1
1 860 . 8 1 1 A 75 75 LYS C C 75 177.967 179.295 -1.328 1
1 861 . 8 1 1 A 75 75 LYS CA C 75 60.029 58.606 1.423 1
1 862 . 8 1 1 A 75 75 LYS CB C 75 32.533 32.676 -0.143 1
1 866 . 8 1 1 A 75 75 LYS N N 75 119.783 118.636 1.147 1
1 867 . 8 1 1 A 76 76 SER H H 76 7.832 7.826 0.006 1
1 868 . 8 1 1 A 76 76 SER HA H 76 4.040 4.388 -0.348 1
1 871 . 8 1 1 A 76 76 SER C C 76 177.816 176.821 0.995 1
1 872 . 8 1 1 A 76 76 SER CA C 76 62.105 61.489 0.616 1
1 873 . 8 1 1 A 76 76 SER CB C 76 62.679 63.153 -0.474 1
1 874 . 8 1 1 A 76 76 SER N N 76 113.395 114.869 -1.474 1
1 875 . 8 1 1 A 77 77 GLU H H 77 7.590 7.658 -0.068 1
1 876 . 8 1 1 A 77 77 GLU HA H 77 4.042 4.379 -0.337 1
1 881 . 8 1 1 A 77 77 GLU C C 77 177.809 178.627 -0.818 1
1 882 . 8 1 1 A 77 77 GLU CA C 77 58.270 58.116 0.154 1
1 883 . 8 1 1 A 77 77 GLU CB C 77 29.208 29.469 -0.261 1
1 885 . 8 1 1 A 77 77 GLU N N 77 121.574 122.013 -0.439 1
1 886 . 8 1 1 A 78 78 PHE H H 78 9.081 7.916 1.165 1
1 887 . 8 1 1 A 78 78 PHE HA H 78 3.778 4.166 -0.388 1
1 895 . 8 1 1 A 78 78 PHE C C 78 178.114 177.209 0.905 1
1 896 . 8 1 1 A 78 78 PHE CA C 78 60.629 61.334 -0.705 1
1 897 . 8 1 1 A 78 78 PHE CB C 78 38.295 38.740 -0.445 1
1 902 . 8 1 1 A 78 78 PHE N N 78 122.682 122.468 0.214 1
1 903 . 8 1 1 A 79 79 PHE H H 79 8.890 7.988 0.902 1
1 904 . 8 1 1 A 79 79 PHE HA H 79 3.800 3.963 -0.163 1
1 912 . 8 1 1 A 79 79 PHE C C 79 178.354 178.390 -0.036 1
1 913 . 8 1 1 A 79 79 PHE CA C 79 60.704 61.809 -1.105 1
1 914 . 8 1 1 A 79 79 PHE CB C 79 37.184 38.310 -1.126 1
1 920 . 8 1 1 A 79 79 PHE N N 79 121.056 118.191 2.865 1
1 921 . 8 1 1 A 80 80 GLU H H 80 7.793 8.265 -0.472 1
1 922 . 8 1 1 A 80 80 GLU HA H 80 4.082 3.914 0.168 1
1 927 . 8 1 1 A 80 80 GLU C C 80 179.068 178.947 0.121 1
1 928 . 8 1 1 A 80 80 GLU CA C 80 59.735 60.000 -0.265 1
1 929 . 8 1 1 A 80 80 GLU CB C 80 28.722 29.389 -0.667 1
1 931 . 8 1 1 A 80 80 GLU N N 80 120.312 118.542 1.770 1
1 932 . 8 1 1 A 81 81 ASN H H 81 8.624 8.516 0.108 1
1 933 . 8 1 1 A 81 81 ASN HA H 81 4.521 4.569 -0.048 1
1 938 . 8 1 1 A 81 81 ASN C C 81 179.262 178.089 1.173 1
1 939 . 8 1 1 A 81 81 ASN CA C 81 55.504 56.313 -0.809 1
1 940 . 8 1 1 A 81 81 ASN CB C 81 37.517 38.916 -1.399 1
1 941 . 8 1 1 A 81 81 ASN N N 81 119.338 118.812 0.526 1
1 943 . 8 1 1 A 82 82 CYS H H 82 8.554 7.877 0.677 1
1 944 . 8 1 1 A 82 82 CYS HA H 82 3.792 4.004 -0.212 1
1 947 . 8 1 1 A 82 82 CYS C C 82 176.478 177.245 -0.767 1
1 948 . 8 1 1 A 82 82 CYS CA C 82 65.232 63.162 2.070 1
1 949 . 8 1 1 A 82 82 CYS CB C 82 26.762 26.930 -0.168 1
1 950 . 8 1 1 A 82 82 CYS N N 82 120.576 118.010 2.566 1
1 951 . 8 1 1 A 83 83 ARG H H 83 8.522 8.263 0.259 1
1 952 . 8 1 1 A 83 83 ARG HA H 83 3.932 4.178 -0.246 1
1 960 . 8 1 1 A 83 83 ARG C C 83 179.138 178.671 0.467 1
1 961 . 8 1 1 A 83 83 ARG CA C 83 60.443 58.882 1.561 1
1 962 . 8 1 1 A 83 83 ARG CB C 83 29.550 29.797 -0.247 1
1 965 . 8 1 1 A 83 83 ARG N N 83 123.035 119.780 3.255 1
1 967 . 8 1 1 A 84 84 ASP H H 84 7.791 8.118 -0.327 1
1 968 . 8 1 1 A 84 84 ASP HA H 84 4.353 4.445 -0.092 1
1 971 . 8 1 1 A 84 84 ASP C C 84 178.649 178.480 0.169 1
1 972 . 8 1 1 A 84 84 ASP CA C 84 57.767 57.492 0.275 1
1 973 . 8 1 1 A 84 84 ASP CB C 84 41.305 41.411 -0.106 1
1 974 . 8 1 1 A 84 84 ASP N N 84 120.332 119.737 0.595 1
1 975 . 8 1 1 A 85 85 THR H H 85 8.370 8.137 0.233 1
1 976 . 8 1 1 A 85 85 THR HA H 85 3.730 3.897 -0.167 1
1 981 . 8 1 1 A 85 85 THR C C 85 175.198 176.324 -1.126 1
1 982 . 8 1 1 A 85 85 THR CA C 85 66.830 65.781 1.049 1
1 983 . 8 1 1 A 85 85 THR CB C 85 68.533 68.493 0.040 1
1 985 . 8 1 1 A 85 85 THR N N 85 117.360 115.692 1.668 1
1 986 . 8 1 1 A 86 86 ALA H H 86 8.845 8.110 0.735 1
1 987 . 8 1 1 A 86 86 ALA HA H 86 3.991 4.055 -0.064 1
1 991 . 8 1 1 A 86 86 ALA C C 86 179.980 179.724 0.256 1
1 992 . 8 1 1 A 86 86 ALA CA C 86 55.769 55.446 0.323 1
1 993 . 8 1 1 A 86 86 ALA CB C 86 17.881 18.183 -0.302 1
1 994 . 8 1 1 A 86 86 ALA N N 86 123.613 123.762 -0.149 1
1 995 . 8 1 1 A 87 87 LYS H H 87 7.686 8.271 -0.585 1
1 996 . 8 1 1 A 87 87 LYS HA H 87 4.099 4.030 0.069 1
1 1005 . 8 1 1 A 87 87 LYS C C 87 179.592 179.379 0.213 1
1 1006 . 8 1 1 A 87 87 LYS CA C 87 59.708 59.736 -0.028 1
1 1007 . 8 1 1 A 87 87 LYS CB C 87 32.054 32.203 -0.149 1
1 1011 . 8 1 1 A 87 87 LYS N N 87 119.623 117.331 2.292 1
1 1012 . 8 1 1 A 88 88 ARG H H 88 7.683 7.630 0.053 1
1 1013 . 8 1 1 A 88 88 ARG HA H 88 4.051 4.155 -0.104 1
1 1020 . 8 1 1 A 88 88 ARG C C 88 180.053 179.123 0.930 1
1 1021 . 8 1 1 A 88 88 ARG CA C 88 59.558 59.074 0.484 1
1 1022 . 8 1 1 A 88 88 ARG CB C 88 29.684 30.056 -0.372 1
1 1025 . 8 1 1 A 88 88 ARG N N 88 120.788 119.547 1.241 1
1 1026 . 8 1 1 A 89 89 ASN H H 89 8.973 8.398 0.575 1
1 1027 . 8 1 1 A 89 89 ASN HA H 89 4.354 4.664 -0.310 1
1 1032 . 8 1 1 A 89 89 ASN C C 89 178.382 178.620 -0.238 1
1 1033 . 8 1 1 A 89 89 ASN CA C 89 55.334 55.822 -0.488 1
1 1034 . 8 1 1 A 89 89 ASN CB C 89 37.864 37.798 0.066 1
1 1035 . 8 1 1 A 89 89 ASN N N 89 121.012 118.080 2.932 1
1 1037 . 8 1 1 A 90 90 GLN H H 90 8.152 8.073 0.079 1
1 1038 . 8 1 1 A 90 90 GLN HA H 90 4.020 4.212 -0.192 1
1 1045 . 8 1 1 A 90 90 GLN C C 90 179.075 178.484 0.591 1
1 1046 . 8 1 1 A 90 90 GLN CA C 90 59.318 58.837 0.481 1
1 1047 . 8 1 1 A 90 90 GLN CB C 90 28.049 28.419 -0.370 1
1 1049 . 8 1 1 A 90 90 GLN N N 90 122.122 121.066 1.056 1
1 1051 . 8 1 1 A 91 91 GLN H H 91 7.514 8.238 -0.724 1
1 1052 . 8 1 1 A 91 91 GLN HA H 91 4.053 4.093 -0.040 1
1 1059 . 8 1 1 A 91 91 GLN C C 91 177.081 177.919 -0.838 1
1 1060 . 8 1 1 A 91 91 GLN CA C 91 58.031 58.735 -0.704 1
1 1061 . 8 1 1 A 91 91 GLN CB C 91 28.365 27.897 0.468 1
1 1063 . 8 1 1 A 91 91 GLN N N 91 118.124 118.345 -0.221 1
1 1065 . 8 1 1 A 92 92 ALA H H 92 7.704 7.473 0.231 1
1 1066 . 8 1 1 A 92 92 ALA HA H 92 4.246 4.315 -0.069 1
1 1070 . 8 1 1 A 92 92 ALA C C 92 178.450 177.973 0.477 1
1 1071 . 8 1 1 A 92 92 ALA CA C 92 52.671 52.376 0.295 1
1 1072 . 8 1 1 A 92 92 ALA CB C 92 19.316 19.511 -0.195 1
1 1073 . 8 1 1 A 92 92 ALA N N 92 119.880 119.699 0.181 1
1 1074 . 8 1 1 A 93 93 GLY H H 93 7.693 7.727 -0.034 1
1 1075 . 8 1 1 A 93 93 GLY HA2 H 93 3.941 3.942 -0.001 1
1 1076 . 8 1 1 A 93 93 GLY HA3 H 93 3.744 3.952 -0.208 1
1 1077 . 8 1 1 A 93 93 GLY C C 93 174.344 174.814 -0.470 1
1 1078 . 8 1 1 A 93 93 GLY CA C 93 45.949 46.710 -0.761 1
1 1079 . 8 1 1 A 93 93 GLY N N 93 105.347 107.799 -2.452 1
1 1080 . 8 1 1 A 94 94 ASN H H 94 7.076 8.384 -1.308 1
1 1081 . 8 1 1 A 94 94 ASN HA H 94 4.115 4.916 -0.801 1
1 1085 . 8 1 1 A 94 94 ASN C C 94 175.410 175.852 -0.442 1
1 1086 . 8 1 1 A 94 94 ASN CA C 94 52.651 52.982 -0.331 1
1 1087 . 8 1 1 A 94 94 ASN CB C 94 38.330 40.308 -1.978 1
1 1088 . 8 1 1 A 94 94 ASN N N 94 115.747 117.541 -1.794 1
1 1090 . 8 1 1 A 95 95 GLY H H 95 8.236 8.247 -0.011 1
1 1091 . 8 1 1 A 95 95 GLY HA2 H 95 3.633 3.216 0.417 1
1 1092 . 8 1 1 A 95 95 GLY HA3 H 95 3.633 3.492 0.141 1
1 1093 . 8 1 1 A 95 95 GLY C C 95 174.450 172.731 1.719 1
1 1094 . 8 1 1 A 95 95 GLY CA C 95 45.522 45.801 -0.279 1
1 1095 . 8 1 1 A 95 95 GLY N N 95 109.166 108.363 0.803 1
1 1096 . 8 1 1 A 96 96 TRP H H 96 7.899 7.408 0.491 1
1 1097 . 8 1 1 A 96 96 TRP HA H 96 5.241 5.314 -0.073 1
1 1106 . 8 1 1 A 96 96 TRP C C 96 175.661 174.453 1.208 1
1 1107 . 8 1 1 A 96 96 TRP CA C 96 55.090 55.856 -0.766 1
1 1108 . 8 1 1 A 96 96 TRP CB C 96 27.138 34.271 -7.133 1
1 1114 . 8 1 1 A 96 96 TRP N N 96 122.840 119.103 3.737 1
1 1116 . 8 1 1 A 97 97 ASP H H 97 7.344 9.099 -1.755 1
1 1117 . 8 1 1 A 97 97 ASP HA H 97 4.829 5.292 -0.463 1
1 1120 . 8 1 1 A 97 97 ASP C C 97 175.019 176.504 -1.485 1
1 1121 . 8 1 1 A 97 97 ASP CA C 97 52.149 53.196 -1.047 1
1 1122 . 8 1 1 A 97 97 ASP CB C 97 42.697 44.929 -2.232 1
1 1123 . 8 1 1 A 97 97 ASP N N 97 126.861 120.889 5.972 1
1 1124 . 8 1 1 A 98 98 PHE H H 98 8.566 9.231 -0.665 1
1 1125 . 8 1 1 A 98 98 PHE HA H 98 3.727 4.394 -0.667 1
1 1133 . 8 1 1 A 98 98 PHE C C 98 177.443 177.096 0.347 1
1 1134 . 8 1 1 A 98 98 PHE CA C 98 62.471 59.885 2.586 1
1 1135 . 8 1 1 A 98 98 PHE CB C 98 39.919 38.080 1.839 1
1 1141 . 8 1 1 A 98 98 PHE N N 98 117.781 122.098 -4.317 1
1 1142 . 8 1 1 A 99 99 ASP H H 99 8.259 8.281 -0.022 1
1 1143 . 8 1 1 A 99 99 ASP HA H 99 3.960 4.193 -0.233 1
1 1146 . 8 1 1 A 99 99 ASP C C 99 178.132 177.895 0.237 1
1 1147 . 8 1 1 A 99 99 ASP CA C 99 57.658 56.925 0.733 1
1 1148 . 8 1 1 A 99 99 ASP CB C 99 38.572 40.763 -2.191 1
1 1149 . 8 1 1 A 99 99 ASP N N 99 121.709 120.734 0.975 1
1 1150 . 8 1 1 A 100 100 MET H H 100 8.008 8.241 -0.233 1
1 1151 . 8 1 1 A 100 100 MET HA H 100 3.644 4.200 -0.556 1
1 1156 . 8 1 1 A 100 100 MET C C 100 180.008 176.154 3.854 1
1 1157 . 8 1 1 A 100 100 MET CA C 100 58.598 57.942 0.656 1
1 1158 . 8 1 1 A 100 100 MET CB C 100 33.423 32.717 0.706 1
1 1160 . 8 1 1 A 100 100 MET N N 100 119.668 116.787 2.881 1
1 1161 . 8 1 1 A 101 101 LEU H H 101 7.961 8.240 -0.279 1
1 1162 . 8 1 1 A 101 101 LEU HA H 101 3.523 4.352 -0.829 1
1 1172 . 8 1 1 A 101 101 LEU C C 101 173.873 176.965 -3.092 1
1 1173 . 8 1 1 A 101 101 LEU CA C 101 58.743 54.400 4.343 1
1 1174 . 8 1 1 A 101 101 LEU CB C 101 42.632 41.184 1.448 1
1 1178 . 8 1 1 A 101 101 LEU N N 101 119.752 120.813 -1.061 1
1 1179 . 8 1 1 A 102 102 THR H H 102 6.955 8.197 -1.242 1
1 1180 . 8 1 1 A 102 102 THR HA H 102 4.134 4.300 -0.166 1
1 1185 . 8 1 1 A 102 102 THR C C 102 176.513 174.941 1.572 1
1 1186 . 8 1 1 A 102 102 THR CA C 102 61.125 62.688 -1.563 1
1 1187 . 8 1 1 A 102 102 THR CB C 102 71.415 70.995 0.420 1
1 1189 . 8 1 1 A 102 102 THR N N 102 124.665 117.624 7.041 1
1 1190 . 8 1 1 A 103 103 GLY H H 103 7.816 8.189 -0.373 1
1 1191 . 8 1 1 A 103 103 GLY HA2 H 103 3.824 4.023 -0.199 1
1 1192 . 8 1 1 A 103 103 GLY HA3 H 103 3.824 4.136 -0.312 1
1 1193 . 8 1 1 A 103 103 GLY C C 103 174.126 173.814 0.312 1
1 1194 . 8 1 1 A 103 103 GLY CA C 103 47.805 46.630 1.175 1
1 1195 . 8 1 1 A 103 103 GLY N N 103 114.191 110.524 3.667 1
1 1196 . 8 1 1 A 104 104 SER H H 104 8.860 8.037 0.823 1
1 1197 . 8 1 1 A 104 104 SER HA H 104 4.758 5.127 -0.369 1
1 1200 . 8 1 1 A 104 104 SER C C 104 174.591 173.104 1.487 1
1 1201 . 8 1 1 A 104 104 SER CA C 104 56.755 57.260 -0.505 1
1 1202 . 8 1 1 A 104 104 SER CB C 104 65.050 65.922 -0.872 1
1 1203 . 8 1 1 A 104 104 SER N N 104 114.771 114.750 0.021 1
1 1204 . 8 1 1 A 105 105 GLY H H 105 8.788 8.256 0.532 1
1 1205 . 8 1 1 A 105 105 GLY HA2 H 105 3.733 4.056 -0.323 1
1 1206 . 8 1 1 A 105 105 GLY HA3 H 105 3.733 4.181 -0.448 1
1 1207 . 8 1 1 A 105 105 GLY CA C 105 47.247 45.587 1.660 1
1 1208 . 8 1 1 A 105 105 GLY N N 105 110.394 113.887 -3.493 1
1 1209 . 8 1 1 A 106 106 ASN HA H 106 4.454 4.827 -0.373 1
1 1212 . 8 1 1 A 106 106 ASN C C 106 175.180 176.273 -1.093 1
1 1213 . 8 1 1 A 106 106 ASN CA C 106 54.492 54.207 0.285 1
1 1214 . 8 1 1 A 106 106 ASN CB C 106 37.282 40.989 -3.707 1
1 1215 . 8 1 1 A 107 107 TYR H H 107 8.241 7.308 0.933 1
1 1216 . 8 1 1 A 107 107 TYR HA H 107 4.335 4.891 -0.556 1
1 1223 . 8 1 1 A 107 107 TYR C C 107 173.954 176.839 -2.885 1
1 1224 . 8 1 1 A 107 107 TYR CA C 107 57.727 57.237 0.490 1
1 1225 . 8 1 1 A 107 107 TYR CB C 107 37.063 39.407 -2.344 1
1 1230 . 8 1 1 A 107 107 TYR N N 107 120.708 114.995 5.713 1
1 1231 . 8 1 1 A 108 108 SER H H 108 7.117 7.582 -0.465 1
1 1232 . 8 1 1 A 108 108 SER HA H 108 4.221 4.068 0.153 1
1 1235 . 8 1 1 A 108 108 SER C C 108 174.834 174.082 0.752 1
1 1236 . 8 1 1 A 108 108 SER CA C 108 59.859 60.746 -0.887 1
1 1237 . 8 1 1 A 108 108 SER CB C 108 63.846 62.934 0.912 1
1 1238 . 8 1 1 A 108 108 SER N N 108 113.362 117.103 -3.741 1
1 1239 . 8 1 1 A 109 109 SER H H 109 8.053 8.153 -0.100 1
1 1240 . 8 1 1 A 109 109 SER HA H 109 4.560 4.423 0.137 1
1 1243 . 8 1 1 A 109 109 SER CA C 109 57.141 59.737 -2.596 1
1 1244 . 8 1 1 A 109 109 SER CB C 109 64.874 62.811 2.063 1
1 1245 . 8 1 1 A 109 109 SER N N 109 116.657 115.389 1.268 1
1 1246 . 8 1 1 A 110 110 THR HA H 110 3.541 4.215 -0.674 1
1 1251 . 8 1 1 A 110 110 THR C C 110 175.477 176.007 -0.530 1
1 1252 . 8 1 1 A 110 110 THR CA C 110 66.443 64.427 2.016 1
1 1253 . 8 1 1 A 110 110 THR CB C 110 68.091 69.259 -1.168 1
1 1255 . 8 1 1 A 111 111 ASP H H 111 8.224 8.005 0.219 1
1 1256 . 8 1 1 A 111 111 ASP HA H 111 4.237 4.326 -0.089 1
1 1259 . 8 1 1 A 111 111 ASP C C 111 177.520 178.272 -0.752 1
1 1260 . 8 1 1 A 111 111 ASP CA C 111 57.559 57.480 0.079 1
1 1261 . 8 1 1 A 111 111 ASP CB C 111 40.292 41.496 -1.204 1
1 1262 . 8 1 1 A 111 111 ASP N N 111 119.490 121.898 -2.408 1
1 1263 . 8 1 1 A 112 112 ALA H H 112 7.431 8.446 -1.015 1
1 1264 . 8 1 1 A 112 112 ALA HA H 112 4.191 4.146 0.045 1
1 1268 . 8 1 1 A 112 112 ALA C C 112 180.646 179.827 0.819 1
1 1269 . 8 1 1 A 112 112 ALA CA C 112 54.534 54.526 0.008 1
1 1270 . 8 1 1 A 112 112 ALA CB C 112 18.992 18.294 0.698 1
1 1271 . 8 1 1 A 112 112 ALA N N 112 119.710 121.710 -2.000 1
1 1272 . 8 1 1 A 113 113 GLN H H 113 7.576 7.891 -0.315 1
1 1273 . 8 1 1 A 113 113 GLN HA H 113 3.562 4.204 -0.642 1
1 1278 . 8 1 1 A 113 113 GLN C C 113 176.756 178.101 -1.345 1
1 1279 . 8 1 1 A 113 113 GLN CA C 113 57.736 58.661 -0.925 1
1 1280 . 8 1 1 A 113 113 GLN CB C 113 29.110 28.432 0.678 1
1 1281 . 8 1 1 A 113 113 GLN N N 113 117.518 118.352 -0.834 1
1 1283 . 8 1 1 A 114 114 MET H H 114 8.192 8.259 -0.067 1
1 1284 . 8 1 1 A 114 114 MET HA H 114 4.231 4.281 -0.050 1
1 1289 . 8 1 1 A 114 114 MET C C 114 175.648 177.136 -1.488 1
1 1290 . 8 1 1 A 114 114 MET CA C 114 57.446 57.586 -0.140 1
1 1291 . 8 1 1 A 114 114 MET CB C 114 33.570 32.932 0.638 1
1 1293 . 8 1 1 A 114 114 MET N N 114 111.509 119.715 -8.206 1
1 1294 . 8 1 1 A 115 115 GLN H H 115 6.940 7.477 -0.537 1
1 1295 . 8 1 1 A 115 115 GLN HA H 115 4.307 4.538 -0.231 1
1 1302 . 8 1 1 A 115 115 GLN C C 115 176.270 176.045 0.225 1
1 1303 . 8 1 1 A 115 115 GLN CA C 115 54.680 54.866 -0.186 1
1 1304 . 8 1 1 A 115 115 GLN CB C 115 28.233 29.209 -0.976 1
1 1306 . 8 1 1 A 115 115 GLN N N 115 114.300 116.859 -2.559 1
1 1308 . 8 1 1 A 116 116 TYR H H 116 6.677 7.916 -1.239 1
1 1309 . 8 1 1 A 116 116 TYR HA H 116 4.193 4.471 -0.278 1
1 1312 . 8 1 1 A 116 116 TYR C C 116 175.268 175.255 0.013 1
1 1313 . 8 1 1 A 116 116 TYR CA C 116 54.357 61.105 -6.748 1
1 1314 . 8 1 1 A 116 116 TYR CB C 116 35.498 37.877 -2.379 1
1 1315 . 8 1 1 A 116 116 TYR N N 116 117.919 120.400 -2.481 1
1 1316 . 8 1 1 A 117 117 ASP H H 117 8.081 7.282 0.799 1
1 1317 . 8 1 1 A 117 117 ASP HA H 117 4.665 4.550 0.115 1
1 1320 . 8 1 1 A 117 117 ASP CA C 117 52.422 56.086 -3.664 1
1 1321 . 8 1 1 A 117 117 ASP CB C 117 42.416 39.822 2.594 1
1 1322 . 8 1 1 A 117 117 ASP N N 117 120.887 116.395 4.492 1
1 1323 . 8 1 1 A 118 118 PRO C C 118 179.180 178.243 0.937 1
1 1324 . 8 1 1 A 118 118 PRO CA C 118 65.942 64.841 1.101 1
1 1325 . 8 1 1 A 118 118 PRO CB C 118 32.197 32.038 0.159 1
1 1326 . 8 1 1 A 119 119 GLY H H 119 9.742 8.316 1.426 1
1 1327 . 8 1 1 A 119 119 GLY C C 119 175.622 175.012 0.610 1
1 1328 . 8 1 1 A 119 119 GLY CA C 119 46.785 46.080 0.705 1
1 1329 . 8 1 1 A 119 119 GLY N N 119 106.412 106.416 -0.004 1
1 1330 . 8 1 1 A 120 120 LEU H H 120 6.666 7.609 -0.943 1
1 1331 . 8 1 1 A 120 120 LEU HA H 120 3.365 3.653 -0.288 1
1 1341 . 8 1 1 A 120 120 LEU C C 120 179.262 178.372 0.890 1
1 1342 . 8 1 1 A 120 120 LEU CA C 120 56.605 56.620 -0.015 1
1 1343 . 8 1 1 A 120 120 LEU CB C 120 39.262 41.278 -2.016 1
1 1347 . 8 1 1 A 120 120 LEU N N 120 126.226 122.276 3.950 1
1 1348 . 8 1 1 A 121 121 PHE H H 121 7.356 8.314 -0.958 1
1 1349 . 8 1 1 A 121 121 PHE HA H 121 4.459 3.941 0.518 1
1 1352 . 8 1 1 A 121 121 PHE C C 121 179.716 177.381 2.335 1
1 1353 . 8 1 1 A 121 121 PHE CA C 121 62.838 62.184 0.654 1
1 1354 . 8 1 1 A 121 121 PHE CB C 121 37.603 39.245 -1.642 1
1 1355 . 8 1 1 A 121 121 PHE N N 121 117.437 119.284 -1.847 1
1 1356 . 8 1 1 A 122 122 ALA H H 122 7.926 8.005 -0.079 1
1 1357 . 8 1 1 A 122 122 ALA HA H 122 4.523 3.746 0.777 1
1 1361 . 8 1 1 A 122 122 ALA C C 122 180.435 179.472 0.963 1
1 1362 . 8 1 1 A 122 122 ALA CA C 122 55.527 55.103 0.424 1
1 1363 . 8 1 1 A 122 122 ALA CB C 122 17.814 18.126 -0.312 1
1 1364 . 8 1 1 A 122 122 ALA N N 122 121.068 120.818 0.250 1
1 1365 . 8 1 1 A 123 123 GLN H H 123 7.507 7.468 0.039 1
1 1366 . 8 1 1 A 123 123 GLN HA H 123 4.153 3.920 0.233 1
1 1371 . 8 1 1 A 123 123 GLN C C 123 180.561 178.914 1.647 1
1 1372 . 8 1 1 A 123 123 GLN CA C 123 59.948 58.912 1.036 1
1 1373 . 8 1 1 A 123 123 GLN CB C 123 29.135 28.302 0.833 1
1 1375 . 8 1 1 A 123 123 GLN N N 123 120.324 117.804 2.520 1
1 1376 . 8 1 1 A 124 124 ILE H H 124 8.318 8.120 0.198 1
1 1377 . 8 1 1 A 124 124 ILE HA H 124 3.635 3.824 -0.189 1
1 1387 . 8 1 1 A 124 124 ILE C C 124 176.481 178.036 -1.555 1
1 1388 . 8 1 1 A 124 124 ILE CA C 124 66.432 64.079 2.353 1
1 1389 . 8 1 1 A 124 124 ILE CB C 124 39.168 37.702 1.466 1
1 1393 . 8 1 1 A 124 124 ILE N N 124 123.747 118.218 5.529 1
1 1394 . 8 1 1 A 125 125 GLN H H 125 8.474 8.142 0.332 1
1 1395 . 8 1 1 A 125 125 GLN HA H 125 4.264 3.927 0.337 1
1 1402 . 8 1 1 A 125 125 GLN C C 125 178.947 177.737 1.210 1
1 1403 . 8 1 1 A 125 125 GLN CA C 125 59.651 58.491 1.160 1
1 1404 . 8 1 1 A 125 125 GLN CB C 125 28.880 28.398 0.482 1
1 1406 . 8 1 1 A 125 125 GLN N N 125 120.368 121.115 -0.747 1
1 1408 . 8 1 1 A 126 126 ALA H H 126 8.002 7.715 0.287 1
1 1409 . 8 1 1 A 126 126 ALA HA H 126 4.144 4.037 0.107 1
1 1413 . 8 1 1 A 126 126 ALA C C 126 179.316 179.859 -0.543 1
1 1414 . 8 1 1 A 126 126 ALA CA C 126 55.036 54.743 0.293 1
1 1415 . 8 1 1 A 126 126 ALA CB C 126 18.087 18.010 0.077 1
1 1416 . 8 1 1 A 126 126 ALA N N 126 121.661 121.542 0.119 1
1 1417 . 8 1 1 A 127 127 ALA H H 127 7.823 8.072 -0.249 1
1 1418 . 8 1 1 A 127 127 ALA HA H 127 4.162 4.008 0.154 1
1 1422 . 8 1 1 A 127 127 ALA C C 127 180.707 179.439 1.268 1
1 1423 . 8 1 1 A 127 127 ALA CA C 127 55.080 54.962 0.118 1
1 1424 . 8 1 1 A 127 127 ALA CB C 127 19.354 18.587 0.767 1
1 1425 . 8 1 1 A 127 127 ALA N N 127 119.853 120.195 -0.342 1
1 1426 . 8 1 1 A 128 128 ALA H H 128 8.936 8.074 0.862 1
1 1427 . 8 1 1 A 128 128 ALA HA H 128 3.928 3.955 -0.027 1
1 1431 . 8 1 1 A 128 128 ALA C C 128 181.031 179.496 1.535 1
1 1432 . 8 1 1 A 128 128 ALA CA C 128 55.502 54.764 0.738 1
1 1433 . 8 1 1 A 128 128 ALA CB C 128 16.609 18.222 -1.613 1
1 1434 . 8 1 1 A 128 128 ALA N N 128 121.355 120.491 0.864 1
1 1435 . 8 1 1 A 129 129 THR H H 129 8.543 7.803 0.740 1
1 1436 . 8 1 1 A 129 129 THR HA H 129 4.015 3.668 0.347 1
1 1441 . 8 1 1 A 129 129 THR C C 129 177.332 176.269 1.063 1
1 1442 . 8 1 1 A 129 129 THR CA C 129 65.893 65.107 0.786 1
1 1443 . 8 1 1 A 129 129 THR CB C 129 68.566 68.582 -0.016 1
1 1445 . 8 1 1 A 129 129 THR N N 129 112.709 112.323 0.386 1
1 1446 . 8 1 1 A 130 130 LYS H H 130 8.126 7.421 0.705 1
1 1447 . 8 1 1 A 130 130 LYS HA H 130 4.000 3.967 0.033 1
1 1456 . 8 1 1 A 130 130 LYS C C 130 179.082 178.453 0.629 1
1 1457 . 8 1 1 A 130 130 LYS CA C 130 60.299 59.369 0.930 1
1 1458 . 8 1 1 A 130 130 LYS CB C 130 32.767 32.309 0.458 1
1 1462 . 8 1 1 A 130 130 LYS N N 130 123.879 120.401 3.478 1
1 1463 . 8 1 1 A 131 131 ALA H H 131 7.184 7.771 -0.587 1
1 1464 . 8 1 1 A 131 131 ALA HA H 131 4.005 4.188 -0.183 1
1 1468 . 8 1 1 A 131 131 ALA C C 131 178.482 179.484 -1.002 1
1 1469 . 8 1 1 A 131 131 ALA CA C 131 55.027 55.292 -0.265 1
1 1470 . 8 1 1 A 131 131 ALA CB C 131 18.669 18.868 -0.199 1
1 1471 . 8 1 1 A 131 131 ALA N N 131 118.590 120.968 -2.378 1
1 1472 . 8 1 1 A 132 132 TRP H H 132 7.977 8.617 -0.640 1
1 1473 . 8 1 1 A 132 132 TRP HA H 132 4.001 4.127 -0.126 1
1 1480 . 8 1 1 A 132 132 TRP C C 132 177.332 175.789 1.543 1
1 1481 . 8 1 1 A 132 132 TRP CA C 132 60.431 57.350 3.081 1
1 1482 . 8 1 1 A 132 132 TRP CB C 132 27.786 27.662 0.124 1
1 1486 . 8 1 1 A 132 132 TRP N N 132 119.168 116.919 2.249 1
1 1488 . 8 1 1 A 133 133 ARG H H 133 8.006 8.017 -0.011 1
1 1489 . 8 1 1 A 133 133 ARG HA H 133 4.027 4.436 -0.409 1
1 1497 . 8 1 1 A 133 133 ARG C C 133 176.664 178.126 -1.462 1
1 1498 . 8 1 1 A 133 133 ARG CA C 133 59.355 57.069 2.286 1
1 1499 . 8 1 1 A 133 133 ARG CB C 133 30.451 32.426 -1.975 1
1 1502 . 8 1 1 A 133 133 ARG N N 133 113.062 120.674 -7.612 1
1 1504 . 8 1 1 A 134 134 LYS H H 134 7.322 7.982 -0.660 1
1 1505 . 8 1 1 A 134 134 LYS HA H 134 4.313 4.247 0.066 1
1 1514 . 8 1 1 A 134 134 LYS C C 134 176.282 176.320 -0.038 1
1 1515 . 8 1 1 A 134 134 LYS CA C 134 54.922 57.286 -2.364 1
1 1516 . 8 1 1 A 134 134 LYS CB C 134 32.633 31.817 0.816 1
1 1520 . 8 1 1 A 134 134 LYS N N 134 118.170 116.567 1.603 1
1 1521 . 8 1 1 A 135 135 LEU H H 135 7.440 7.997 -0.557 1
1 1522 . 8 1 1 A 135 135 LEU HA H 135 4.174 4.455 -0.281 1
1 1532 . 8 1 1 A 135 135 LEU CA C 135 54.408 53.074 1.334 1
1 1533 . 8 1 1 A 135 135 LEU CB C 135 40.407 41.755 -1.348 1
1 1537 . 8 1 1 A 135 135 LEU N N 135 123.358 123.272 0.086 1
1 1538 . 8 1 1 A 136 136 PRO HA H 136 4.437 4.543 -0.106 1
1 1545 . 8 1 1 A 136 136 PRO C C 136 177.106 177.194 -0.088 1
1 1546 . 8 1 1 A 136 136 PRO CA C 136 62.889 62.623 0.266 1
1 1547 . 8 1 1 A 136 136 PRO CB C 136 32.192 32.615 -0.423 1
1 1550 . 8 1 1 A 137 137 VAL H H 137 8.219 8.853 -0.634 1
1 1551 . 8 1 1 A 137 137 VAL HA H 137 4.077 4.009 0.068 1
1 1559 . 8 1 1 A 137 137 VAL C C 137 176.305 175.464 0.841 1
1 1560 . 8 1 1 A 137 137 VAL CA C 137 61.958 65.233 -3.275 1
1 1561 . 8 1 1 A 137 137 VAL CB C 137 32.755 31.082 1.673 1
1 1564 . 8 1 1 A 137 137 VAL N N 137 120.079 121.844 -1.765 1
1 1565 . 8 1 1 A 138 138 LYS H H 138 8.444 8.976 -0.532 1
1 1566 . 8 1 1 A 138 138 LYS HA H 138 4.316 4.621 -0.305 1
1 1575 . 8 1 1 A 138 138 LYS C C 138 176.790 176.269 0.521 1
1 1576 . 8 1 1 A 138 138 LYS CA C 138 56.792 57.473 -0.681 1
1 1577 . 8 1 1 A 138 138 LYS CB C 138 33.205 35.191 -1.986 1
1 1581 . 8 1 1 A 138 138 LYS N N 138 126.449 119.585 6.864 1
1 1582 . 8 1 1 A 139 139 GLY H H 139 8.518 7.625 0.893 1
1 1583 . 8 1 1 A 139 139 GLY HA2 H 139 4.070 4.064 0.006 1
1 1584 . 8 1 1 A 139 139 GLY HA3 H 139 3.897 4.086 -0.189 1
1 1585 . 8 1 1 A 139 139 GLY C C 139 172.874 172.073 0.801 1
1 1586 . 8 1 1 A 139 139 GLY CA C 139 45.157 45.996 -0.839 1
1 1587 . 8 1 1 A 139 139 GLY N N 139 112.617 107.171 5.446 1
1 6 . 9 1 1 A 2 2 VAL H H 2 8.992 8.619 0.373 1
1 7 . 9 1 1 A 2 2 VAL HA H 2 5.370 4.955 0.415 1
1 15 . 9 1 1 A 2 2 VAL C C 2 174.325 174.049 0.276 1
1 16 . 9 1 1 A 2 2 VAL CA C 2 61.267 60.417 0.850 1
1 17 . 9 1 1 A 2 2 VAL CB C 2 33.890 35.837 -1.947 1
1 20 . 9 1 1 A 2 2 VAL N N 2 126.939 121.101 5.838 1
1 21 . 9 1 1 A 3 3 THR H H 3 8.912 9.310 -0.398 1
1 22 . 9 1 1 A 3 3 THR HA H 3 4.505 5.328 -0.823 1
1 27 . 9 1 1 A 3 3 THR C C 3 172.710 172.332 0.378 1
1 28 . 9 1 1 A 3 3 THR CA C 3 59.689 59.732 -0.043 1
1 29 . 9 1 1 A 3 3 THR CB C 3 72.398 71.890 0.508 1
1 31 . 9 1 1 A 3 3 THR N N 3 118.091 123.063 -4.972 1
1 32 . 9 1 1 A 4 4 GLU H H 4 8.631 8.919 -0.288 1
1 33 . 9 1 1 A 4 4 GLU HA H 4 5.788 5.135 0.653 1
1 38 . 9 1 1 A 4 4 GLU C C 4 175.758 175.121 0.637 1
1 39 . 9 1 1 A 4 4 GLU CA C 4 54.902 54.602 0.300 1
1 40 . 9 1 1 A 4 4 GLU CB C 4 35.097 32.332 2.765 1
1 42 . 9 1 1 A 4 4 GLU N N 4 120.966 128.035 -7.069 1
1 43 . 9 1 1 A 5 5 THR H H 5 9.188 9.342 -0.154 1
1 44 . 9 1 1 A 5 5 THR HA H 5 4.739 5.366 -0.627 1
1 49 . 9 1 1 A 5 5 THR C C 5 172.757 173.557 -0.800 1
1 50 . 9 1 1 A 5 5 THR CA C 5 60.382 59.937 0.445 1
1 51 . 9 1 1 A 5 5 THR CB C 5 71.558 71.261 0.297 1
1 53 . 9 1 1 A 5 5 THR N N 5 119.366 117.824 1.542 1
1 54 . 9 1 1 A 6 6 VAL H H 6 8.476 8.958 -0.482 1
1 55 . 9 1 1 A 6 6 VAL HA H 6 5.026 5.210 -0.184 1
1 63 . 9 1 1 A 6 6 VAL C C 6 176.674 174.115 2.559 1
1 64 . 9 1 1 A 6 6 VAL CA C 6 61.008 60.683 0.325 1
1 65 . 9 1 1 A 6 6 VAL CB C 6 33.861 33.529 0.332 1
1 68 . 9 1 1 A 6 6 VAL N N 6 121.384 119.243 2.141 1
1 69 . 9 1 1 A 7 7 ASP H H 7 8.848 8.741 0.107 1
1 70 . 9 1 1 A 7 7 ASP HA H 7 4.797 4.671 0.126 1
1 73 . 9 1 1 A 7 7 ASP CA C 7 52.834 54.030 -1.196 1
1 74 . 9 1 1 A 7 7 ASP CB C 7 42.219 40.879 1.340 1
1 75 . 9 1 1 A 7 7 ASP N N 7 127.061 127.679 -0.618 1
1 76 . 9 1 1 A 8 8 GLY C C 8 175.143 175.262 -0.119 1
1 77 . 9 1 1 A 8 8 GLY CA C 8 46.553 45.959 0.594 1
1 78 . 9 1 1 A 9 9 GLN H H 9 8.408 8.865 -0.457 1
1 79 . 9 1 1 A 9 9 GLN HA H 9 4.541 4.360 0.181 1
1 86 . 9 1 1 A 9 9 GLN C C 9 176.463 177.172 -0.709 1
1 87 . 9 1 1 A 9 9 GLN CA C 9 55.167 56.981 -1.814 1
1 88 . 9 1 1 A 9 9 GLN CB C 9 29.376 29.069 0.307 1
1 90 . 9 1 1 A 9 9 GLN N N 9 118.300 120.396 -2.096 1
1 92 . 9 1 1 A 10 10 GLY H H 10 8.162 7.893 0.269 1
1 93 . 9 1 1 A 10 10 GLY HA2 H 10 4.174 4.080 0.094 1
1 94 . 9 1 1 A 10 10 GLY HA3 H 10 3.521 4.087 -0.566 1
1 95 . 9 1 1 A 10 10 GLY C C 10 174.092 173.957 0.135 1
1 96 . 9 1 1 A 10 10 GLY CA C 10 45.558 45.418 0.140 1
1 97 . 9 1 1 A 10 10 GLY N N 10 108.747 107.961 0.786 1
1 98 . 9 1 1 A 11 11 GLN H H 11 8.507 7.629 0.878 1
1 99 . 9 1 1 A 11 11 GLN HA H 11 4.202 4.171 0.031 1
1 106 . 9 1 1 A 11 11 GLN C C 11 173.992 175.158 -1.166 1
1 107 . 9 1 1 A 11 11 GLN CA C 11 55.098 55.822 -0.724 1
1 108 . 9 1 1 A 11 11 GLN CB C 11 29.097 28.953 0.144 1
1 110 . 9 1 1 A 11 11 GLN N N 11 122.979 119.658 3.321 1
1 112 . 9 1 1 A 12 12 ALA H H 12 8.259 8.416 -0.157 1
1 113 . 9 1 1 A 12 12 ALA HA H 12 5.156 5.222 -0.066 1
1 117 . 9 1 1 A 12 12 ALA C C 12 177.284 176.511 0.773 1
1 118 . 9 1 1 A 12 12 ALA CA C 12 51.087 50.256 0.831 1
1 119 . 9 1 1 A 12 12 ALA CB C 12 20.500 20.581 -0.081 1
1 120 . 9 1 1 A 12 12 ALA N N 12 127.100 125.687 1.413 1
1 121 . 9 1 1 A 13 13 TRP H H 13 9.245 9.463 -0.218 1
1 122 . 9 1 1 A 13 13 TRP HA H 13 4.717 5.272 -0.555 1
1 131 . 9 1 1 A 13 13 TRP C C 13 175.108 175.621 -0.513 1
1 132 . 9 1 1 A 13 13 TRP CA C 13 55.966 56.000 -0.034 1
1 133 . 9 1 1 A 13 13 TRP CB C 13 31.912 33.873 -1.961 1
1 139 . 9 1 1 A 13 13 TRP N N 13 123.088 122.157 0.931 1
1 141 . 9 1 1 A 14 14 ARG H H 14 8.575 8.804 -0.229 1
1 142 . 9 1 1 A 14 14 ARG HA H 14 5.335 5.300 0.035 1
1 150 . 9 1 1 A 14 14 ARG C C 14 175.191 174.935 0.256 1
1 151 . 9 1 1 A 14 14 ARG CA C 14 53.106 54.715 -1.609 1
1 152 . 9 1 1 A 14 14 ARG CB C 14 32.749 32.758 -0.009 1
1 154 . 9 1 1 A 14 14 ARG N N 14 121.163 120.389 0.774 1
1 156 . 9 1 1 A 15 15 HIS H H 15 8.595 9.466 -0.871 1
1 157 . 9 1 1 A 15 15 HIS HA H 15 4.790 4.912 -0.122 1
1 161 . 9 1 1 A 15 15 HIS C C 15 173.770 174.084 -0.314 1
1 162 . 9 1 1 A 15 15 HIS CA C 15 55.289 54.258 1.031 1
1 163 . 9 1 1 A 15 15 HIS CB C 15 33.208 30.957 2.251 1
1 165 . 9 1 1 A 15 15 HIS N N 15 117.643 122.134 -4.491 1
1 166 . 9 1 1 A 16 16 HIS H H 16 8.993 8.917 0.076 1
1 167 . 9 1 1 A 16 16 HIS HA H 16 5.158 5.043 0.115 1
1 171 . 9 1 1 A 16 16 HIS C C 16 173.608 174.562 -0.954 1
1 172 . 9 1 1 A 16 16 HIS CA C 16 56.450 55.335 1.115 1
1 173 . 9 1 1 A 16 16 HIS CB C 16 34.171 31.409 2.762 1
1 175 . 9 1 1 A 16 16 HIS N N 16 123.520 121.743 1.777 1
1 176 . 9 1 1 A 17 17 ASN H H 17 7.829 8.836 -1.007 1
1 177 . 9 1 1 A 17 17 ASN HA H 17 4.713 5.426 -0.713 1
1 182 . 9 1 1 A 17 17 ASN C C 17 173.682 175.843 -2.161 1
1 183 . 9 1 1 A 17 17 ASN CA C 17 51.822 51.841 -0.019 1
1 184 . 9 1 1 A 17 17 ASN CB C 17 43.176 40.917 2.259 1
1 185 . 9 1 1 A 17 17 ASN N N 17 122.213 121.350 0.863 1
1 187 . 9 1 1 A 18 18 GLY H H 18 8.423 8.561 -0.138 1
1 188 . 9 1 1 A 18 18 GLY HA2 H 18 3.931 4.073 -0.142 1
1 189 . 9 1 1 A 18 18 GLY HA3 H 18 3.707 4.176 -0.469 1
1 190 . 9 1 1 A 18 18 GLY C C 18 173.985 173.022 0.963 1
1 191 . 9 1 1 A 18 18 GLY CA C 18 43.949 44.600 -0.651 1
1 192 . 9 1 1 A 18 18 GLY N N 18 106.991 107.580 -0.589 1
1 193 . 9 1 1 A 19 19 PHE H H 19 8.338 8.605 -0.267 1
1 194 . 9 1 1 A 19 19 PHE HA H 19 4.068 4.555 -0.487 1
1 197 . 9 1 1 A 19 19 PHE C C 19 176.568 175.394 1.174 1
1 198 . 9 1 1 A 19 19 PHE CA C 19 59.338 59.339 -0.001 1
1 199 . 9 1 1 A 19 19 PHE CB C 19 40.201 39.068 1.133 1
1 200 . 9 1 1 A 19 19 PHE N N 19 116.857 118.830 -1.973 1
1 201 . 9 1 1 A 20 20 ASP H H 20 8.794 8.721 0.073 1
1 202 . 9 1 1 A 20 20 ASP HA H 20 4.485 4.835 -0.350 1
1 205 . 9 1 1 A 20 20 ASP C C 20 177.379 177.238 0.141 1
1 206 . 9 1 1 A 20 20 ASP CA C 20 54.140 54.550 -0.410 1
1 207 . 9 1 1 A 20 20 ASP CB C 20 41.915 42.250 -0.335 1
1 208 . 9 1 1 A 20 20 ASP N N 20 123.025 125.362 -2.337 1
1 209 . 9 1 1 A 21 21 PHE H H 21 8.862 9.191 -0.329 1
1 210 . 9 1 1 A 21 21 PHE HA H 21 4.087 4.120 -0.033 1
1 218 . 9 1 1 A 21 21 PHE C C 21 176.952 177.324 -0.372 1
1 219 . 9 1 1 A 21 21 PHE CA C 21 61.095 62.407 -1.312 1
1 220 . 9 1 1 A 21 21 PHE CB C 21 38.678 39.226 -0.548 1
1 226 . 9 1 1 A 21 21 PHE N N 21 127.163 127.637 -0.474 1
1 227 . 9 1 1 A 22 22 ALA H H 22 8.561 8.000 0.561 1
1 228 . 9 1 1 A 22 22 ALA HA H 22 3.878 3.964 -0.086 1
1 232 . 9 1 1 A 22 22 ALA C C 22 180.710 180.136 0.574 1
1 233 . 9 1 1 A 22 22 ALA CA C 22 55.211 55.098 0.113 1
1 234 . 9 1 1 A 22 22 ALA CB C 22 18.321 18.101 0.220 1
1 235 . 9 1 1 A 22 22 ALA N N 22 120.293 121.293 -1.000 1
1 236 . 9 1 1 A 23 23 VAL H H 23 7.241 7.867 -0.626 1
1 237 . 9 1 1 A 23 23 VAL HA H 23 3.684 3.511 0.173 1
1 245 . 9 1 1 A 23 23 VAL C C 23 177.101 178.131 -1.030 1
1 246 . 9 1 1 A 23 23 VAL CA C 23 65.237 66.952 -1.715 1
1 247 . 9 1 1 A 23 23 VAL CB C 23 31.780 31.526 0.254 1
1 250 . 9 1 1 A 23 23 VAL N N 23 118.775 117.901 0.874 1
1 251 . 9 1 1 A 24 24 ILE H H 24 6.761 8.128 -1.367 1
1 252 . 9 1 1 A 24 24 ILE HA H 24 3.196 3.534 -0.338 1
1 262 . 9 1 1 A 24 24 ILE C C 24 177.287 177.954 -0.667 1
1 263 . 9 1 1 A 24 24 ILE CA C 24 63.404 65.574 -2.170 1
1 264 . 9 1 1 A 24 24 ILE CB C 24 36.294 37.877 -1.583 1
1 268 . 9 1 1 A 24 24 ILE N N 24 119.036 119.795 -0.759 1
1 269 . 9 1 1 A 25 25 LYS H H 25 8.032 8.249 -0.217 1
1 270 . 9 1 1 A 25 25 LYS HA H 25 3.809 3.668 0.141 1
1 279 . 9 1 1 A 25 25 LYS C C 25 179.450 178.928 0.522 1
1 280 . 9 1 1 A 25 25 LYS CA C 25 59.621 59.591 0.030 1
1 281 . 9 1 1 A 25 25 LYS CB C 25 32.259 32.236 0.023 1
1 285 . 9 1 1 A 25 25 LYS N N 25 118.368 120.698 -2.330 1
1 286 . 9 1 1 A 26 26 GLU H H 26 7.845 8.385 -0.540 1
1 287 . 9 1 1 A 26 26 GLU HA H 26 4.021 4.074 -0.053 1
1 292 . 9 1 1 A 26 26 GLU C C 26 179.191 179.381 -0.190 1
1 293 . 9 1 1 A 26 26 GLU CA C 26 59.530 58.924 0.606 1
1 294 . 9 1 1 A 26 26 GLU CB C 26 29.449 29.515 -0.066 1
1 296 . 9 1 1 A 26 26 GLU N N 26 120.522 118.426 2.096 1
1 297 . 9 1 1 A 27 27 LEU H H 27 8.165 7.691 0.474 1
1 298 . 9 1 1 A 27 27 LEU HA H 27 4.163 4.111 0.052 1
1 308 . 9 1 1 A 27 27 LEU C C 27 177.256 178.309 -1.053 1
1 309 . 9 1 1 A 27 27 LEU CA C 27 58.049 57.439 0.610 1
1 310 . 9 1 1 A 27 27 LEU CB C 27 41.365 41.359 0.006 1
1 314 . 9 1 1 A 27 27 LEU N N 27 120.879 121.445 -0.566 1
1 315 . 9 1 1 A 28 28 LYS H H 28 8.902 8.159 0.743 1
1 316 . 9 1 1 A 28 28 LYS HA H 28 4.199 4.609 -0.410 1
1 317 . 9 1 1 A 28 28 LYS C C 28 179.707 179.354 0.353 1
1 318 . 9 1 1 A 28 28 LYS CA C 28 60.097 58.971 1.126 1
1 319 . 9 1 1 A 28 28 LYS CB C 28 33.420 31.660 1.760 1
1 320 . 9 1 1 A 28 28 LYS N N 28 120.050 119.469 0.581 1
1 321 . 9 1 1 A 29 29 THR H H 29 8.294 8.218 0.076 1
1 322 . 9 1 1 A 29 29 THR HA H 29 3.892 3.965 -0.073 1
1 327 . 9 1 1 A 29 29 THR C C 29 175.711 176.616 -0.905 1
1 328 . 9 1 1 A 29 29 THR CA C 29 66.846 66.434 0.412 1
1 329 . 9 1 1 A 29 29 THR CB C 29 68.794 68.845 -0.051 1
1 331 . 9 1 1 A 29 29 THR N N 29 115.933 116.762 -0.829 1
1 332 . 9 1 1 A 30 30 ALA H H 30 8.244 8.506 -0.262 1
1 333 . 9 1 1 A 30 30 ALA HA H 30 4.241 4.253 -0.012 1
1 337 . 9 1 1 A 30 30 ALA C C 30 179.128 179.468 -0.340 1
1 338 . 9 1 1 A 30 30 ALA CA C 30 55.714 55.607 0.107 1
1 339 . 9 1 1 A 30 30 ALA CB C 30 18.955 18.285 0.670 1
1 340 . 9 1 1 A 30 30 ALA N N 30 124.617 123.168 1.449 1
1 341 . 9 1 1 A 31 31 ALA H H 31 8.968 8.470 0.498 1
1 342 . 9 1 1 A 31 31 ALA HA H 31 3.890 4.001 -0.111 1
1 346 . 9 1 1 A 31 31 ALA C C 31 180.352 179.628 0.724 1
1 347 . 9 1 1 A 31 31 ALA CA C 31 55.454 55.411 0.043 1
1 348 . 9 1 1 A 31 31 ALA CB C 31 17.124 18.368 -1.244 1
1 349 . 9 1 1 A 31 31 ALA N N 31 119.327 120.454 -1.127 1
1 350 . 9 1 1 A 32 32 SER H H 32 7.995 7.741 0.254 1
1 351 . 9 1 1 A 32 32 SER HA H 32 4.238 4.147 0.091 1
1 354 . 9 1 1 A 32 32 SER C C 32 175.612 177.179 -1.567 1
1 355 . 9 1 1 A 32 32 SER CA C 32 61.203 61.428 -0.225 1
1 356 . 9 1 1 A 32 32 SER CB C 32 63.406 62.824 0.582 1
1 357 . 9 1 1 A 32 32 SER N N 32 111.962 113.246 -1.284 1
1 358 . 9 1 1 A 33 33 GLN H H 33 8.333 7.566 0.767 1
1 359 . 9 1 1 A 33 33 GLN HA H 33 3.992 4.144 -0.152 1
1 366 . 9 1 1 A 33 33 GLN C C 33 177.486 177.583 -0.097 1
1 367 . 9 1 1 A 33 33 GLN CA C 33 58.277 58.424 -0.147 1
1 368 . 9 1 1 A 33 33 GLN CB C 33 29.140 29.380 -0.240 1
1 370 . 9 1 1 A 33 33 GLN N N 33 119.527 120.875 -1.348 1
1 372 . 9 1 1 A 34 34 TYR H H 34 8.587 8.334 0.253 1
1 373 . 9 1 1 A 34 34 TYR HA H 34 4.792 4.528 0.264 1
1 380 . 9 1 1 A 34 34 TYR C C 34 176.499 176.685 -0.186 1
1 381 . 9 1 1 A 34 34 TYR CA C 34 57.711 59.154 -1.443 1
1 382 . 9 1 1 A 34 34 TYR CB C 34 39.561 39.122 0.439 1
1 387 . 9 1 1 A 34 34 TYR N N 34 114.610 116.222 -1.612 1
1 388 . 9 1 1 A 35 35 GLY H H 35 7.346 8.490 -1.144 1
1 389 . 9 1 1 A 35 35 GLY HA2 H 35 4.785 4.093 0.692 1
1 390 . 9 1 1 A 35 35 GLY HA3 H 35 4.007 4.109 -0.102 1
1 391 . 9 1 1 A 35 35 GLY C C 35 175.796 173.416 2.380 1
1 392 . 9 1 1 A 35 35 GLY CA C 35 44.355 44.927 -0.572 1
1 393 . 9 1 1 A 35 35 GLY N N 35 108.501 107.057 1.444 1
1 394 . 9 1 1 A 36 36 ALA H H 36 9.363 7.741 1.622 1
1 395 . 9 1 1 A 36 36 ALA HA H 36 4.217 4.915 -0.698 1
1 399 . 9 1 1 A 36 36 ALA C C 36 178.039 177.978 0.061 1
1 400 . 9 1 1 A 36 36 ALA CA C 36 56.114 51.148 4.966 1
1 401 . 9 1 1 A 36 36 ALA CB C 36 19.179 20.658 -1.479 1
1 402 . 9 1 1 A 36 36 ALA N N 36 125.811 124.192 1.619 1
1 403 . 9 1 1 A 37 37 THR H H 37 8.070 8.713 -0.643 1
1 404 . 9 1 1 A 37 37 THR HA H 37 4.570 4.253 0.317 1
1 409 . 9 1 1 A 37 37 THR C C 37 173.685 173.990 -0.305 1
1 410 . 9 1 1 A 37 37 THR CA C 37 59.822 65.354 -5.532 1
1 411 . 9 1 1 A 37 37 THR CB C 37 68.267 66.818 1.449 1
1 413 . 9 1 1 A 37 37 THR N N 37 129.410 109.722 19.688 1
1 414 . 9 1 1 A 38 38 ALA H H 38 6.853 7.862 -1.009 1
1 415 . 9 1 1 A 38 38 ALA HA H 38 4.601 4.510 0.091 1
1 419 . 9 1 1 A 38 38 ALA CA C 38 50.758 50.731 0.027 1
1 420 . 9 1 1 A 38 38 ALA CB C 38 18.325 19.396 -1.071 1
1 421 . 9 1 1 A 38 38 ALA N N 38 124.674 125.543 -0.869 1
1 422 . 9 1 1 A 40 40 TYR HA H 40 4.032 4.037 -0.005 1
1 429 . 9 1 1 A 40 40 TYR C C 40 176.456 177.336 -0.880 1
1 430 . 9 1 1 A 40 40 TYR CA C 40 61.010 61.698 -0.688 1
1 431 . 9 1 1 A 40 40 TYR CB C 40 39.286 38.812 0.474 1
1 436 . 9 1 1 A 41 41 THR H H 41 6.874 8.168 -1.294 1
1 437 . 9 1 1 A 41 41 THR HA H 41 3.616 3.719 -0.103 1
1 442 . 9 1 1 A 41 41 THR C C 41 176.930 176.517 0.413 1
1 443 . 9 1 1 A 41 41 THR CA C 41 65.557 65.603 -0.046 1
1 444 . 9 1 1 A 41 41 THR CB C 41 68.228 69.227 -0.999 1
1 446 . 9 1 1 A 41 41 THR N N 41 115.143 113.983 1.160 1
1 447 . 9 1 1 A 42 42 LEU H H 42 8.623 7.367 1.256 1
1 448 . 9 1 1 A 42 42 LEU HA H 42 3.708 3.992 -0.284 1
1 458 . 9 1 1 A 42 42 LEU C C 42 178.206 179.058 -0.852 1
1 459 . 9 1 1 A 42 42 LEU CA C 42 57.417 57.809 -0.392 1
1 460 . 9 1 1 A 42 42 LEU CB C 42 41.342 41.128 0.214 1
1 464 . 9 1 1 A 42 42 LEU N N 42 120.418 118.283 2.135 1
1 465 . 9 1 1 A 43 43 ALA H H 43 7.735 7.881 -0.146 1
1 466 . 9 1 1 A 43 43 ALA HA H 43 4.020 3.951 0.069 1
1 470 . 9 1 1 A 43 43 ALA C C 43 180.826 180.497 0.329 1
1 471 . 9 1 1 A 43 43 ALA CA C 43 54.925 55.122 -0.197 1
1 472 . 9 1 1 A 43 43 ALA CB C 43 17.506 18.033 -0.527 1
1 473 . 9 1 1 A 43 43 ALA N N 43 120.203 121.888 -1.685 1
1 474 . 9 1 1 A 44 44 ILE H H 44 7.149 7.343 -0.194 1
1 475 . 9 1 1 A 44 44 ILE HA H 44 3.603 3.554 0.049 1
1 485 . 9 1 1 A 44 44 ILE C C 44 178.594 178.017 0.577 1
1 486 . 9 1 1 A 44 44 ILE CA C 44 64.782 64.526 0.256 1
1 487 . 9 1 1 A 44 44 ILE CB C 44 37.472 37.671 -0.199 1
1 491 . 9 1 1 A 44 44 ILE N N 44 118.881 119.484 -0.603 1
1 492 . 9 1 1 A 45 45 VAL H H 45 7.968 7.725 0.243 1
1 493 . 9 1 1 A 45 45 VAL HA H 45 2.925 3.459 -0.534 1
1 501 . 9 1 1 A 45 45 VAL C C 45 177.023 177.413 -0.390 1
1 502 . 9 1 1 A 45 45 VAL CA C 45 67.081 66.453 0.628 1
1 503 . 9 1 1 A 45 45 VAL CB C 45 30.854 31.119 -0.265 1
1 506 . 9 1 1 A 45 45 VAL N N 45 120.764 119.567 1.197 1
1 507 . 9 1 1 A 46 46 GLU H H 46 8.399 8.040 0.359 1
1 508 . 9 1 1 A 46 46 GLU HA H 46 3.848 3.854 -0.006 1
1 513 . 9 1 1 A 46 46 GLU C C 46 178.656 179.050 -0.394 1
1 514 . 9 1 1 A 46 46 GLU CA C 46 59.491 59.408 0.083 1
1 515 . 9 1 1 A 46 46 GLU CB C 46 28.991 28.984 0.007 1
1 517 . 9 1 1 A 46 46 GLU N N 46 116.599 119.992 -3.393 1
1 518 . 9 1 1 A 47 47 SER H H 47 7.273 7.714 -0.441 1
1 519 . 9 1 1 A 47 47 SER HA H 47 4.287 4.094 0.193 1
1 521 . 9 1 1 A 47 47 SER CA C 47 61.047 62.636 -1.589 1
1 522 . 9 1 1 A 47 47 SER CB C 47 63.016 62.980 0.036 1
1 523 . 9 1 1 A 47 47 SER N N 47 113.609 116.947 -3.338 1
1 524 . 9 1 1 A 48 48 VAL H H 48 8.006 8.133 -0.127 1
1 525 . 9 1 1 A 48 48 VAL HA H 48 3.556 3.566 -0.010 1
1 533 . 9 1 1 A 48 48 VAL C C 48 177.257 176.661 0.596 1
1 534 . 9 1 1 A 48 48 VAL CA C 48 65.025 66.412 -1.387 1
1 535 . 9 1 1 A 48 48 VAL CB C 48 31.841 31.467 0.374 1
1 538 . 9 1 1 A 48 48 VAL N N 48 122.327 121.381 0.946 1
1 539 . 9 1 1 A 49 49 ALA H H 49 8.369 7.798 0.571 1
1 540 . 9 1 1 A 49 49 ALA HA H 49 4.115 4.269 -0.154 1
1 544 . 9 1 1 A 49 49 ALA C C 49 177.307 177.348 -0.041 1
1 545 . 9 1 1 A 49 49 ALA CA C 49 53.253 51.971 1.282 1
1 546 . 9 1 1 A 49 49 ALA CB C 49 20.131 18.750 1.381 1
1 547 . 9 1 1 A 49 49 ALA N N 49 118.050 120.315 -2.265 1
1 548 . 9 1 1 A 50 50 ASP H H 50 7.052 7.625 -0.573 1
1 549 . 9 1 1 A 50 50 ASP HA H 50 4.788 4.426 0.362 1
1 552 . 9 1 1 A 50 50 ASP C C 50 175.481 175.690 -0.209 1
1 553 . 9 1 1 A 50 50 ASP CA C 50 53.681 56.084 -2.403 1
1 554 . 9 1 1 A 50 50 ASP CB C 50 39.333 40.974 -1.641 1
1 555 . 9 1 1 A 50 50 ASP N N 50 116.997 117.839 -0.842 1
1 556 . 9 1 1 A 51 51 ASN H H 51 8.535 7.550 0.985 1
1 557 . 9 1 1 A 51 51 ASN HA H 51 4.628 4.310 0.318 1
1 562 . 9 1 1 A 51 51 ASN C C 51 174.077 174.978 -0.901 1
1 563 . 9 1 1 A 51 51 ASN CA C 51 52.315 51.385 0.930 1
1 564 . 9 1 1 A 51 51 ASN CB C 51 41.928 39.955 1.973 1
1 565 . 9 1 1 A 51 51 ASN N N 51 118.626 114.566 4.060 1
1 567 . 9 1 1 A 52 52 TRP H H 52 8.555 8.710 -0.155 1
1 574 . 9 1 1 A 52 52 TRP C C 52 173.269 176.497 -3.228 1
1 575 . 9 1 1 A 52 52 TRP CA C 52 55.031 56.848 -1.817 1
1 576 . 9 1 1 A 52 52 TRP CB C 52 26.801 30.393 -3.592 1
1 582 . 9 1 1 A 52 52 TRP N N 52 120.693 120.839 -0.146 1
1 584 . 9 1 1 A 53 53 LEU H H 53 7.847 9.077 -1.230 1
1 585 . 9 1 1 A 53 53 LEU HA H 53 4.859 5.194 -0.335 1
1 595 . 9 1 1 A 53 53 LEU C C 53 177.397 175.045 2.352 1
1 596 . 9 1 1 A 53 53 LEU CA C 53 53.619 53.209 0.410 1
1 597 . 9 1 1 A 53 53 LEU CB C 53 41.812 46.235 -4.423 1
1 601 . 9 1 1 A 53 53 LEU N N 53 124.741 120.694 4.047 1
1 602 . 9 1 1 A 54 54 THR H H 54 8.850 8.184 0.666 1
1 603 . 9 1 1 A 54 54 THR HA H 54 4.598 4.759 -0.161 1
1 608 . 9 1 1 A 54 54 THR CA C 54 60.531 58.449 2.082 1
1 609 . 9 1 1 A 54 54 THR CB C 54 67.183 70.066 -2.883 1
1 611 . 9 1 1 A 54 54 THR N N 54 113.407 108.904 4.503 1
1 612 . 9 1 1 A 55 55 PRO HA H 55 4.511 4.266 0.245 1
1 619 . 9 1 1 A 55 55 PRO C C 55 179.383 178.958 0.425 1
1 620 . 9 1 1 A 55 55 PRO CA C 55 67.159 65.365 1.794 1
1 621 . 9 1 1 A 55 55 PRO CB C 55 32.095 31.714 0.381 1
1 622 . 9 1 1 A 56 56 THR H H 56 8.575 8.116 0.459 1
1 623 . 9 1 1 A 56 56 THR HA H 56 4.229 4.109 0.120 1
1 628 . 9 1 1 A 56 56 THR C C 56 176.668 176.070 0.598 1
1 629 . 9 1 1 A 56 56 THR CA C 56 66.943 66.001 0.942 1
1 630 . 9 1 1 A 56 56 THR CB C 56 68.129 68.091 0.038 1
1 632 . 9 1 1 A 56 56 THR N N 56 114.855 113.956 0.899 1
1 633 . 9 1 1 A 57 57 ASP H H 57 8.730 8.283 0.447 1
1 634 . 9 1 1 A 57 57 ASP HA H 57 4.425 4.615 -0.190 1
1 637 . 9 1 1 A 57 57 ASP C C 57 178.351 178.742 -0.391 1
1 638 . 9 1 1 A 57 57 ASP CA C 57 57.963 57.458 0.505 1
1 639 . 9 1 1 A 57 57 ASP CB C 57 40.134 41.212 -1.078 1
1 640 . 9 1 1 A 57 57 ASP N N 57 126.239 120.816 5.423 1
1 641 . 9 1 1 A 58 58 TRP H H 58 8.244 8.720 -0.476 1
1 642 . 9 1 1 A 58 58 TRP HA H 58 4.030 4.505 -0.475 1
1 650 . 9 1 1 A 58 58 TRP C C 58 177.432 179.435 -2.003 1
1 651 . 9 1 1 A 58 58 TRP CA C 58 62.731 60.156 2.575 1
1 652 . 9 1 1 A 58 58 TRP CB C 58 29.122 29.391 -0.269 1
1 657 . 9 1 1 A 58 58 TRP N N 58 119.241 121.450 -2.209 1
1 659 . 9 1 1 A 59 59 ASN H H 59 8.098 8.891 -0.793 1
1 660 . 9 1 1 A 59 59 ASN HA H 59 4.424 4.473 -0.049 1
1 663 . 9 1 1 A 59 59 ASN C C 59 176.952 177.899 -0.947 1
1 664 . 9 1 1 A 59 59 ASN CA C 59 58.135 56.316 1.819 1
1 665 . 9 1 1 A 59 59 ASN CB C 59 40.168 38.111 2.057 1
1 666 . 9 1 1 A 59 59 ASN N N 59 115.747 118.142 -2.395 1
1 667 . 9 1 1 A 60 60 THR H H 60 8.712 7.833 0.879 1
1 668 . 9 1 1 A 60 60 THR HA H 60 3.717 4.046 -0.329 1
1 673 . 9 1 1 A 60 60 THR C C 60 176.044 176.701 -0.657 1
1 674 . 9 1 1 A 60 60 THR CA C 60 66.576 66.518 0.058 1
1 675 . 9 1 1 A 60 60 THR CB C 60 69.251 68.302 0.949 1
1 677 . 9 1 1 A 60 60 THR N N 60 114.896 118.371 -3.475 1
1 678 . 9 1 1 A 61 61 LEU H H 61 8.485 8.449 0.036 1
1 679 . 9 1 1 A 61 61 LEU HA H 61 3.391 4.161 -0.770 1
1 689 . 9 1 1 A 61 61 LEU C C 61 177.433 178.592 -1.159 1
1 690 . 9 1 1 A 61 61 LEU CA C 61 58.354 58.717 -0.363 1
1 691 . 9 1 1 A 61 61 LEU CB C 61 41.761 42.380 -0.619 1
1 695 . 9 1 1 A 61 61 LEU N N 61 123.433 122.644 0.789 1
1 696 . 9 1 1 A 62 62 VAL H H 62 8.073 8.398 -0.325 1
1 697 . 9 1 1 A 62 62 VAL HA H 62 3.207 3.800 -0.593 1
1 705 . 9 1 1 A 62 62 VAL C C 62 177.585 178.012 -0.427 1
1 706 . 9 1 1 A 62 62 VAL CA C 62 67.345 65.215 2.130 1
1 707 . 9 1 1 A 62 62 VAL CB C 62 30.905 30.544 0.361 1
1 710 . 9 1 1 A 62 62 VAL N N 62 116.018 118.451 -2.433 1
1 711 . 9 1 1 A 63 63 ARG H H 63 7.765 7.803 -0.038 1
1 712 . 9 1 1 A 63 63 ARG HA H 63 3.602 3.837 -0.235 1
1 719 . 9 1 1 A 63 63 ARG C C 63 177.818 178.166 -0.348 1
1 720 . 9 1 1 A 63 63 ARG CA C 63 58.049 59.465 -1.416 1
1 721 . 9 1 1 A 63 63 ARG CB C 63 29.955 30.091 -0.136 1
1 724 . 9 1 1 A 63 63 ARG N N 63 116.700 121.537 -4.837 1
1 725 . 9 1 1 A 64 64 ALA H H 64 7.574 7.656 -0.082 1
1 726 . 9 1 1 A 64 64 ALA HA H 64 4.158 4.322 -0.164 1
1 730 . 9 1 1 A 64 64 ALA C C 64 179.886 179.315 0.571 1
1 731 . 9 1 1 A 64 64 ALA CA C 64 54.007 54.003 0.004 1
1 732 . 9 1 1 A 64 64 ALA CB C 64 19.147 19.744 -0.597 1
1 733 . 9 1 1 A 64 64 ALA N N 64 117.555 121.431 -3.876 1
1 734 . 9 1 1 A 65 65 VAL H H 65 7.554 8.017 -0.463 1
1 735 . 9 1 1 A 65 65 VAL HA H 65 4.253 3.836 0.417 1
1 743 . 9 1 1 A 65 65 VAL C C 65 174.180 176.182 -2.002 1
1 744 . 9 1 1 A 65 65 VAL CA C 65 62.683 65.227 -2.544 1
1 745 . 9 1 1 A 65 65 VAL CB C 65 33.458 31.253 2.205 1
1 748 . 9 1 1 A 65 65 VAL N N 65 110.013 115.878 -5.865 1
1 749 . 9 1 1 A 66 66 LEU H H 66 7.792 7.192 0.600 1
1 750 . 9 1 1 A 66 66 LEU HA H 66 4.790 4.842 -0.052 1
1 760 . 9 1 1 A 66 66 LEU C C 66 177.537 175.167 2.370 1
1 761 . 9 1 1 A 66 66 LEU CA C 66 52.823 52.807 0.016 1
1 762 . 9 1 1 A 66 66 LEU CB C 66 44.071 45.764 -1.693 1
1 766 . 9 1 1 A 66 66 LEU N N 66 118.967 121.379 -2.412 1
1 767 . 9 1 1 A 67 67 SER H H 67 9.208 8.373 0.835 1
1 768 . 9 1 1 A 67 67 SER HA H 67 4.414 5.093 -0.679 1
1 771 . 9 1 1 A 67 67 SER CA C 67 57.943 57.160 0.783 1
1 772 . 9 1 1 A 67 67 SER CB C 67 64.743 67.380 -2.637 1
1 773 . 9 1 1 A 67 67 SER N N 67 116.378 115.435 0.943 1
1 774 . 9 1 1 A 69 69 GLY HA2 H 69 3.916 3.806 0.110 1
1 775 . 9 1 1 A 69 69 GLY HA3 H 69 3.867 3.827 0.040 1
1 776 . 9 1 1 A 69 69 GLY C C 69 176.783 175.588 1.195 1
1 777 . 9 1 1 A 69 69 GLY CA C 69 46.977 46.736 0.241 1
1 778 . 9 1 1 A 70 70 ASP H H 70 7.674 8.193 -0.519 1
1 779 . 9 1 1 A 70 70 ASP HA H 70 4.511 3.886 0.625 1
1 782 . 9 1 1 A 70 70 ASP C C 70 178.096 178.051 0.045 1
1 783 . 9 1 1 A 70 70 ASP CA C 70 57.262 56.504 0.758 1
1 784 . 9 1 1 A 70 70 ASP CB C 70 40.594 39.774 0.820 1
1 785 . 9 1 1 A 70 70 ASP N N 70 123.930 121.633 2.297 1
1 786 . 9 1 1 A 71 71 HIS H H 71 8.729 7.938 0.791 1
1 787 . 9 1 1 A 71 71 HIS HA H 71 4.235 4.240 -0.005 1
1 790 . 9 1 1 A 71 71 HIS C C 71 176.769 177.302 -0.533 1
1 791 . 9 1 1 A 71 71 HIS CA C 71 60.041 59.776 0.265 1
1 792 . 9 1 1 A 71 71 HIS CB C 71 30.682 29.839 0.843 1
1 793 . 9 1 1 A 71 71 HIS N N 71 121.003 119.498 1.505 1
1 794 . 9 1 1 A 72 72 LEU H H 72 7.620 7.748 -0.128 1
1 795 . 9 1 1 A 72 72 LEU HA H 72 3.769 3.870 -0.101 1
1 805 . 9 1 1 A 72 72 LEU C C 72 180.275 179.064 1.211 1
1 806 . 9 1 1 A 72 72 LEU CA C 72 58.192 57.902 0.290 1
1 807 . 9 1 1 A 72 72 LEU CB C 72 41.381 41.451 -0.070 1
1 811 . 9 1 1 A 72 72 LEU N N 72 118.569 119.013 -0.444 1
1 812 . 9 1 1 A 73 73 LEU H H 73 7.542 7.459 0.083 1
1 813 . 9 1 1 A 73 73 LEU HA H 73 4.107 4.167 -0.060 1
1 823 . 9 1 1 A 73 73 LEU C C 73 179.436 179.163 0.273 1
1 824 . 9 1 1 A 73 73 LEU CA C 73 58.026 57.321 0.705 1
1 825 . 9 1 1 A 73 73 LEU CB C 73 41.638 42.077 -0.439 1
1 829 . 9 1 1 A 73 73 LEU N N 73 121.418 120.158 1.260 1
1 830 . 9 1 1 A 74 74 TRP H H 74 8.786 8.017 0.769 1
1 831 . 9 1 1 A 74 74 TRP HA H 74 3.589 5.397 -1.808 1
1 840 . 9 1 1 A 74 74 TRP C C 74 176.816 178.636 -1.820 1
1 841 . 9 1 1 A 74 74 TRP CA C 74 63.046 59.902 3.144 1
1 842 . 9 1 1 A 74 74 TRP CB C 74 28.065 29.189 -1.124 1
1 848 . 9 1 1 A 74 74 TRP N N 74 121.111 118.250 2.861 1
1 850 . 9 1 1 A 75 75 LYS H H 75 8.939 7.581 1.358 1
1 851 . 9 1 1 A 75 75 LYS HA H 75 3.055 4.100 -1.045 1
1 860 . 9 1 1 A 75 75 LYS C C 75 177.967 179.061 -1.094 1
1 861 . 9 1 1 A 75 75 LYS CA C 75 60.029 58.693 1.336 1
1 862 . 9 1 1 A 75 75 LYS CB C 75 32.533 32.690 -0.157 1
1 866 . 9 1 1 A 75 75 LYS N N 75 119.783 118.639 1.144 1
1 867 . 9 1 1 A 76 76 SER H H 76 7.832 7.743 0.089 1
1 868 . 9 1 1 A 76 76 SER HA H 76 4.040 4.238 -0.198 1
1 871 . 9 1 1 A 76 76 SER C C 76 177.816 177.121 0.695 1
1 872 . 9 1 1 A 76 76 SER CA C 76 62.105 61.665 0.440 1
1 873 . 9 1 1 A 76 76 SER CB C 76 62.679 62.919 -0.240 1
1 874 . 9 1 1 A 76 76 SER N N 76 113.395 115.171 -1.776 1
1 875 . 9 1 1 A 77 77 GLU H H 77 7.590 7.877 -0.287 1
1 876 . 9 1 1 A 77 77 GLU HA H 77 4.042 4.240 -0.198 1
1 881 . 9 1 1 A 77 77 GLU C C 77 177.809 178.384 -0.575 1
1 882 . 9 1 1 A 77 77 GLU CA C 77 58.270 58.205 0.065 1
1 883 . 9 1 1 A 77 77 GLU CB C 77 29.208 29.425 -0.217 1
1 885 . 9 1 1 A 77 77 GLU N N 77 121.574 121.560 0.014 1
1 886 . 9 1 1 A 78 78 PHE H H 78 9.081 7.842 1.239 1
1 887 . 9 1 1 A 78 78 PHE HA H 78 3.778 4.286 -0.508 1
1 895 . 9 1 1 A 78 78 PHE C C 78 178.114 177.275 0.839 1
1 896 . 9 1 1 A 78 78 PHE CA C 78 60.629 61.267 -0.638 1
1 897 . 9 1 1 A 78 78 PHE CB C 78 38.295 38.971 -0.676 1
1 902 . 9 1 1 A 78 78 PHE N N 78 122.682 122.517 0.165 1
1 903 . 9 1 1 A 79 79 PHE H H 79 8.890 8.024 0.866 1
1 904 . 9 1 1 A 79 79 PHE HA H 79 3.800 3.881 -0.081 1
1 912 . 9 1 1 A 79 79 PHE C C 79 178.354 178.290 0.064 1
1 913 . 9 1 1 A 79 79 PHE CA C 79 60.704 61.898 -1.194 1
1 914 . 9 1 1 A 79 79 PHE CB C 79 37.184 38.357 -1.173 1
1 920 . 9 1 1 A 79 79 PHE N N 79 121.056 117.410 3.646 1
1 921 . 9 1 1 A 80 80 GLU H H 80 7.793 8.336 -0.543 1
1 922 . 9 1 1 A 80 80 GLU HA H 80 4.082 3.958 0.124 1
1 927 . 9 1 1 A 80 80 GLU C C 80 179.068 179.321 -0.253 1
1 928 . 9 1 1 A 80 80 GLU CA C 80 59.735 59.753 -0.018 1
1 929 . 9 1 1 A 80 80 GLU CB C 80 28.722 28.832 -0.110 1
1 931 . 9 1 1 A 80 80 GLU N N 80 120.312 118.731 1.581 1
1 932 . 9 1 1 A 81 81 ASN H H 81 8.624 8.426 0.198 1
1 933 . 9 1 1 A 81 81 ASN HA H 81 4.521 4.491 0.030 1
1 938 . 9 1 1 A 81 81 ASN C C 81 179.262 177.849 1.413 1
1 939 . 9 1 1 A 81 81 ASN CA C 81 55.504 56.318 -0.814 1
1 940 . 9 1 1 A 81 81 ASN CB C 81 37.517 38.424 -0.907 1
1 941 . 9 1 1 A 81 81 ASN N N 81 119.338 118.520 0.818 1
1 943 . 9 1 1 A 82 82 CYS H H 82 8.554 8.072 0.482 1
1 944 . 9 1 1 A 82 82 CYS HA H 82 3.792 4.073 -0.281 1
1 947 . 9 1 1 A 82 82 CYS C C 82 176.478 177.279 -0.801 1
1 948 . 9 1 1 A 82 82 CYS CA C 82 65.232 62.308 2.924 1
1 949 . 9 1 1 A 82 82 CYS CB C 82 26.762 27.036 -0.274 1
1 950 . 9 1 1 A 82 82 CYS N N 82 120.576 118.441 2.135 1
1 951 . 9 1 1 A 83 83 ARG H H 83 8.522 7.796 0.726 1
1 952 . 9 1 1 A 83 83 ARG HA H 83 3.932 4.160 -0.228 1
1 960 . 9 1 1 A 83 83 ARG C C 83 179.138 178.720 0.418 1
1 961 . 9 1 1 A 83 83 ARG CA C 83 60.443 59.576 0.867 1
1 962 . 9 1 1 A 83 83 ARG CB C 83 29.550 29.931 -0.381 1
1 965 . 9 1 1 A 83 83 ARG N N 83 123.035 120.445 2.590 1
1 967 . 9 1 1 A 84 84 ASP H H 84 7.791 7.897 -0.106 1
1 968 . 9 1 1 A 84 84 ASP HA H 84 4.353 4.415 -0.062 1
1 971 . 9 1 1 A 84 84 ASP C C 84 178.649 179.037 -0.388 1
1 972 . 9 1 1 A 84 84 ASP CA C 84 57.767 57.701 0.066 1
1 973 . 9 1 1 A 84 84 ASP CB C 84 41.305 41.759 -0.454 1
1 974 . 9 1 1 A 84 84 ASP N N 84 120.332 119.997 0.335 1
1 975 . 9 1 1 A 85 85 THR H H 85 8.370 7.985 0.385 1
1 976 . 9 1 1 A 85 85 THR HA H 85 3.730 3.955 -0.225 1
1 981 . 9 1 1 A 85 85 THR C C 85 175.198 176.627 -1.429 1
1 982 . 9 1 1 A 85 85 THR CA C 85 66.830 66.280 0.550 1
1 983 . 9 1 1 A 85 85 THR CB C 85 68.533 68.302 0.231 1
1 985 . 9 1 1 A 85 85 THR N N 85 117.360 115.886 1.474 1
1 986 . 9 1 1 A 86 86 ALA H H 86 8.845 8.137 0.708 1
1 987 . 9 1 1 A 86 86 ALA HA H 86 3.991 4.185 -0.194 1
1 991 . 9 1 1 A 86 86 ALA C C 86 179.980 179.575 0.405 1
1 992 . 9 1 1 A 86 86 ALA CA C 86 55.769 55.147 0.622 1
1 993 . 9 1 1 A 86 86 ALA CB C 86 17.881 18.355 -0.474 1
1 994 . 9 1 1 A 86 86 ALA N N 86 123.613 123.507 0.106 1
1 995 . 9 1 1 A 87 87 LYS H H 87 7.686 8.377 -0.691 1
1 996 . 9 1 1 A 87 87 LYS HA H 87 4.099 4.093 0.006 1
1 1005 . 9 1 1 A 87 87 LYS C C 87 179.592 179.221 0.371 1
1 1006 . 9 1 1 A 87 87 LYS CA C 87 59.708 59.732 -0.024 1
1 1007 . 9 1 1 A 87 87 LYS CB C 87 32.054 32.246 -0.192 1
1 1011 . 9 1 1 A 87 87 LYS N N 87 119.623 118.141 1.482 1
1 1012 . 9 1 1 A 88 88 ARG H H 88 7.683 7.789 -0.106 1
1 1013 . 9 1 1 A 88 88 ARG HA H 88 4.051 4.202 -0.151 1
1 1020 . 9 1 1 A 88 88 ARG C C 88 180.053 179.421 0.632 1
1 1021 . 9 1 1 A 88 88 ARG CA C 88 59.558 59.226 0.332 1
1 1022 . 9 1 1 A 88 88 ARG CB C 88 29.684 30.004 -0.320 1
1 1025 . 9 1 1 A 88 88 ARG N N 88 120.788 119.721 1.067 1
1 1026 . 9 1 1 A 89 89 ASN H H 89 8.973 8.275 0.698 1
1 1027 . 9 1 1 A 89 89 ASN HA H 89 4.354 4.700 -0.346 1
1 1032 . 9 1 1 A 89 89 ASN C C 89 178.382 178.503 -0.121 1
1 1033 . 9 1 1 A 89 89 ASN CA C 89 55.334 55.643 -0.309 1
1 1034 . 9 1 1 A 89 89 ASN CB C 89 37.864 37.997 -0.133 1
1 1035 . 9 1 1 A 89 89 ASN N N 89 121.012 118.188 2.824 1
1 1037 . 9 1 1 A 90 90 GLN H H 90 8.152 8.034 0.118 1
1 1038 . 9 1 1 A 90 90 GLN HA H 90 4.020 4.177 -0.157 1
1 1045 . 9 1 1 A 90 90 GLN C C 90 179.075 178.684 0.391 1
1 1046 . 9 1 1 A 90 90 GLN CA C 90 59.318 58.773 0.545 1
1 1047 . 9 1 1 A 90 90 GLN CB C 90 28.049 28.619 -0.570 1
1 1049 . 9 1 1 A 90 90 GLN N N 90 122.122 121.150 0.972 1
1 1051 . 9 1 1 A 91 91 GLN H H 91 7.514 8.547 -1.033 1
1 1052 . 9 1 1 A 91 91 GLN HA H 91 4.053 4.071 -0.018 1
1 1059 . 9 1 1 A 91 91 GLN C C 91 177.081 177.547 -0.466 1
1 1060 . 9 1 1 A 91 91 GLN CA C 91 58.031 58.622 -0.591 1
1 1061 . 9 1 1 A 91 91 GLN CB C 91 28.365 27.948 0.417 1
1 1063 . 9 1 1 A 91 91 GLN N N 91 118.124 118.178 -0.054 1
1 1065 . 9 1 1 A 92 92 ALA H H 92 7.704 7.642 0.062 1
1 1066 . 9 1 1 A 92 92 ALA HA H 92 4.246 4.394 -0.148 1
1 1070 . 9 1 1 A 92 92 ALA C C 92 178.450 177.934 0.516 1
1 1071 . 9 1 1 A 92 92 ALA CA C 92 52.671 52.054 0.617 1
1 1072 . 9 1 1 A 92 92 ALA CB C 92 19.316 19.746 -0.430 1
1 1073 . 9 1 1 A 92 92 ALA N N 92 119.880 119.574 0.306 1
1 1074 . 9 1 1 A 93 93 GLY H H 93 7.693 8.005 -0.312 1
1 1075 . 9 1 1 A 93 93 GLY HA2 H 93 3.941 3.910 0.031 1
1 1076 . 9 1 1 A 93 93 GLY HA3 H 93 3.744 3.920 -0.176 1
1 1077 . 9 1 1 A 93 93 GLY C C 93 174.344 175.360 -1.016 1
1 1078 . 9 1 1 A 93 93 GLY CA C 93 45.949 46.836 -0.887 1
1 1079 . 9 1 1 A 93 93 GLY N N 93 105.347 107.579 -2.232 1
1 1080 . 9 1 1 A 94 94 ASN H H 94 7.076 8.904 -1.828 1
1 1081 . 9 1 1 A 94 94 ASN HA H 94 4.115 4.757 -0.642 1
1 1085 . 9 1 1 A 94 94 ASN C C 94 175.410 175.282 0.128 1
1 1086 . 9 1 1 A 94 94 ASN CA C 94 52.651 52.950 -0.299 1
1 1087 . 9 1 1 A 94 94 ASN CB C 94 38.330 39.145 -0.815 1
1 1088 . 9 1 1 A 94 94 ASN N N 94 115.747 117.085 -1.338 1
1 1090 . 9 1 1 A 95 95 GLY H H 95 8.236 8.080 0.156 1
1 1091 . 9 1 1 A 95 95 GLY HA2 H 95 3.633 3.628 0.005 1
1 1092 . 9 1 1 A 95 95 GLY HA3 H 95 3.633 3.831 -0.198 1
1 1093 . 9 1 1 A 95 95 GLY C C 95 174.450 174.237 0.213 1
1 1094 . 9 1 1 A 95 95 GLY CA C 95 45.522 44.976 0.546 1
1 1095 . 9 1 1 A 95 95 GLY N N 95 109.166 105.479 3.687 1
1 1096 . 9 1 1 A 96 96 TRP H H 96 7.899 7.753 0.146 1
1 1097 . 9 1 1 A 96 96 TRP HA H 96 5.241 4.765 0.476 1
1 1106 . 9 1 1 A 96 96 TRP C C 96 175.661 176.028 -0.367 1
1 1107 . 9 1 1 A 96 96 TRP CA C 96 55.090 57.445 -2.355 1
1 1108 . 9 1 1 A 96 96 TRP CB C 96 27.138 30.834 -3.696 1
1 1114 . 9 1 1 A 96 96 TRP N N 96 122.840 120.949 1.891 1
1 1116 . 9 1 1 A 97 97 ASP H H 97 7.344 9.098 -1.754 1
1 1117 . 9 1 1 A 97 97 ASP HA H 97 4.829 5.331 -0.502 1
1 1120 . 9 1 1 A 97 97 ASP C C 97 175.019 176.830 -1.811 1
1 1121 . 9 1 1 A 97 97 ASP CA C 97 52.149 52.492 -0.343 1
1 1122 . 9 1 1 A 97 97 ASP CB C 97 42.697 44.964 -2.267 1
1 1123 . 9 1 1 A 97 97 ASP N N 97 126.861 118.945 7.916 1
1 1124 . 9 1 1 A 98 98 PHE H H 98 8.566 9.306 -0.740 1
1 1125 . 9 1 1 A 98 98 PHE HA H 98 3.727 4.114 -0.387 1
1 1133 . 9 1 1 A 98 98 PHE C C 98 177.443 176.979 0.464 1
1 1134 . 9 1 1 A 98 98 PHE CA C 98 62.471 61.532 0.939 1
1 1135 . 9 1 1 A 98 98 PHE CB C 98 39.919 39.531 0.388 1
1 1141 . 9 1 1 A 98 98 PHE N N 98 117.781 120.680 -2.899 1
1 1142 . 9 1 1 A 99 99 ASP H H 99 8.259 7.967 0.292 1
1 1143 . 9 1 1 A 99 99 ASP HA H 99 3.960 4.284 -0.324 1
1 1146 . 9 1 1 A 99 99 ASP C C 99 178.132 178.272 -0.140 1
1 1147 . 9 1 1 A 99 99 ASP CA C 99 57.658 56.322 1.336 1
1 1148 . 9 1 1 A 99 99 ASP CB C 99 38.572 40.764 -2.192 1
1 1149 . 9 1 1 A 99 99 ASP N N 99 121.709 118.977 2.732 1
1 1150 . 9 1 1 A 100 100 MET H H 100 8.008 8.607 -0.599 1
1 1151 . 9 1 1 A 100 100 MET HA H 100 3.644 4.351 -0.707 1
1 1156 . 9 1 1 A 100 100 MET C C 100 180.008 177.105 2.903 1
1 1157 . 9 1 1 A 100 100 MET CA C 100 58.598 58.354 0.244 1
1 1158 . 9 1 1 A 100 100 MET CB C 100 33.423 33.095 0.328 1
1 1160 . 9 1 1 A 100 100 MET N N 100 119.668 118.947 0.721 1
1 1161 . 9 1 1 A 101 101 LEU H H 101 7.961 8.106 -0.145 1
1 1162 . 9 1 1 A 101 101 LEU HA H 101 3.523 4.449 -0.926 1
1 1172 . 9 1 1 A 101 101 LEU C C 101 173.873 175.200 -1.327 1
1 1173 . 9 1 1 A 101 101 LEU CA C 101 58.743 54.013 4.730 1
1 1174 . 9 1 1 A 101 101 LEU CB C 101 42.632 41.411 1.221 1
1 1178 . 9 1 1 A 101 101 LEU N N 101 119.752 120.373 -0.621 1
1 1179 . 9 1 1 A 102 102 THR H H 102 6.955 8.136 -1.181 1
1 1180 . 9 1 1 A 102 102 THR HA H 102 4.134 4.452 -0.318 1
1 1185 . 9 1 1 A 102 102 THR C C 102 176.513 172.636 3.877 1
1 1186 . 9 1 1 A 102 102 THR CA C 102 61.125 60.260 0.865 1
1 1187 . 9 1 1 A 102 102 THR CB C 102 71.415 70.364 1.051 1
1 1189 . 9 1 1 A 102 102 THR N N 102 124.665 118.023 6.642 1
1 1190 . 9 1 1 A 103 103 GLY H H 103 7.816 8.681 -0.865 1
1 1191 . 9 1 1 A 103 103 GLY HA2 H 103 3.824 4.379 -0.555 1
1 1192 . 9 1 1 A 103 103 GLY HA3 H 103 3.824 4.497 -0.673 1
1 1193 . 9 1 1 A 103 103 GLY C C 103 174.126 174.266 -0.140 1
1 1194 . 9 1 1 A 103 103 GLY CA C 103 47.805 45.043 2.762 1
1 1195 . 9 1 1 A 103 103 GLY N N 103 114.191 111.574 2.617 1
1 1196 . 9 1 1 A 104 104 SER H H 104 8.860 8.974 -0.114 1
1 1197 . 9 1 1 A 104 104 SER HA H 104 4.758 4.159 0.599 1
1 1200 . 9 1 1 A 104 104 SER C C 104 174.591 174.909 -0.318 1
1 1201 . 9 1 1 A 104 104 SER CA C 104 56.755 59.964 -3.209 1
1 1202 . 9 1 1 A 104 104 SER CB C 104 65.050 63.834 1.216 1
1 1203 . 9 1 1 A 104 104 SER N N 104 114.771 119.452 -4.681 1
1 1204 . 9 1 1 A 105 105 GLY H H 105 8.788 8.006 0.782 1
1 1205 . 9 1 1 A 105 105 GLY HA2 H 105 3.733 4.023 -0.290 1
1 1206 . 9 1 1 A 105 105 GLY HA3 H 105 3.733 4.045 -0.312 1
1 1207 . 9 1 1 A 105 105 GLY CA C 105 47.247 45.348 1.899 1
1 1208 . 9 1 1 A 105 105 GLY N N 105 110.394 108.866 1.528 1
1 1209 . 9 1 1 A 106 106 ASN HA H 106 4.454 4.731 -0.277 1
1 1212 . 9 1 1 A 106 106 ASN C C 106 175.180 175.883 -0.703 1
1 1213 . 9 1 1 A 106 106 ASN CA C 106 54.492 54.967 -0.475 1
1 1214 . 9 1 1 A 106 106 ASN CB C 106 37.282 39.988 -2.706 1
1 1215 . 9 1 1 A 107 107 TYR H H 107 8.241 7.663 0.578 1
1 1216 . 9 1 1 A 107 107 TYR HA H 107 4.335 4.733 -0.398 1
1 1223 . 9 1 1 A 107 107 TYR C C 107 173.954 176.754 -2.800 1
1 1224 . 9 1 1 A 107 107 TYR CA C 107 57.727 58.186 -0.459 1
1 1225 . 9 1 1 A 107 107 TYR CB C 107 37.063 39.470 -2.407 1
1 1230 . 9 1 1 A 107 107 TYR N N 107 120.708 112.941 7.767 1
1 1231 . 9 1 1 A 108 108 SER H H 108 7.117 7.751 -0.634 1
1 1232 . 9 1 1 A 108 108 SER HA H 108 4.221 4.201 0.020 1
1 1235 . 9 1 1 A 108 108 SER C C 108 174.834 173.874 0.960 1
1 1236 . 9 1 1 A 108 108 SER CA C 108 59.859 58.789 1.070 1
1 1237 . 9 1 1 A 108 108 SER CB C 108 63.846 61.311 2.535 1
1 1238 . 9 1 1 A 108 108 SER N N 108 113.362 112.720 0.642 1
1 1239 . 9 1 1 A 109 109 SER H H 109 8.053 8.211 -0.158 1
1 1240 . 9 1 1 A 109 109 SER HA H 109 4.560 4.375 0.185 1
1 1243 . 9 1 1 A 109 109 SER CA C 109 57.141 60.621 -3.480 1
1 1244 . 9 1 1 A 109 109 SER CB C 109 64.874 63.638 1.236 1
1 1245 . 9 1 1 A 109 109 SER N N 109 116.657 115.895 0.762 1
1 1246 . 9 1 1 A 110 110 THR HA H 110 3.541 3.854 -0.313 1
1 1251 . 9 1 1 A 110 110 THR C C 110 175.477 175.701 -0.224 1
1 1252 . 9 1 1 A 110 110 THR CA C 110 66.443 66.494 -0.051 1
1 1253 . 9 1 1 A 110 110 THR CB C 110 68.091 68.611 -0.520 1
1 1255 . 9 1 1 A 111 111 ASP H H 111 8.224 8.321 -0.097 1
1 1256 . 9 1 1 A 111 111 ASP HA H 111 4.237 4.249 -0.012 1
1 1259 . 9 1 1 A 111 111 ASP C C 111 177.520 178.311 -0.791 1
1 1260 . 9 1 1 A 111 111 ASP CA C 111 57.559 57.537 0.022 1
1 1261 . 9 1 1 A 111 111 ASP CB C 111 40.292 41.642 -1.350 1
1 1262 . 9 1 1 A 111 111 ASP N N 111 119.490 121.267 -1.777 1
1 1263 . 9 1 1 A 112 112 ALA H H 112 7.431 7.717 -0.286 1
1 1264 . 9 1 1 A 112 112 ALA HA H 112 4.191 4.086 0.105 1
1 1268 . 9 1 1 A 112 112 ALA C C 112 180.646 179.930 0.716 1
1 1269 . 9 1 1 A 112 112 ALA CA C 112 54.534 54.690 -0.156 1
1 1270 . 9 1 1 A 112 112 ALA CB C 112 18.992 18.369 0.623 1
1 1271 . 9 1 1 A 112 112 ALA N N 112 119.710 121.616 -1.906 1
1 1272 . 9 1 1 A 113 113 GLN H H 113 7.576 7.365 0.211 1
1 1273 . 9 1 1 A 113 113 GLN HA H 113 3.562 4.251 -0.689 1
1 1278 . 9 1 1 A 113 113 GLN C C 113 176.756 178.070 -1.314 1
1 1279 . 9 1 1 A 113 113 GLN CA C 113 57.736 58.696 -0.960 1
1 1280 . 9 1 1 A 113 113 GLN CB C 113 29.110 28.563 0.547 1
1 1281 . 9 1 1 A 113 113 GLN N N 113 117.518 118.453 -0.935 1
1 1283 . 9 1 1 A 114 114 MET H H 114 8.192 8.493 -0.301 1
1 1284 . 9 1 1 A 114 114 MET HA H 114 4.231 4.410 -0.179 1
1 1289 . 9 1 1 A 114 114 MET C C 114 175.648 177.160 -1.512 1
1 1290 . 9 1 1 A 114 114 MET CA C 114 57.446 57.795 -0.349 1
1 1291 . 9 1 1 A 114 114 MET CB C 114 33.570 32.899 0.671 1
1 1293 . 9 1 1 A 114 114 MET N N 114 111.509 119.497 -7.988 1
1 1294 . 9 1 1 A 115 115 GLN H H 115 6.940 7.640 -0.700 1
1 1295 . 9 1 1 A 115 115 GLN HA H 115 4.307 4.405 -0.098 1
1 1302 . 9 1 1 A 115 115 GLN C C 115 176.270 174.781 1.489 1
1 1303 . 9 1 1 A 115 115 GLN CA C 115 54.680 54.880 -0.200 1
1 1304 . 9 1 1 A 115 115 GLN CB C 115 28.233 28.997 -0.764 1
1 1306 . 9 1 1 A 115 115 GLN N N 115 114.300 116.392 -2.092 1
1 1308 . 9 1 1 A 116 116 TYR H H 116 6.677 7.392 -0.715 1
1 1309 . 9 1 1 A 116 116 TYR HA H 116 4.193 4.751 -0.558 1
1 1312 . 9 1 1 A 116 116 TYR C C 116 175.268 174.409 0.859 1
1 1313 . 9 1 1 A 116 116 TYR CA C 116 54.357 57.969 -3.612 1
1 1314 . 9 1 1 A 116 116 TYR CB C 116 35.498 39.419 -3.921 1
1 1315 . 9 1 1 A 116 116 TYR N N 116 117.919 119.247 -1.328 1
1 1316 . 9 1 1 A 117 117 ASP H H 117 8.081 8.824 -0.743 1
1 1317 . 9 1 1 A 117 117 ASP HA H 117 4.665 5.145 -0.480 1
1 1320 . 9 1 1 A 117 117 ASP CA C 117 52.422 50.894 1.528 1
1 1321 . 9 1 1 A 117 117 ASP CB C 117 42.416 43.165 -0.749 1
1 1322 . 9 1 1 A 117 117 ASP N N 117 120.887 122.528 -1.641 1
1 1323 . 9 1 1 A 118 118 PRO C C 118 179.180 179.562 -0.382 1
1 1324 . 9 1 1 A 118 118 PRO CA C 118 65.942 66.297 -0.355 1
1 1325 . 9 1 1 A 118 118 PRO CB C 118 32.197 31.964 0.233 1
1 1326 . 9 1 1 A 119 119 GLY H H 119 9.742 8.891 0.851 1
1 1327 . 9 1 1 A 119 119 GLY C C 119 175.622 175.157 0.465 1
1 1328 . 9 1 1 A 119 119 GLY CA C 119 46.785 46.493 0.292 1
1 1329 . 9 1 1 A 119 119 GLY N N 119 106.412 106.458 -0.046 1
1 1330 . 9 1 1 A 120 120 LEU H H 120 6.666 7.982 -1.316 1
1 1331 . 9 1 1 A 120 120 LEU HA H 120 3.365 3.581 -0.216 1
1 1341 . 9 1 1 A 120 120 LEU C C 120 179.262 178.370 0.892 1
1 1342 . 9 1 1 A 120 120 LEU CA C 120 56.605 56.965 -0.360 1
1 1343 . 9 1 1 A 120 120 LEU CB C 120 39.262 41.721 -2.459 1
1 1347 . 9 1 1 A 120 120 LEU N N 120 126.226 123.163 3.063 1
1 1348 . 9 1 1 A 121 121 PHE H H 121 7.356 8.335 -0.979 1
1 1349 . 9 1 1 A 121 121 PHE HA H 121 4.459 3.817 0.642 1
1 1352 . 9 1 1 A 121 121 PHE C C 121 179.716 177.518 2.198 1
1 1353 . 9 1 1 A 121 121 PHE CA C 121 62.838 62.010 0.828 1
1 1354 . 9 1 1 A 121 121 PHE CB C 121 37.603 38.587 -0.984 1
1 1355 . 9 1 1 A 121 121 PHE N N 121 117.437 119.358 -1.921 1
1 1356 . 9 1 1 A 122 122 ALA H H 122 7.926 8.525 -0.599 1
1 1357 . 9 1 1 A 122 122 ALA HA H 122 4.523 3.872 0.651 1
1 1361 . 9 1 1 A 122 122 ALA C C 122 180.435 179.965 0.470 1
1 1362 . 9 1 1 A 122 122 ALA CA C 122 55.527 55.232 0.295 1
1 1363 . 9 1 1 A 122 122 ALA CB C 122 17.814 17.909 -0.095 1
1 1364 . 9 1 1 A 122 122 ALA N N 122 121.068 120.721 0.347 1
1 1365 . 9 1 1 A 123 123 GLN H H 123 7.507 8.033 -0.526 1
1 1366 . 9 1 1 A 123 123 GLN HA H 123 4.153 3.903 0.250 1
1 1371 . 9 1 1 A 123 123 GLN C C 123 180.561 178.781 1.780 1
1 1372 . 9 1 1 A 123 123 GLN CA C 123 59.948 58.688 1.260 1
1 1373 . 9 1 1 A 123 123 GLN CB C 123 29.135 28.312 0.823 1
1 1375 . 9 1 1 A 123 123 GLN N N 123 120.324 116.348 3.976 1
1 1376 . 9 1 1 A 124 124 ILE H H 124 8.318 7.684 0.634 1
1 1377 . 9 1 1 A 124 124 ILE HA H 124 3.635 3.803 -0.168 1
1 1387 . 9 1 1 A 124 124 ILE C C 124 176.481 177.998 -1.517 1
1 1388 . 9 1 1 A 124 124 ILE CA C 124 66.432 63.711 2.721 1
1 1389 . 9 1 1 A 124 124 ILE CB C 124 39.168 37.438 1.730 1
1 1393 . 9 1 1 A 124 124 ILE N N 124 123.747 117.902 5.845 1
1 1394 . 9 1 1 A 125 125 GLN H H 125 8.474 7.998 0.476 1
1 1395 . 9 1 1 A 125 125 GLN HA H 125 4.264 3.840 0.424 1
1 1402 . 9 1 1 A 125 125 GLN C C 125 178.947 177.703 1.244 1
1 1403 . 9 1 1 A 125 125 GLN CA C 125 59.651 58.372 1.279 1
1 1404 . 9 1 1 A 125 125 GLN CB C 125 28.880 28.451 0.429 1
1 1406 . 9 1 1 A 125 125 GLN N N 125 120.368 121.214 -0.846 1
1 1408 . 9 1 1 A 126 126 ALA H H 126 8.002 7.834 0.168 1
1 1409 . 9 1 1 A 126 126 ALA HA H 126 4.144 3.960 0.184 1
1 1413 . 9 1 1 A 126 126 ALA C C 126 179.316 179.853 -0.537 1
1 1414 . 9 1 1 A 126 126 ALA CA C 126 55.036 54.945 0.091 1
1 1415 . 9 1 1 A 126 126 ALA CB C 126 18.087 17.844 0.243 1
1 1416 . 9 1 1 A 126 126 ALA N N 126 121.661 121.118 0.543 1
1 1417 . 9 1 1 A 127 127 ALA H H 127 7.823 7.985 -0.162 1
1 1418 . 9 1 1 A 127 127 ALA HA H 127 4.162 4.026 0.136 1
1 1422 . 9 1 1 A 127 127 ALA C C 127 180.707 179.345 1.362 1
1 1423 . 9 1 1 A 127 127 ALA CA C 127 55.080 54.872 0.208 1
1 1424 . 9 1 1 A 127 127 ALA CB C 127 19.354 18.273 1.081 1
1 1425 . 9 1 1 A 127 127 ALA N N 127 119.853 119.583 0.270 1
1 1426 . 9 1 1 A 128 128 ALA H H 128 8.936 7.860 1.076 1
1 1427 . 9 1 1 A 128 128 ALA HA H 128 3.928 3.748 0.180 1
1 1431 . 9 1 1 A 128 128 ALA C C 128 181.031 179.198 1.833 1
1 1432 . 9 1 1 A 128 128 ALA CA C 128 55.502 54.627 0.875 1
1 1433 . 9 1 1 A 128 128 ALA CB C 128 16.609 17.665 -1.056 1
1 1434 . 9 1 1 A 128 128 ALA N N 128 121.355 120.190 1.165 1
1 1435 . 9 1 1 A 129 129 THR H H 129 8.543 8.015 0.528 1
1 1436 . 9 1 1 A 129 129 THR HA H 129 4.015 3.661 0.354 1
1 1441 . 9 1 1 A 129 129 THR C C 129 177.332 176.521 0.811 1
1 1442 . 9 1 1 A 129 129 THR CA C 129 65.893 65.363 0.530 1
1 1443 . 9 1 1 A 129 129 THR CB C 129 68.566 68.081 0.485 1
1 1445 . 9 1 1 A 129 129 THR N N 129 112.709 110.918 1.791 1
1 1446 . 9 1 1 A 130 130 LYS H H 130 8.126 7.335 0.791 1
1 1447 . 9 1 1 A 130 130 LYS HA H 130 4.000 3.924 0.076 1
1 1456 . 9 1 1 A 130 130 LYS C C 130 179.082 178.224 0.858 1
1 1457 . 9 1 1 A 130 130 LYS CA C 130 60.299 59.350 0.949 1
1 1458 . 9 1 1 A 130 130 LYS CB C 130 32.767 32.244 0.523 1
1 1462 . 9 1 1 A 130 130 LYS N N 130 123.879 121.815 2.064 1
1 1463 . 9 1 1 A 131 131 ALA H H 131 7.184 7.909 -0.725 1
1 1464 . 9 1 1 A 131 131 ALA HA H 131 4.005 4.137 -0.132 1
1 1468 . 9 1 1 A 131 131 ALA C C 131 178.482 179.531 -1.049 1
1 1469 . 9 1 1 A 131 131 ALA CA C 131 55.027 55.257 -0.230 1
1 1470 . 9 1 1 A 131 131 ALA CB C 131 18.669 18.810 -0.141 1
1 1471 . 9 1 1 A 131 131 ALA N N 131 118.590 120.887 -2.297 1
1 1472 . 9 1 1 A 132 132 TRP H H 132 7.977 8.541 -0.564 1
1 1473 . 9 1 1 A 132 132 TRP HA H 132 4.001 4.138 -0.137 1
1 1480 . 9 1 1 A 132 132 TRP C C 132 177.332 175.741 1.591 1
1 1481 . 9 1 1 A 132 132 TRP CA C 132 60.431 57.352 3.079 1
1 1482 . 9 1 1 A 132 132 TRP CB C 132 27.786 27.537 0.249 1
1 1486 . 9 1 1 A 132 132 TRP N N 132 119.168 116.770 2.398 1
1 1488 . 9 1 1 A 133 133 ARG H H 133 8.006 8.134 -0.128 1
1 1489 . 9 1 1 A 133 133 ARG HA H 133 4.027 4.362 -0.335 1
1 1497 . 9 1 1 A 133 133 ARG C C 133 176.664 177.420 -0.756 1
1 1498 . 9 1 1 A 133 133 ARG CA C 133 59.355 57.079 2.276 1
1 1499 . 9 1 1 A 133 133 ARG CB C 133 30.451 32.483 -2.032 1
1 1502 . 9 1 1 A 133 133 ARG N N 133 113.062 120.574 -7.512 1
1 1504 . 9 1 1 A 134 134 LYS H H 134 7.322 7.674 -0.352 1
1 1505 . 9 1 1 A 134 134 LYS HA H 134 4.313 4.426 -0.113 1
1 1514 . 9 1 1 A 134 134 LYS C C 134 176.282 176.554 -0.272 1
1 1515 . 9 1 1 A 134 134 LYS CA C 134 54.922 56.280 -1.358 1
1 1516 . 9 1 1 A 134 134 LYS CB C 134 32.633 32.042 0.591 1
1 1520 . 9 1 1 A 134 134 LYS N N 134 118.170 115.462 2.708 1
1 1521 . 9 1 1 A 135 135 LEU H H 135 7.440 7.652 -0.212 1
1 1522 . 9 1 1 A 135 135 LEU HA H 135 4.174 4.881 -0.707 1
1 1532 . 9 1 1 A 135 135 LEU CA C 135 54.408 51.645 2.763 1
1 1533 . 9 1 1 A 135 135 LEU CB C 135 40.407 43.395 -2.988 1
1 1537 . 9 1 1 A 135 135 LEU N N 135 123.358 116.466 6.892 1
1 1538 . 9 1 1 A 136 136 PRO HA H 136 4.437 4.429 0.008 1
1 1545 . 9 1 1 A 136 136 PRO C C 136 177.106 177.035 0.071 1
1 1546 . 9 1 1 A 136 136 PRO CA C 136 62.889 66.045 -3.156 1
1 1547 . 9 1 1 A 136 136 PRO CB C 136 32.192 31.563 0.629 1
1 1550 . 9 1 1 A 137 137 VAL H H 137 8.219 7.720 0.499 1
1 1551 . 9 1 1 A 137 137 VAL HA H 137 4.077 4.142 -0.065 1
1 1559 . 9 1 1 A 137 137 VAL C C 137 176.305 176.626 -0.321 1
1 1560 . 9 1 1 A 137 137 VAL CA C 137 61.958 61.710 0.248 1
1 1561 . 9 1 1 A 137 137 VAL CB C 137 32.755 32.586 0.169 1
1 1564 . 9 1 1 A 137 137 VAL N N 137 120.079 116.000 4.079 1
1 1565 . 9 1 1 A 138 138 LYS H H 138 8.444 8.945 -0.501 1
1 1566 . 9 1 1 A 138 138 LYS HA H 138 4.316 4.045 0.271 1
1 1575 . 9 1 1 A 138 138 LYS C C 138 176.790 176.366 0.424 1
1 1576 . 9 1 1 A 138 138 LYS CA C 138 56.792 58.132 -1.340 1
1 1577 . 9 1 1 A 138 138 LYS CB C 138 33.205 32.895 0.310 1
1 1581 . 9 1 1 A 138 138 LYS N N 138 126.449 130.233 -3.784 1
1 1582 . 9 1 1 A 139 139 GLY H H 139 8.518 7.838 0.680 1
1 1583 . 9 1 1 A 139 139 GLY HA2 H 139 4.070 4.015 0.055 1
1 1584 . 9 1 1 A 139 139 GLY HA3 H 139 3.897 4.023 -0.126 1
1 1585 . 9 1 1 A 139 139 GLY C C 139 172.874 173.068 -0.194 1
1 1586 . 9 1 1 A 139 139 GLY CA C 139 45.157 45.466 -0.309 1
1 1587 . 9 1 1 A 139 139 GLY N N 139 112.617 106.285 6.332 1
1 6 . 10 1 1 A 2 2 VAL H H 2 8.992 8.876 0.116 1
1 7 . 10 1 1 A 2 2 VAL HA H 2 5.370 4.949 0.421 1
1 15 . 10 1 1 A 2 2 VAL C C 2 174.325 174.832 -0.507 1
1 16 . 10 1 1 A 2 2 VAL CA C 2 61.267 60.553 0.714 1
1 17 . 10 1 1 A 2 2 VAL CB C 2 33.890 35.443 -1.553 1
1 20 . 10 1 1 A 2 2 VAL N N 2 126.939 119.810 7.129 1
1 21 . 10 1 1 A 3 3 THR H H 3 8.912 8.775 0.137 1
1 22 . 10 1 1 A 3 3 THR HA H 3 4.505 5.260 -0.755 1
1 27 . 10 1 1 A 3 3 THR C C 3 172.710 172.853 -0.143 1
1 28 . 10 1 1 A 3 3 THR CA C 3 59.689 59.978 -0.289 1
1 29 . 10 1 1 A 3 3 THR CB C 3 72.398 72.072 0.326 1
1 31 . 10 1 1 A 3 3 THR N N 3 118.091 121.192 -3.101 1
1 32 . 10 1 1 A 4 4 GLU H H 4 8.631 8.782 -0.151 1
1 33 . 10 1 1 A 4 4 GLU HA H 4 5.788 5.109 0.679 1
1 38 . 10 1 1 A 4 4 GLU C C 4 175.758 174.516 1.242 1
1 39 . 10 1 1 A 4 4 GLU CA C 4 54.902 55.233 -0.331 1
1 40 . 10 1 1 A 4 4 GLU CB C 4 35.097 31.966 3.131 1
1 42 . 10 1 1 A 4 4 GLU N N 4 120.966 124.936 -3.970 1
1 43 . 10 1 1 A 5 5 THR H H 5 9.188 8.851 0.337 1
1 44 . 10 1 1 A 5 5 THR HA H 5 4.739 4.764 -0.025 1
1 49 . 10 1 1 A 5 5 THR C C 5 172.757 172.215 0.542 1
1 50 . 10 1 1 A 5 5 THR CA C 5 60.382 59.989 0.393 1
1 51 . 10 1 1 A 5 5 THR CB C 5 71.558 70.660 0.898 1
1 53 . 10 1 1 A 5 5 THR N N 5 119.366 114.646 4.720 1
1 54 . 10 1 1 A 6 6 VAL H H 6 8.476 8.701 -0.225 1
1 55 . 10 1 1 A 6 6 VAL HA H 6 5.026 4.812 0.214 1
1 63 . 10 1 1 A 6 6 VAL C C 6 176.674 173.488 3.186 1
1 64 . 10 1 1 A 6 6 VAL CA C 6 61.008 59.074 1.934 1
1 65 . 10 1 1 A 6 6 VAL CB C 6 33.861 34.517 -0.656 1
1 68 . 10 1 1 A 6 6 VAL N N 6 121.384 122.199 -0.815 1
1 69 . 10 1 1 A 7 7 ASP H H 7 8.848 8.467 0.381 1
1 70 . 10 1 1 A 7 7 ASP HA H 7 4.797 5.185 -0.388 1
1 73 . 10 1 1 A 7 7 ASP CA C 7 52.834 52.357 0.477 1
1 74 . 10 1 1 A 7 7 ASP CB C 7 42.219 44.175 -1.956 1
1 75 . 10 1 1 A 7 7 ASP N N 7 127.061 122.726 4.335 1
1 76 . 10 1 1 A 8 8 GLY C C 8 175.143 175.053 0.090 1
1 77 . 10 1 1 A 8 8 GLY CA C 8 46.553 47.110 -0.557 1
1 78 . 10 1 1 A 9 9 GLN H H 9 8.408 7.293 1.115 1
1 79 . 10 1 1 A 9 9 GLN HA H 9 4.541 4.400 0.141 1
1 86 . 10 1 1 A 9 9 GLN C C 9 176.463 176.243 0.220 1
1 87 . 10 1 1 A 9 9 GLN CA C 9 55.167 55.662 -0.495 1
1 88 . 10 1 1 A 9 9 GLN CB C 9 29.376 29.076 0.300 1
1 90 . 10 1 1 A 9 9 GLN N N 9 118.300 118.079 0.221 1
1 92 . 10 1 1 A 10 10 GLY H H 10 8.162 8.280 -0.118 1
1 93 . 10 1 1 A 10 10 GLY HA2 H 10 4.174 3.926 0.248 1
1 94 . 10 1 1 A 10 10 GLY HA3 H 10 3.521 3.929 -0.408 1
1 95 . 10 1 1 A 10 10 GLY C C 10 174.092 174.406 -0.314 1
1 96 . 10 1 1 A 10 10 GLY CA C 10 45.558 45.577 -0.019 1
1 97 . 10 1 1 A 10 10 GLY N N 10 108.747 108.362 0.385 1
1 98 . 10 1 1 A 11 11 GLN H H 11 8.507 7.946 0.561 1
1 99 . 10 1 1 A 11 11 GLN HA H 11 4.202 4.490 -0.288 1
1 106 . 10 1 1 A 11 11 GLN C C 11 173.992 175.034 -1.042 1
1 107 . 10 1 1 A 11 11 GLN CA C 11 55.098 55.558 -0.460 1
1 108 . 10 1 1 A 11 11 GLN CB C 11 29.097 29.358 -0.261 1
1 110 . 10 1 1 A 11 11 GLN N N 11 122.979 120.555 2.424 1
1 112 . 10 1 1 A 12 12 ALA H H 12 8.259 8.962 -0.703 1
1 113 . 10 1 1 A 12 12 ALA HA H 12 5.156 5.358 -0.202 1
1 117 . 10 1 1 A 12 12 ALA C C 12 177.284 176.760 0.524 1
1 118 . 10 1 1 A 12 12 ALA CA C 12 51.087 50.383 0.704 1
1 119 . 10 1 1 A 12 12 ALA CB C 12 20.500 21.461 -0.961 1
1 120 . 10 1 1 A 12 12 ALA N N 12 127.100 126.797 0.303 1
1 121 . 10 1 1 A 13 13 TRP H H 13 9.245 8.676 0.569 1
1 122 . 10 1 1 A 13 13 TRP HA H 13 4.717 5.569 -0.852 1
1 131 . 10 1 1 A 13 13 TRP C C 13 175.108 173.616 1.492 1
1 132 . 10 1 1 A 13 13 TRP CA C 13 55.966 55.144 0.822 1
1 133 . 10 1 1 A 13 13 TRP CB C 13 31.912 32.570 -0.658 1
1 139 . 10 1 1 A 13 13 TRP N N 13 123.088 119.183 3.905 1
1 141 . 10 1 1 A 14 14 ARG H H 14 8.575 9.138 -0.563 1
1 142 . 10 1 1 A 14 14 ARG HA H 14 5.335 4.993 0.342 1
1 150 . 10 1 1 A 14 14 ARG C C 14 175.191 173.518 1.673 1
1 151 . 10 1 1 A 14 14 ARG CA C 14 53.106 55.106 -2.000 1
1 152 . 10 1 1 A 14 14 ARG CB C 14 32.749 34.101 -1.352 1
1 154 . 10 1 1 A 14 14 ARG N N 14 121.163 118.060 3.103 1
1 156 . 10 1 1 A 15 15 HIS H H 15 8.595 9.008 -0.413 1
1 157 . 10 1 1 A 15 15 HIS HA H 15 4.790 5.278 -0.488 1
1 161 . 10 1 1 A 15 15 HIS C C 15 173.770 174.720 -0.950 1
1 162 . 10 1 1 A 15 15 HIS CA C 15 55.289 53.655 1.634 1
1 163 . 10 1 1 A 15 15 HIS CB C 15 33.208 33.115 0.093 1
1 165 . 10 1 1 A 15 15 HIS N N 15 117.643 116.799 0.844 1
1 166 . 10 1 1 A 16 16 HIS H H 16 8.993 8.932 0.061 1
1 167 . 10 1 1 A 16 16 HIS HA H 16 5.158 4.965 0.193 1
1 171 . 10 1 1 A 16 16 HIS C C 16 173.608 175.369 -1.761 1
1 172 . 10 1 1 A 16 16 HIS CA C 16 56.450 55.619 0.831 1
1 173 . 10 1 1 A 16 16 HIS CB C 16 34.171 31.253 2.918 1
1 175 . 10 1 1 A 16 16 HIS N N 16 123.520 121.047 2.473 1
1 176 . 10 1 1 A 17 17 ASN H H 17 7.829 9.128 -1.299 1
1 177 . 10 1 1 A 17 17 ASN HA H 17 4.713 5.331 -0.618 1
1 182 . 10 1 1 A 17 17 ASN C C 17 173.682 175.589 -1.907 1
1 183 . 10 1 1 A 17 17 ASN CA C 17 51.822 51.780 0.042 1
1 184 . 10 1 1 A 17 17 ASN CB C 17 43.176 41.838 1.338 1
1 185 . 10 1 1 A 17 17 ASN N N 17 122.213 120.554 1.659 1
1 187 . 10 1 1 A 18 18 GLY H H 18 8.423 8.270 0.153 1
1 188 . 10 1 1 A 18 18 GLY HA2 H 18 3.931 3.732 0.199 1
1 189 . 10 1 1 A 18 18 GLY HA3 H 18 3.707 3.926 -0.219 1
1 190 . 10 1 1 A 18 18 GLY C C 18 173.985 173.126 0.859 1
1 191 . 10 1 1 A 18 18 GLY CA C 18 43.949 45.718 -1.769 1
1 192 . 10 1 1 A 18 18 GLY N N 18 106.991 109.087 -2.096 1
1 193 . 10 1 1 A 19 19 PHE H H 19 8.338 7.848 0.490 1
1 194 . 10 1 1 A 19 19 PHE HA H 19 4.068 5.289 -1.221 1
1 197 . 10 1 1 A 19 19 PHE C C 19 176.568 174.599 1.969 1
1 198 . 10 1 1 A 19 19 PHE CA C 19 59.338 56.471 2.867 1
1 199 . 10 1 1 A 19 19 PHE CB C 19 40.201 43.397 -3.196 1
1 200 . 10 1 1 A 19 19 PHE N N 19 116.857 116.076 0.781 1
1 201 . 10 1 1 A 20 20 ASP H H 20 8.794 8.921 -0.127 1
1 202 . 10 1 1 A 20 20 ASP HA H 20 4.485 4.847 -0.362 1
1 205 . 10 1 1 A 20 20 ASP C C 20 177.379 177.170 0.209 1
1 206 . 10 1 1 A 20 20 ASP CA C 20 54.140 54.788 -0.648 1
1 207 . 10 1 1 A 20 20 ASP CB C 20 41.915 40.832 1.083 1
1 208 . 10 1 1 A 20 20 ASP N N 20 123.025 124.870 -1.845 1
1 209 . 10 1 1 A 21 21 PHE H H 21 8.862 9.033 -0.171 1
1 210 . 10 1 1 A 21 21 PHE HA H 21 4.087 4.029 0.058 1
1 218 . 10 1 1 A 21 21 PHE C C 21 176.952 177.122 -0.170 1
1 219 . 10 1 1 A 21 21 PHE CA C 21 61.095 62.358 -1.263 1
1 220 . 10 1 1 A 21 21 PHE CB C 21 38.678 39.520 -0.842 1
1 226 . 10 1 1 A 21 21 PHE N N 21 127.163 125.826 1.337 1
1 227 . 10 1 1 A 22 22 ALA H H 22 8.561 8.274 0.287 1
1 228 . 10 1 1 A 22 22 ALA HA H 22 3.878 3.994 -0.116 1
1 232 . 10 1 1 A 22 22 ALA C C 22 180.710 179.967 0.743 1
1 233 . 10 1 1 A 22 22 ALA CA C 22 55.211 55.269 -0.058 1
1 234 . 10 1 1 A 22 22 ALA CB C 22 18.321 18.507 -0.186 1
1 235 . 10 1 1 A 22 22 ALA N N 22 120.293 121.039 -0.746 1
1 236 . 10 1 1 A 23 23 VAL H H 23 7.241 7.747 -0.506 1
1 237 . 10 1 1 A 23 23 VAL HA H 23 3.684 3.488 0.196 1
1 245 . 10 1 1 A 23 23 VAL C C 23 177.101 177.906 -0.805 1
1 246 . 10 1 1 A 23 23 VAL CA C 23 65.237 66.962 -1.725 1
1 247 . 10 1 1 A 23 23 VAL CB C 23 31.780 31.544 0.236 1
1 250 . 10 1 1 A 23 23 VAL N N 23 118.775 117.670 1.105 1
1 251 . 10 1 1 A 24 24 ILE H H 24 6.761 7.813 -1.052 1
1 252 . 10 1 1 A 24 24 ILE HA H 24 3.196 3.505 -0.309 1
1 262 . 10 1 1 A 24 24 ILE C C 24 177.287 178.157 -0.870 1
1 263 . 10 1 1 A 24 24 ILE CA C 24 63.404 65.662 -2.258 1
1 264 . 10 1 1 A 24 24 ILE CB C 24 36.294 37.796 -1.502 1
1 268 . 10 1 1 A 24 24 ILE N N 24 119.036 119.411 -0.375 1
1 269 . 10 1 1 A 25 25 LYS H H 25 8.032 8.185 -0.153 1
1 270 . 10 1 1 A 25 25 LYS HA H 25 3.809 3.637 0.172 1
1 279 . 10 1 1 A 25 25 LYS C C 25 179.450 178.910 0.540 1
1 280 . 10 1 1 A 25 25 LYS CA C 25 59.621 59.310 0.311 1
1 281 . 10 1 1 A 25 25 LYS CB C 25 32.259 32.097 0.162 1
1 285 . 10 1 1 A 25 25 LYS N N 25 118.368 119.942 -1.574 1
1 286 . 10 1 1 A 26 26 GLU H H 26 7.845 7.560 0.285 1
1 287 . 10 1 1 A 26 26 GLU HA H 26 4.021 4.076 -0.055 1
1 292 . 10 1 1 A 26 26 GLU C C 26 179.191 179.407 -0.216 1
1 293 . 10 1 1 A 26 26 GLU CA C 26 59.530 58.892 0.638 1
1 294 . 10 1 1 A 26 26 GLU CB C 26 29.449 29.791 -0.342 1
1 296 . 10 1 1 A 26 26 GLU N N 26 120.522 120.662 -0.140 1
1 297 . 10 1 1 A 27 27 LEU H H 27 8.165 8.013 0.152 1
1 298 . 10 1 1 A 27 27 LEU HA H 27 4.163 4.153 0.010 1
1 308 . 10 1 1 A 27 27 LEU C C 27 177.256 178.270 -1.014 1
1 309 . 10 1 1 A 27 27 LEU CA C 27 58.049 57.839 0.210 1
1 310 . 10 1 1 A 27 27 LEU CB C 27 41.365 42.004 -0.639 1
1 314 . 10 1 1 A 27 27 LEU N N 27 120.879 121.250 -0.371 1
1 315 . 10 1 1 A 28 28 LYS H H 28 8.902 8.457 0.445 1
1 316 . 10 1 1 A 28 28 LYS HA H 28 4.199 4.260 -0.061 1
1 317 . 10 1 1 A 28 28 LYS C C 28 179.707 178.985 0.722 1
1 318 . 10 1 1 A 28 28 LYS CA C 28 60.097 59.516 0.581 1
1 319 . 10 1 1 A 28 28 LYS CB C 28 33.420 32.055 1.365 1
1 320 . 10 1 1 A 28 28 LYS N N 28 120.050 119.761 0.289 1
1 321 . 10 1 1 A 29 29 THR H H 29 8.294 8.168 0.126 1
1 322 . 10 1 1 A 29 29 THR HA H 29 3.892 3.908 -0.016 1
1 327 . 10 1 1 A 29 29 THR C C 29 175.711 176.646 -0.935 1
1 328 . 10 1 1 A 29 29 THR CA C 29 66.846 66.418 0.428 1
1 329 . 10 1 1 A 29 29 THR CB C 29 68.794 68.731 0.063 1
1 331 . 10 1 1 A 29 29 THR N N 29 115.933 116.689 -0.756 1
1 332 . 10 1 1 A 30 30 ALA H H 30 8.244 8.457 -0.213 1
1 333 . 10 1 1 A 30 30 ALA HA H 30 4.241 4.116 0.125 1
1 337 . 10 1 1 A 30 30 ALA C C 30 179.128 179.806 -0.678 1
1 338 . 10 1 1 A 30 30 ALA CA C 30 55.714 55.143 0.571 1
1 339 . 10 1 1 A 30 30 ALA CB C 30 18.955 18.434 0.521 1
1 340 . 10 1 1 A 30 30 ALA N N 30 124.617 123.615 1.002 1
1 341 . 10 1 1 A 31 31 ALA H H 31 8.968 8.405 0.563 1
1 342 . 10 1 1 A 31 31 ALA HA H 31 3.890 4.060 -0.170 1
1 346 . 10 1 1 A 31 31 ALA C C 31 180.352 179.629 0.723 1
1 347 . 10 1 1 A 31 31 ALA CA C 31 55.454 55.480 -0.026 1
1 348 . 10 1 1 A 31 31 ALA CB C 31 17.124 18.149 -1.025 1
1 349 . 10 1 1 A 31 31 ALA N N 31 119.327 120.815 -1.488 1
1 350 . 10 1 1 A 32 32 SER H H 32 7.995 7.740 0.255 1
1 351 . 10 1 1 A 32 32 SER HA H 32 4.238 4.247 -0.009 1
1 354 . 10 1 1 A 32 32 SER C C 32 175.612 176.621 -1.009 1
1 355 . 10 1 1 A 32 32 SER CA C 32 61.203 61.402 -0.199 1
1 356 . 10 1 1 A 32 32 SER CB C 32 63.406 62.902 0.504 1
1 357 . 10 1 1 A 32 32 SER N N 32 111.962 113.174 -1.212 1
1 358 . 10 1 1 A 33 33 GLN H H 33 8.333 7.802 0.531 1
1 359 . 10 1 1 A 33 33 GLN HA H 33 3.992 4.327 -0.335 1
1 366 . 10 1 1 A 33 33 GLN C C 33 177.486 177.525 -0.039 1
1 367 . 10 1 1 A 33 33 GLN CA C 33 58.277 58.261 0.016 1
1 368 . 10 1 1 A 33 33 GLN CB C 33 29.140 29.815 -0.675 1
1 370 . 10 1 1 A 33 33 GLN N N 33 119.527 119.911 -0.384 1
1 372 . 10 1 1 A 34 34 TYR H H 34 8.587 8.306 0.281 1
1 373 . 10 1 1 A 34 34 TYR HA H 34 4.792 4.374 0.418 1
1 380 . 10 1 1 A 34 34 TYR C C 34 176.499 176.640 -0.141 1
1 381 . 10 1 1 A 34 34 TYR CA C 34 57.711 59.955 -2.244 1
1 382 . 10 1 1 A 34 34 TYR CB C 34 39.561 38.893 0.668 1
1 387 . 10 1 1 A 34 34 TYR N N 34 114.610 115.338 -0.728 1
1 388 . 10 1 1 A 35 35 GLY H H 35 7.346 8.304 -0.958 1
1 389 . 10 1 1 A 35 35 GLY HA2 H 35 4.785 4.089 0.696 1
1 390 . 10 1 1 A 35 35 GLY HA3 H 35 4.007 4.090 -0.083 1
1 391 . 10 1 1 A 35 35 GLY C C 35 175.796 173.264 2.532 1
1 392 . 10 1 1 A 35 35 GLY CA C 35 44.355 44.731 -0.376 1
1 393 . 10 1 1 A 35 35 GLY N N 35 108.501 106.097 2.404 1
1 394 . 10 1 1 A 36 36 ALA H H 36 9.363 8.259 1.104 1
1 395 . 10 1 1 A 36 36 ALA HA H 36 4.217 4.619 -0.402 1
1 399 . 10 1 1 A 36 36 ALA C C 36 178.039 177.441 0.598 1
1 400 . 10 1 1 A 36 36 ALA CA C 36 56.114 51.630 4.484 1
1 401 . 10 1 1 A 36 36 ALA CB C 36 19.179 18.767 0.412 1
1 402 . 10 1 1 A 36 36 ALA N N 36 125.811 123.300 2.511 1
1 403 . 10 1 1 A 37 37 THR H H 37 8.070 8.355 -0.285 1
1 404 . 10 1 1 A 37 37 THR HA H 37 4.570 4.523 0.047 1
1 409 . 10 1 1 A 37 37 THR C C 37 173.685 174.231 -0.546 1
1 410 . 10 1 1 A 37 37 THR CA C 37 59.822 62.922 -3.100 1
1 411 . 10 1 1 A 37 37 THR CB C 37 68.267 71.709 -3.442 1
1 413 . 10 1 1 A 37 37 THR N N 37 129.410 118.822 10.588 1
1 414 . 10 1 1 A 38 38 ALA H H 38 6.853 7.524 -0.671 1
1 415 . 10 1 1 A 38 38 ALA HA H 38 4.601 4.603 -0.002 1
1 419 . 10 1 1 A 38 38 ALA CA C 38 50.758 50.667 0.091 1
1 420 . 10 1 1 A 38 38 ALA CB C 38 18.325 19.615 -1.290 1
1 421 . 10 1 1 A 38 38 ALA N N 38 124.674 124.648 0.026 1
1 422 . 10 1 1 A 40 40 TYR HA H 40 4.032 4.035 -0.003 1
1 429 . 10 1 1 A 40 40 TYR C C 40 176.456 177.310 -0.854 1
1 430 . 10 1 1 A 40 40 TYR CA C 40 61.010 61.927 -0.917 1
1 431 . 10 1 1 A 40 40 TYR CB C 40 39.286 38.779 0.507 1
1 436 . 10 1 1 A 41 41 THR H H 41 6.874 8.029 -1.155 1
1 437 . 10 1 1 A 41 41 THR HA H 41 3.616 3.929 -0.313 1
1 442 . 10 1 1 A 41 41 THR C C 41 176.930 176.627 0.303 1
1 443 . 10 1 1 A 41 41 THR CA C 41 65.557 65.556 0.001 1
1 444 . 10 1 1 A 41 41 THR CB C 41 68.228 69.361 -1.133 1
1 446 . 10 1 1 A 41 41 THR N N 41 115.143 113.968 1.175 1
1 447 . 10 1 1 A 42 42 LEU H H 42 8.623 7.320 1.303 1
1 448 . 10 1 1 A 42 42 LEU HA H 42 3.708 4.004 -0.296 1
1 458 . 10 1 1 A 42 42 LEU C C 42 178.206 178.949 -0.743 1
1 459 . 10 1 1 A 42 42 LEU CA C 42 57.417 57.759 -0.342 1
1 460 . 10 1 1 A 42 42 LEU CB C 42 41.342 41.219 0.123 1
1 464 . 10 1 1 A 42 42 LEU N N 42 120.418 118.334 2.084 1
1 465 . 10 1 1 A 43 43 ALA H H 43 7.735 7.843 -0.108 1
1 466 . 10 1 1 A 43 43 ALA HA H 43 4.020 3.989 0.031 1
1 470 . 10 1 1 A 43 43 ALA C C 43 180.826 180.477 0.349 1
1 471 . 10 1 1 A 43 43 ALA CA C 43 54.925 54.920 0.005 1
1 472 . 10 1 1 A 43 43 ALA CB C 43 17.506 18.315 -0.809 1
1 473 . 10 1 1 A 43 43 ALA N N 43 120.203 121.761 -1.558 1
1 474 . 10 1 1 A 44 44 ILE H H 44 7.149 7.336 -0.187 1
1 475 . 10 1 1 A 44 44 ILE HA H 44 3.603 3.577 0.026 1
1 485 . 10 1 1 A 44 44 ILE C C 44 178.594 178.126 0.468 1
1 486 . 10 1 1 A 44 44 ILE CA C 44 64.782 64.548 0.234 1
1 487 . 10 1 1 A 44 44 ILE CB C 44 37.472 37.795 -0.323 1
1 491 . 10 1 1 A 44 44 ILE N N 44 118.881 119.582 -0.701 1
1 492 . 10 1 1 A 45 45 VAL H H 45 7.968 7.805 0.163 1
1 493 . 10 1 1 A 45 45 VAL HA H 45 2.925 3.363 -0.438 1
1 501 . 10 1 1 A 45 45 VAL C C 45 177.023 177.799 -0.776 1
1 502 . 10 1 1 A 45 45 VAL CA C 45 67.081 67.028 0.053 1
1 503 . 10 1 1 A 45 45 VAL CB C 45 30.854 31.274 -0.420 1
1 506 . 10 1 1 A 45 45 VAL N N 45 120.764 119.913 0.851 1
1 507 . 10 1 1 A 46 46 GLU H H 46 8.399 8.345 0.054 1
1 508 . 10 1 1 A 46 46 GLU HA H 46 3.848 3.905 -0.057 1
1 513 . 10 1 1 A 46 46 GLU C C 46 178.656 178.584 0.072 1
1 514 . 10 1 1 A 46 46 GLU CA C 46 59.491 59.115 0.376 1
1 515 . 10 1 1 A 46 46 GLU CB C 46 28.991 28.798 0.193 1
1 517 . 10 1 1 A 46 46 GLU N N 46 116.599 119.729 -3.130 1
1 518 . 10 1 1 A 47 47 SER H H 47 7.273 7.374 -0.101 1
1 519 . 10 1 1 A 47 47 SER HA H 47 4.287 4.118 0.169 1
1 521 . 10 1 1 A 47 47 SER CA C 47 61.047 60.995 0.052 1
1 522 . 10 1 1 A 47 47 SER CB C 47 63.016 62.955 0.061 1
1 523 . 10 1 1 A 47 47 SER N N 47 113.609 115.551 -1.942 1
1 524 . 10 1 1 A 48 48 VAL H H 48 8.006 7.977 0.029 1
1 525 . 10 1 1 A 48 48 VAL HA H 48 3.556 3.646 -0.090 1
1 533 . 10 1 1 A 48 48 VAL C C 48 177.257 177.424 -0.167 1
1 534 . 10 1 1 A 48 48 VAL CA C 48 65.025 66.003 -0.978 1
1 535 . 10 1 1 A 48 48 VAL CB C 48 31.841 31.261 0.580 1
1 538 . 10 1 1 A 48 48 VAL N N 48 122.327 121.102 1.225 1
1 539 . 10 1 1 A 49 49 ALA H H 49 8.369 7.747 0.622 1
1 540 . 10 1 1 A 49 49 ALA HA H 49 4.115 4.324 -0.209 1
1 544 . 10 1 1 A 49 49 ALA C C 49 177.307 177.622 -0.315 1
1 545 . 10 1 1 A 49 49 ALA CA C 49 53.253 53.150 0.103 1
1 546 . 10 1 1 A 49 49 ALA CB C 49 20.131 18.389 1.742 1
1 547 . 10 1 1 A 49 49 ALA N N 49 118.050 120.856 -2.806 1
1 548 . 10 1 1 A 50 50 ASP H H 50 7.052 7.910 -0.858 1
1 549 . 10 1 1 A 50 50 ASP HA H 50 4.788 4.673 0.115 1
1 552 . 10 1 1 A 50 50 ASP C C 50 175.481 175.903 -0.422 1
1 553 . 10 1 1 A 50 50 ASP CA C 50 53.681 54.237 -0.556 1
1 554 . 10 1 1 A 50 50 ASP CB C 50 39.333 41.121 -1.788 1
1 555 . 10 1 1 A 50 50 ASP N N 50 116.997 117.458 -0.461 1
1 556 . 10 1 1 A 51 51 ASN H H 51 8.535 7.818 0.717 1
1 557 . 10 1 1 A 51 51 ASN HA H 51 4.628 4.626 0.002 1
1 562 . 10 1 1 A 51 51 ASN C C 51 174.077 174.397 -0.320 1
1 563 . 10 1 1 A 51 51 ASN CA C 51 52.315 51.856 0.459 1
1 564 . 10 1 1 A 51 51 ASN CB C 51 41.928 41.816 0.112 1
1 565 . 10 1 1 A 51 51 ASN N N 51 118.626 117.152 1.474 1
1 567 . 10 1 1 A 52 52 TRP H H 52 8.555 8.309 0.246 1
1 574 . 10 1 1 A 52 52 TRP C C 52 173.269 176.337 -3.068 1
1 575 . 10 1 1 A 52 52 TRP CA C 52 55.031 56.365 -1.334 1
1 576 . 10 1 1 A 52 52 TRP CB C 52 26.801 30.513 -3.712 1
1 582 . 10 1 1 A 52 52 TRP N N 52 120.693 120.808 -0.115 1
1 584 . 10 1 1 A 53 53 LEU H H 53 7.847 8.700 -0.853 1
1 585 . 10 1 1 A 53 53 LEU HA H 53 4.859 4.946 -0.087 1
1 595 . 10 1 1 A 53 53 LEU C C 53 177.397 175.381 2.016 1
1 596 . 10 1 1 A 53 53 LEU CA C 53 53.619 53.416 0.203 1
1 597 . 10 1 1 A 53 53 LEU CB C 53 41.812 45.559 -3.747 1
1 601 . 10 1 1 A 53 53 LEU N N 53 124.741 120.382 4.359 1
1 602 . 10 1 1 A 54 54 THR H H 54 8.850 8.955 -0.105 1
1 603 . 10 1 1 A 54 54 THR HA H 54 4.598 4.804 -0.206 1
1 608 . 10 1 1 A 54 54 THR CA C 54 60.531 60.008 0.523 1
1 609 . 10 1 1 A 54 54 THR CB C 54 67.183 69.025 -1.842 1
1 611 . 10 1 1 A 54 54 THR N N 54 113.407 111.812 1.595 1
1 612 . 10 1 1 A 55 55 PRO HA H 55 4.511 4.641 -0.130 1
1 619 . 10 1 1 A 55 55 PRO C C 55 179.383 178.540 0.843 1
1 620 . 10 1 1 A 55 55 PRO CA C 55 67.159 64.692 2.467 1
1 621 . 10 1 1 A 55 55 PRO CB C 55 32.095 31.905 0.190 1
1 622 . 10 1 1 A 56 56 THR H H 56 8.575 7.758 0.817 1
1 623 . 10 1 1 A 56 56 THR HA H 56 4.229 4.115 0.114 1
1 628 . 10 1 1 A 56 56 THR C C 56 176.668 176.198 0.470 1
1 629 . 10 1 1 A 56 56 THR CA C 56 66.943 65.958 0.985 1
1 630 . 10 1 1 A 56 56 THR CB C 56 68.129 67.973 0.156 1
1 632 . 10 1 1 A 56 56 THR N N 56 114.855 112.047 2.808 1
1 633 . 10 1 1 A 57 57 ASP H H 57 8.730 8.299 0.431 1
1 634 . 10 1 1 A 57 57 ASP HA H 57 4.425 4.711 -0.286 1
1 637 . 10 1 1 A 57 57 ASP C C 57 178.351 179.352 -1.001 1
1 638 . 10 1 1 A 57 57 ASP CA C 57 57.963 57.723 0.240 1
1 639 . 10 1 1 A 57 57 ASP CB C 57 40.134 40.545 -0.411 1
1 640 . 10 1 1 A 57 57 ASP N N 57 126.239 121.037 5.202 1
1 641 . 10 1 1 A 58 58 TRP H H 58 8.244 8.557 -0.313 1
1 642 . 10 1 1 A 58 58 TRP HA H 58 4.030 4.664 -0.634 1
1 650 . 10 1 1 A 58 58 TRP C C 58 177.432 179.155 -1.723 1
1 651 . 10 1 1 A 58 58 TRP CA C 58 62.731 60.144 2.587 1
1 652 . 10 1 1 A 58 58 TRP CB C 58 29.122 29.355 -0.233 1
1 657 . 10 1 1 A 58 58 TRP N N 58 119.241 120.516 -1.275 1
1 659 . 10 1 1 A 59 59 ASN H H 59 8.098 8.944 -0.846 1
1 660 . 10 1 1 A 59 59 ASN HA H 59 4.424 4.501 -0.077 1
1 663 . 10 1 1 A 59 59 ASN C C 59 176.952 178.028 -1.076 1
1 664 . 10 1 1 A 59 59 ASN CA C 59 58.135 56.716 1.419 1
1 665 . 10 1 1 A 59 59 ASN CB C 59 40.168 39.212 0.956 1
1 666 . 10 1 1 A 59 59 ASN N N 59 115.747 118.091 -2.344 1
1 667 . 10 1 1 A 60 60 THR H H 60 8.712 7.979 0.733 1
1 668 . 10 1 1 A 60 60 THR HA H 60 3.717 4.019 -0.302 1
1 673 . 10 1 1 A 60 60 THR C C 60 176.044 176.564 -0.520 1
1 674 . 10 1 1 A 60 60 THR CA C 60 66.576 66.913 -0.337 1
1 675 . 10 1 1 A 60 60 THR CB C 60 69.251 67.941 1.310 1
1 677 . 10 1 1 A 60 60 THR N N 60 114.896 116.182 -1.286 1
1 678 . 10 1 1 A 61 61 LEU H H 61 8.485 8.573 -0.088 1
1 679 . 10 1 1 A 61 61 LEU HA H 61 3.391 3.960 -0.569 1
1 689 . 10 1 1 A 61 61 LEU C C 61 177.433 178.619 -1.186 1
1 690 . 10 1 1 A 61 61 LEU CA C 61 58.354 58.691 -0.337 1
1 691 . 10 1 1 A 61 61 LEU CB C 61 41.761 42.373 -0.612 1
1 695 . 10 1 1 A 61 61 LEU N N 61 123.433 121.997 1.436 1
1 696 . 10 1 1 A 62 62 VAL H H 62 8.073 8.256 -0.183 1
1 697 . 10 1 1 A 62 62 VAL HA H 62 3.207 3.740 -0.533 1
1 705 . 10 1 1 A 62 62 VAL C C 62 177.585 177.918 -0.333 1
1 706 . 10 1 1 A 62 62 VAL CA C 62 67.345 65.187 2.158 1
1 707 . 10 1 1 A 62 62 VAL CB C 62 30.905 30.572 0.333 1
1 710 . 10 1 1 A 62 62 VAL N N 62 116.018 118.286 -2.268 1
1 711 . 10 1 1 A 63 63 ARG H H 63 7.765 7.719 0.046 1
1 712 . 10 1 1 A 63 63 ARG HA H 63 3.602 3.827 -0.225 1
1 719 . 10 1 1 A 63 63 ARG C C 63 177.818 178.145 -0.327 1
1 720 . 10 1 1 A 63 63 ARG CA C 63 58.049 59.499 -1.450 1
1 721 . 10 1 1 A 63 63 ARG CB C 63 29.955 30.015 -0.060 1
1 724 . 10 1 1 A 63 63 ARG N N 63 116.700 121.603 -4.903 1
1 725 . 10 1 1 A 64 64 ALA H H 64 7.574 7.645 -0.071 1
1 726 . 10 1 1 A 64 64 ALA HA H 64 4.158 4.301 -0.143 1
1 730 . 10 1 1 A 64 64 ALA C C 64 179.886 179.321 0.565 1
1 731 . 10 1 1 A 64 64 ALA CA C 64 54.007 54.088 -0.081 1
1 732 . 10 1 1 A 64 64 ALA CB C 64 19.147 19.666 -0.519 1
1 733 . 10 1 1 A 64 64 ALA N N 64 117.555 121.634 -4.079 1
1 734 . 10 1 1 A 65 65 VAL H H 65 7.554 7.839 -0.285 1
1 735 . 10 1 1 A 65 65 VAL HA H 65 4.253 3.807 0.446 1
1 743 . 10 1 1 A 65 65 VAL C C 65 174.180 176.333 -2.153 1
1 744 . 10 1 1 A 65 65 VAL CA C 65 62.683 65.220 -2.537 1
1 745 . 10 1 1 A 65 65 VAL CB C 65 33.458 31.260 2.198 1
1 748 . 10 1 1 A 65 65 VAL N N 65 110.013 115.733 -5.720 1
1 749 . 10 1 1 A 66 66 LEU H H 66 7.792 7.093 0.699 1
1 750 . 10 1 1 A 66 66 LEU HA H 66 4.790 4.751 0.039 1
1 760 . 10 1 1 A 66 66 LEU C C 66 177.537 175.429 2.108 1
1 761 . 10 1 1 A 66 66 LEU CA C 66 52.823 52.608 0.215 1
1 762 . 10 1 1 A 66 66 LEU CB C 66 44.071 45.483 -1.412 1
1 766 . 10 1 1 A 66 66 LEU N N 66 118.967 121.301 -2.334 1
1 767 . 10 1 1 A 67 67 SER H H 67 9.208 8.363 0.845 1
1 768 . 10 1 1 A 67 67 SER HA H 67 4.414 5.026 -0.612 1
1 771 . 10 1 1 A 67 67 SER CA C 67 57.943 57.419 0.524 1
1 772 . 10 1 1 A 67 67 SER CB C 67 64.743 66.917 -2.174 1
1 773 . 10 1 1 A 67 67 SER N N 67 116.378 115.249 1.129 1
1 774 . 10 1 1 A 69 69 GLY HA2 H 69 3.916 3.704 0.212 1
1 775 . 10 1 1 A 69 69 GLY HA3 H 69 3.867 3.737 0.130 1
1 776 . 10 1 1 A 69 69 GLY C C 69 176.783 175.500 1.283 1
1 777 . 10 1 1 A 69 69 GLY CA C 69 46.977 46.842 0.135 1
1 778 . 10 1 1 A 70 70 ASP H H 70 7.674 8.018 -0.344 1
1 779 . 10 1 1 A 70 70 ASP HA H 70 4.511 3.518 0.993 1
1 782 . 10 1 1 A 70 70 ASP C C 70 178.096 178.152 -0.056 1
1 783 . 10 1 1 A 70 70 ASP CA C 70 57.262 56.398 0.864 1
1 784 . 10 1 1 A 70 70 ASP CB C 70 40.594 39.621 0.973 1
1 785 . 10 1 1 A 70 70 ASP N N 70 123.930 122.083 1.847 1
1 786 . 10 1 1 A 71 71 HIS H H 71 8.729 7.854 0.875 1
1 787 . 10 1 1 A 71 71 HIS HA H 71 4.235 4.127 0.108 1
1 790 . 10 1 1 A 71 71 HIS C C 71 176.769 176.671 0.098 1
1 791 . 10 1 1 A 71 71 HIS CA C 71 60.041 59.674 0.367 1
1 792 . 10 1 1 A 71 71 HIS CB C 71 30.682 30.138 0.544 1
1 793 . 10 1 1 A 71 71 HIS N N 71 121.003 119.413 1.590 1
1 794 . 10 1 1 A 72 72 LEU H H 72 7.620 7.887 -0.267 1
1 795 . 10 1 1 A 72 72 LEU HA H 72 3.769 3.829 -0.060 1
1 805 . 10 1 1 A 72 72 LEU C C 72 180.275 179.075 1.200 1
1 806 . 10 1 1 A 72 72 LEU CA C 72 58.192 57.935 0.257 1
1 807 . 10 1 1 A 72 72 LEU CB C 72 41.381 41.231 0.150 1
1 811 . 10 1 1 A 72 72 LEU N N 72 118.569 118.642 -0.073 1
1 812 . 10 1 1 A 73 73 LEU H H 73 7.542 7.389 0.153 1
1 813 . 10 1 1 A 73 73 LEU HA H 73 4.107 4.183 -0.076 1
1 823 . 10 1 1 A 73 73 LEU C C 73 179.436 179.097 0.339 1
1 824 . 10 1 1 A 73 73 LEU CA C 73 58.026 57.139 0.887 1
1 825 . 10 1 1 A 73 73 LEU CB C 73 41.638 42.064 -0.426 1
1 829 . 10 1 1 A 73 73 LEU N N 73 121.418 120.322 1.096 1
1 830 . 10 1 1 A 74 74 TRP H H 74 8.786 7.907 0.879 1
1 831 . 10 1 1 A 74 74 TRP HA H 74 3.589 5.233 -1.644 1
1 840 . 10 1 1 A 74 74 TRP C C 74 176.816 178.478 -1.662 1
1 841 . 10 1 1 A 74 74 TRP CA C 74 63.046 59.608 3.438 1
1 842 . 10 1 1 A 74 74 TRP CB C 74 28.065 28.844 -0.779 1
1 848 . 10 1 1 A 74 74 TRP N N 74 121.111 118.057 3.054 1
1 850 . 10 1 1 A 75 75 LYS H H 75 8.939 7.327 1.612 1
1 851 . 10 1 1 A 75 75 LYS HA H 75 3.055 3.893 -0.838 1
1 860 . 10 1 1 A 75 75 LYS C C 75 177.967 178.657 -0.690 1
1 861 . 10 1 1 A 75 75 LYS CA C 75 60.029 58.327 1.702 1
1 862 . 10 1 1 A 75 75 LYS CB C 75 32.533 32.604 -0.071 1
1 866 . 10 1 1 A 75 75 LYS N N 75 119.783 118.365 1.418 1
1 867 . 10 1 1 A 76 76 SER H H 76 7.832 7.643 0.189 1
1 868 . 10 1 1 A 76 76 SER HA H 76 4.040 3.878 0.162 1
1 871 . 10 1 1 A 76 76 SER C C 76 177.816 176.993 0.823 1
1 872 . 10 1 1 A 76 76 SER CA C 76 62.105 62.156 -0.051 1
1 873 . 10 1 1 A 76 76 SER CB C 76 62.679 62.807 -0.128 1
1 874 . 10 1 1 A 76 76 SER N N 76 113.395 116.664 -3.269 1
1 875 . 10 1 1 A 77 77 GLU H H 77 7.590 7.500 0.090 1
1 876 . 10 1 1 A 77 77 GLU HA H 77 4.042 4.188 -0.146 1
1 881 . 10 1 1 A 77 77 GLU C C 77 177.809 178.470 -0.661 1
1 882 . 10 1 1 A 77 77 GLU CA C 77 58.270 58.617 -0.347 1
1 883 . 10 1 1 A 77 77 GLU CB C 77 29.208 29.326 -0.118 1
1 885 . 10 1 1 A 77 77 GLU N N 77 121.574 121.506 0.068 1
1 886 . 10 1 1 A 78 78 PHE H H 78 9.081 7.608 1.473 1
1 887 . 10 1 1 A 78 78 PHE HA H 78 3.778 4.223 -0.445 1
1 895 . 10 1 1 A 78 78 PHE C C 78 178.114 177.566 0.548 1
1 896 . 10 1 1 A 78 78 PHE CA C 78 60.629 61.208 -0.579 1
1 897 . 10 1 1 A 78 78 PHE CB C 78 38.295 38.179 0.116 1
1 902 . 10 1 1 A 78 78 PHE N N 78 122.682 121.952 0.730 1
1 903 . 10 1 1 A 79 79 PHE H H 79 8.890 7.564 1.326 1
1 904 . 10 1 1 A 79 79 PHE HA H 79 3.800 4.027 -0.227 1
1 912 . 10 1 1 A 79 79 PHE C C 79 178.354 178.329 0.025 1
1 913 . 10 1 1 A 79 79 PHE CA C 79 60.704 61.755 -1.051 1
1 914 . 10 1 1 A 79 79 PHE CB C 79 37.184 38.497 -1.313 1
1 920 . 10 1 1 A 79 79 PHE N N 79 121.056 118.287 2.769 1
1 921 . 10 1 1 A 80 80 GLU H H 80 7.793 8.155 -0.362 1
1 922 . 10 1 1 A 80 80 GLU HA H 80 4.082 3.970 0.112 1
1 927 . 10 1 1 A 80 80 GLU C C 80 179.068 179.477 -0.409 1
1 928 . 10 1 1 A 80 80 GLU CA C 80 59.735 59.560 0.175 1
1 929 . 10 1 1 A 80 80 GLU CB C 80 28.722 29.133 -0.411 1
1 931 . 10 1 1 A 80 80 GLU N N 80 120.312 118.444 1.868 1
1 932 . 10 1 1 A 81 81 ASN H H 81 8.624 8.629 -0.005 1
1 933 . 10 1 1 A 81 81 ASN HA H 81 4.521 4.509 0.012 1
1 938 . 10 1 1 A 81 81 ASN C C 81 179.262 178.144 1.118 1
1 939 . 10 1 1 A 81 81 ASN CA C 81 55.504 56.474 -0.970 1
1 940 . 10 1 1 A 81 81 ASN CB C 81 37.517 37.861 -0.344 1
1 941 . 10 1 1 A 81 81 ASN N N 81 119.338 118.587 0.751 1
1 943 . 10 1 1 A 82 82 CYS H H 82 8.554 7.953 0.601 1
1 944 . 10 1 1 A 82 82 CYS HA H 82 3.792 4.058 -0.266 1
1 947 . 10 1 1 A 82 82 CYS C C 82 176.478 176.872 -0.394 1
1 948 . 10 1 1 A 82 82 CYS CA C 82 65.232 63.366 1.866 1
1 949 . 10 1 1 A 82 82 CYS CB C 82 26.762 27.271 -0.509 1
1 950 . 10 1 1 A 82 82 CYS N N 82 120.576 117.631 2.945 1
1 951 . 10 1 1 A 83 83 ARG H H 83 8.522 8.174 0.348 1
1 952 . 10 1 1 A 83 83 ARG HA H 83 3.932 4.159 -0.227 1
1 960 . 10 1 1 A 83 83 ARG C C 83 179.138 178.744 0.394 1
1 961 . 10 1 1 A 83 83 ARG CA C 83 60.443 58.994 1.449 1
1 962 . 10 1 1 A 83 83 ARG CB C 83 29.550 30.106 -0.556 1
1 965 . 10 1 1 A 83 83 ARG N N 83 123.035 119.697 3.338 1
1 967 . 10 1 1 A 84 84 ASP H H 84 7.791 8.446 -0.655 1
1 968 . 10 1 1 A 84 84 ASP HA H 84 4.353 4.417 -0.064 1
1 971 . 10 1 1 A 84 84 ASP C C 84 178.649 178.534 0.115 1
1 972 . 10 1 1 A 84 84 ASP CA C 84 57.767 57.581 0.186 1
1 973 . 10 1 1 A 84 84 ASP CB C 84 41.305 41.457 -0.152 1
1 974 . 10 1 1 A 84 84 ASP N N 84 120.332 119.548 0.784 1
1 975 . 10 1 1 A 85 85 THR H H 85 8.370 7.923 0.447 1
1 976 . 10 1 1 A 85 85 THR HA H 85 3.730 3.930 -0.200 1
1 981 . 10 1 1 A 85 85 THR C C 85 175.198 176.052 -0.854 1
1 982 . 10 1 1 A 85 85 THR CA C 85 66.830 66.324 0.506 1
1 983 . 10 1 1 A 85 85 THR CB C 85 68.533 68.246 0.287 1
1 985 . 10 1 1 A 85 85 THR N N 85 117.360 115.731 1.629 1
1 986 . 10 1 1 A 86 86 ALA H H 86 8.845 8.419 0.426 1
1 987 . 10 1 1 A 86 86 ALA HA H 86 3.991 4.063 -0.072 1
1 991 . 10 1 1 A 86 86 ALA C C 86 179.980 179.576 0.404 1
1 992 . 10 1 1 A 86 86 ALA CA C 86 55.769 55.563 0.206 1
1 993 . 10 1 1 A 86 86 ALA CB C 86 17.881 18.247 -0.366 1
1 994 . 10 1 1 A 86 86 ALA N N 86 123.613 123.914 -0.301 1
1 995 . 10 1 1 A 87 87 LYS H H 87 7.686 8.155 -0.469 1
1 996 . 10 1 1 A 87 87 LYS HA H 87 4.099 4.088 0.011 1
1 1005 . 10 1 1 A 87 87 LYS C C 87 179.592 178.753 0.839 1
1 1006 . 10 1 1 A 87 87 LYS CA C 87 59.708 59.163 0.545 1
1 1007 . 10 1 1 A 87 87 LYS CB C 87 32.054 31.895 0.159 1
1 1011 . 10 1 1 A 87 87 LYS N N 87 119.623 116.430 3.193 1
1 1012 . 10 1 1 A 88 88 ARG H H 88 7.683 8.105 -0.422 1
1 1013 . 10 1 1 A 88 88 ARG HA H 88 4.051 4.150 -0.099 1
1 1020 . 10 1 1 A 88 88 ARG C C 88 180.053 179.003 1.050 1
1 1021 . 10 1 1 A 88 88 ARG CA C 88 59.558 58.990 0.568 1
1 1022 . 10 1 1 A 88 88 ARG CB C 88 29.684 30.030 -0.346 1
1 1025 . 10 1 1 A 88 88 ARG N N 88 120.788 119.562 1.226 1
1 1026 . 10 1 1 A 89 89 ASN H H 89 8.973 8.418 0.555 1
1 1027 . 10 1 1 A 89 89 ASN HA H 89 4.354 4.654 -0.300 1
1 1032 . 10 1 1 A 89 89 ASN C C 89 178.382 178.647 -0.265 1
1 1033 . 10 1 1 A 89 89 ASN CA C 89 55.334 55.808 -0.474 1
1 1034 . 10 1 1 A 89 89 ASN CB C 89 37.864 37.883 -0.019 1
1 1035 . 10 1 1 A 89 89 ASN N N 89 121.012 118.152 2.860 1
1 1037 . 10 1 1 A 90 90 GLN H H 90 8.152 7.960 0.192 1
1 1038 . 10 1 1 A 90 90 GLN HA H 90 4.020 4.191 -0.171 1
1 1045 . 10 1 1 A 90 90 GLN C C 90 179.075 178.927 0.148 1
1 1046 . 10 1 1 A 90 90 GLN CA C 90 59.318 58.911 0.407 1
1 1047 . 10 1 1 A 90 90 GLN CB C 90 28.049 28.543 -0.494 1
1 1049 . 10 1 1 A 90 90 GLN N N 90 122.122 121.039 1.083 1
1 1051 . 10 1 1 A 91 91 GLN H H 91 7.514 8.194 -0.680 1
1 1052 . 10 1 1 A 91 91 GLN HA H 91 4.053 4.087 -0.034 1
1 1059 . 10 1 1 A 91 91 GLN C C 91 177.081 177.499 -0.418 1
1 1060 . 10 1 1 A 91 91 GLN CA C 91 58.031 58.618 -0.587 1
1 1061 . 10 1 1 A 91 91 GLN CB C 91 28.365 27.897 0.468 1
1 1063 . 10 1 1 A 91 91 GLN N N 91 118.124 118.070 0.054 1
1 1065 . 10 1 1 A 92 92 ALA H H 92 7.704 7.416 0.288 1
1 1066 . 10 1 1 A 92 92 ALA HA H 92 4.246 4.350 -0.104 1
1 1070 . 10 1 1 A 92 92 ALA C C 92 178.450 177.880 0.570 1
1 1071 . 10 1 1 A 92 92 ALA CA C 92 52.671 52.260 0.411 1
1 1072 . 10 1 1 A 92 92 ALA CB C 92 19.316 19.843 -0.527 1
1 1073 . 10 1 1 A 92 92 ALA N N 92 119.880 120.438 -0.558 1
1 1074 . 10 1 1 A 93 93 GLY H H 93 7.693 7.681 0.012 1
1 1075 . 10 1 1 A 93 93 GLY HA2 H 93 3.941 3.914 0.027 1
1 1076 . 10 1 1 A 93 93 GLY HA3 H 93 3.744 3.926 -0.182 1
1 1077 . 10 1 1 A 93 93 GLY C C 93 174.344 174.728 -0.384 1
1 1078 . 10 1 1 A 93 93 GLY CA C 93 45.949 46.697 -0.748 1
1 1079 . 10 1 1 A 93 93 GLY N N 93 105.347 107.240 -1.893 1
1 1080 . 10 1 1 A 94 94 ASN H H 94 7.076 8.613 -1.537 1
1 1081 . 10 1 1 A 94 94 ASN HA H 94 4.115 4.697 -0.582 1
1 1085 . 10 1 1 A 94 94 ASN C C 94 175.410 175.152 0.258 1
1 1086 . 10 1 1 A 94 94 ASN CA C 94 52.651 53.491 -0.840 1
1 1087 . 10 1 1 A 94 94 ASN CB C 94 38.330 39.131 -0.801 1
1 1088 . 10 1 1 A 94 94 ASN N N 94 115.747 118.675 -2.928 1
1 1090 . 10 1 1 A 95 95 GLY H H 95 8.236 8.109 0.127 1
1 1091 . 10 1 1 A 95 95 GLY HA2 H 95 3.633 3.605 0.028 1
1 1092 . 10 1 1 A 95 95 GLY HA3 H 95 3.633 3.835 -0.202 1
1 1093 . 10 1 1 A 95 95 GLY C C 95 174.450 173.837 0.613 1
1 1094 . 10 1 1 A 95 95 GLY CA C 95 45.522 45.209 0.313 1
1 1095 . 10 1 1 A 95 95 GLY N N 95 109.166 106.852 2.314 1
1 1096 . 10 1 1 A 96 96 TRP H H 96 7.899 7.777 0.122 1
1 1097 . 10 1 1 A 96 96 TRP HA H 96 5.241 4.758 0.483 1
1 1106 . 10 1 1 A 96 96 TRP C C 96 175.661 176.042 -0.381 1
1 1107 . 10 1 1 A 96 96 TRP CA C 96 55.090 57.408 -2.318 1
1 1108 . 10 1 1 A 96 96 TRP CB C 96 27.138 31.256 -4.118 1
1 1114 . 10 1 1 A 96 96 TRP N N 96 122.840 120.873 1.967 1
1 1116 . 10 1 1 A 97 97 ASP H H 97 7.344 9.196 -1.852 1
1 1117 . 10 1 1 A 97 97 ASP HA H 97 4.829 5.223 -0.394 1
1 1120 . 10 1 1 A 97 97 ASP C C 97 175.019 176.321 -1.302 1
1 1121 . 10 1 1 A 97 97 ASP CA C 97 52.149 52.736 -0.587 1
1 1122 . 10 1 1 A 97 97 ASP CB C 97 42.697 44.464 -1.767 1
1 1123 . 10 1 1 A 97 97 ASP N N 97 126.861 119.888 6.973 1
1 1124 . 10 1 1 A 98 98 PHE H H 98 8.566 9.146 -0.580 1
1 1125 . 10 1 1 A 98 98 PHE HA H 98 3.727 4.346 -0.619 1
1 1133 . 10 1 1 A 98 98 PHE C C 98 177.443 176.882 0.561 1
1 1134 . 10 1 1 A 98 98 PHE CA C 98 62.471 60.378 2.093 1
1 1135 . 10 1 1 A 98 98 PHE CB C 98 39.919 38.121 1.798 1
1 1141 . 10 1 1 A 98 98 PHE N N 98 117.781 118.694 -0.913 1
1 1142 . 10 1 1 A 99 99 ASP H H 99 8.259 8.004 0.255 1
1 1143 . 10 1 1 A 99 99 ASP HA H 99 3.960 3.935 0.025 1
1 1146 . 10 1 1 A 99 99 ASP C C 99 178.132 178.752 -0.620 1
1 1147 . 10 1 1 A 99 99 ASP CA C 99 57.658 56.357 1.301 1
1 1148 . 10 1 1 A 99 99 ASP CB C 99 38.572 40.698 -2.126 1
1 1149 . 10 1 1 A 99 99 ASP N N 99 121.709 119.951 1.758 1
1 1150 . 10 1 1 A 100 100 MET H H 100 8.008 8.945 -0.937 1
1 1151 . 10 1 1 A 100 100 MET HA H 100 3.644 4.250 -0.606 1
1 1156 . 10 1 1 A 100 100 MET C C 100 180.008 176.733 3.275 1
1 1157 . 10 1 1 A 100 100 MET CA C 100 58.598 58.383 0.215 1
1 1158 . 10 1 1 A 100 100 MET CB C 100 33.423 32.813 0.610 1
1 1160 . 10 1 1 A 100 100 MET N N 100 119.668 118.157 1.511 1
1 1161 . 10 1 1 A 101 101 LEU H H 101 7.961 8.147 -0.186 1
1 1162 . 10 1 1 A 101 101 LEU HA H 101 3.523 4.370 -0.847 1
1 1172 . 10 1 1 A 101 101 LEU C C 101 173.873 176.454 -2.581 1
1 1173 . 10 1 1 A 101 101 LEU CA C 101 58.743 53.757 4.986 1
1 1174 . 10 1 1 A 101 101 LEU CB C 101 42.632 42.285 0.347 1
1 1178 . 10 1 1 A 101 101 LEU N N 101 119.752 119.613 0.139 1
1 1179 . 10 1 1 A 102 102 THR H H 102 6.955 8.759 -1.804 1
1 1180 . 10 1 1 A 102 102 THR HA H 102 4.134 4.295 -0.161 1
1 1185 . 10 1 1 A 102 102 THR C C 102 176.513 175.252 1.261 1
1 1186 . 10 1 1 A 102 102 THR CA C 102 61.125 63.571 -2.446 1
1 1187 . 10 1 1 A 102 102 THR CB C 102 71.415 68.500 2.915 1
1 1189 . 10 1 1 A 102 102 THR N N 102 124.665 120.635 4.030 1
1 1190 . 10 1 1 A 103 103 GLY H H 103 7.816 7.948 -0.132 1
1 1191 . 10 1 1 A 103 103 GLY HA2 H 103 3.824 3.258 0.566 1
1 1192 . 10 1 1 A 103 103 GLY HA3 H 103 3.824 3.568 0.256 1
1 1193 . 10 1 1 A 103 103 GLY C C 103 174.126 175.090 -0.964 1
1 1194 . 10 1 1 A 103 103 GLY CA C 103 47.805 46.968 0.837 1
1 1195 . 10 1 1 A 103 103 GLY N N 103 114.191 109.925 4.266 1
1 1196 . 10 1 1 A 104 104 SER H H 104 8.860 8.585 0.275 1
1 1197 . 10 1 1 A 104 104 SER HA H 104 4.758 4.503 0.255 1
1 1200 . 10 1 1 A 104 104 SER C C 104 174.591 174.952 -0.361 1
1 1201 . 10 1 1 A 104 104 SER CA C 104 56.755 58.903 -2.148 1
1 1202 . 10 1 1 A 104 104 SER CB C 104 65.050 62.044 3.006 1
1 1203 . 10 1 1 A 104 104 SER N N 104 114.771 114.825 -0.054 1
1 1204 . 10 1 1 A 105 105 GLY H H 105 8.788 8.264 0.524 1
1 1205 . 10 1 1 A 105 105 GLY HA2 H 105 3.733 3.663 0.070 1
1 1206 . 10 1 1 A 105 105 GLY HA3 H 105 3.733 3.709 0.024 1
1 1207 . 10 1 1 A 105 105 GLY CA C 105 47.247 46.553 0.694 1
1 1208 . 10 1 1 A 105 105 GLY N N 105 110.394 108.923 1.471 1
1 1209 . 10 1 1 A 106 106 ASN HA H 106 4.454 4.641 -0.187 1
1 1212 . 10 1 1 A 106 106 ASN C C 106 175.180 176.541 -1.361 1
1 1213 . 10 1 1 A 106 106 ASN CA C 106 54.492 55.069 -0.577 1
1 1214 . 10 1 1 A 106 106 ASN CB C 106 37.282 39.628 -2.346 1
1 1215 . 10 1 1 A 107 107 TYR H H 107 8.241 7.050 1.191 1
1 1216 . 10 1 1 A 107 107 TYR HA H 107 4.335 4.819 -0.484 1
1 1223 . 10 1 1 A 107 107 TYR C C 107 173.954 176.062 -2.108 1
1 1224 . 10 1 1 A 107 107 TYR CA C 107 57.727 57.611 0.116 1
1 1225 . 10 1 1 A 107 107 TYR CB C 107 37.063 40.000 -2.937 1
1 1230 . 10 1 1 A 107 107 TYR N N 107 120.708 112.272 8.436 1
1 1231 . 10 1 1 A 108 108 SER H H 108 7.117 7.737 -0.620 1
1 1232 . 10 1 1 A 108 108 SER HA H 108 4.221 4.290 -0.069 1
1 1235 . 10 1 1 A 108 108 SER C C 108 174.834 174.534 0.300 1
1 1236 . 10 1 1 A 108 108 SER CA C 108 59.859 60.415 -0.556 1
1 1237 . 10 1 1 A 108 108 SER CB C 108 63.846 63.496 0.350 1
1 1238 . 10 1 1 A 108 108 SER N N 108 113.362 117.796 -4.434 1
1 1239 . 10 1 1 A 109 109 SER H H 109 8.053 8.778 -0.725 1
1 1240 . 10 1 1 A 109 109 SER HA H 109 4.560 4.869 -0.309 1
1 1243 . 10 1 1 A 109 109 SER CA C 109 57.141 57.033 0.108 1
1 1244 . 10 1 1 A 109 109 SER CB C 109 64.874 65.282 -0.408 1
1 1245 . 10 1 1 A 109 109 SER N N 109 116.657 119.915 -3.258 1
1 1246 . 10 1 1 A 110 110 THR HA H 110 3.541 3.903 -0.362 1
1 1251 . 10 1 1 A 110 110 THR C C 110 175.477 176.323 -0.846 1
1 1252 . 10 1 1 A 110 110 THR CA C 110 66.443 66.443 0.000 1
1 1253 . 10 1 1 A 110 110 THR CB C 110 68.091 68.750 -0.659 1
1 1255 . 10 1 1 A 111 111 ASP H H 111 8.224 8.218 0.006 1
1 1256 . 10 1 1 A 111 111 ASP HA H 111 4.237 4.381 -0.144 1
1 1259 . 10 1 1 A 111 111 ASP C C 111 177.520 178.522 -1.002 1
1 1260 . 10 1 1 A 111 111 ASP CA C 111 57.559 56.738 0.821 1
1 1261 . 10 1 1 A 111 111 ASP CB C 111 40.292 40.459 -0.167 1
1 1262 . 10 1 1 A 111 111 ASP N N 111 119.490 120.315 -0.825 1
1 1263 . 10 1 1 A 112 112 ALA H H 112 7.431 8.058 -0.627 1
1 1264 . 10 1 1 A 112 112 ALA HA H 112 4.191 4.236 -0.045 1
1 1268 . 10 1 1 A 112 112 ALA C C 112 180.646 179.785 0.861 1
1 1269 . 10 1 1 A 112 112 ALA CA C 112 54.534 54.938 -0.404 1
1 1270 . 10 1 1 A 112 112 ALA CB C 112 18.992 18.449 0.543 1
1 1271 . 10 1 1 A 112 112 ALA N N 112 119.710 122.161 -2.451 1
1 1272 . 10 1 1 A 113 113 GLN H H 113 7.576 8.119 -0.543 1
1 1273 . 10 1 1 A 113 113 GLN HA H 113 3.562 4.228 -0.666 1
1 1278 . 10 1 1 A 113 113 GLN C C 113 176.756 178.417 -1.661 1
1 1279 . 10 1 1 A 113 113 GLN CA C 113 57.736 58.173 -0.437 1
1 1280 . 10 1 1 A 113 113 GLN CB C 113 29.110 28.548 0.562 1
1 1281 . 10 1 1 A 113 113 GLN N N 113 117.518 115.854 1.664 1
1 1283 . 10 1 1 A 114 114 MET H H 114 8.192 7.818 0.374 1
1 1284 . 10 1 1 A 114 114 MET HA H 114 4.231 4.251 -0.020 1
1 1289 . 10 1 1 A 114 114 MET C C 114 175.648 177.123 -1.475 1
1 1290 . 10 1 1 A 114 114 MET CA C 114 57.446 57.932 -0.486 1
1 1291 . 10 1 1 A 114 114 MET CB C 114 33.570 32.660 0.910 1
1 1293 . 10 1 1 A 114 114 MET N N 114 111.509 119.715 -8.206 1
1 1294 . 10 1 1 A 115 115 GLN H H 115 6.940 7.756 -0.816 1
1 1295 . 10 1 1 A 115 115 GLN HA H 115 4.307 4.381 -0.074 1
1 1302 . 10 1 1 A 115 115 GLN C C 115 176.270 174.614 1.656 1
1 1303 . 10 1 1 A 115 115 GLN CA C 115 54.680 54.868 -0.188 1
1 1304 . 10 1 1 A 115 115 GLN CB C 115 28.233 28.795 -0.562 1
1 1306 . 10 1 1 A 115 115 GLN N N 115 114.300 116.029 -1.729 1
1 1308 . 10 1 1 A 116 116 TYR H H 116 6.677 7.663 -0.986 1
1 1309 . 10 1 1 A 116 116 TYR HA H 116 4.193 4.520 -0.327 1
1 1312 . 10 1 1 A 116 116 TYR C C 116 175.268 175.285 -0.017 1
1 1313 . 10 1 1 A 116 116 TYR CA C 116 54.357 57.827 -3.470 1
1 1314 . 10 1 1 A 116 116 TYR CB C 116 35.498 39.029 -3.531 1
1 1315 . 10 1 1 A 116 116 TYR N N 116 117.919 118.680 -0.761 1
1 1316 . 10 1 1 A 117 117 ASP H H 117 8.081 9.179 -1.098 1
1 1317 . 10 1 1 A 117 117 ASP HA H 117 4.665 4.948 -0.283 1
1 1320 . 10 1 1 A 117 117 ASP CA C 117 52.422 52.300 0.122 1
1 1321 . 10 1 1 A 117 117 ASP CB C 117 42.416 40.685 1.731 1
1 1322 . 10 1 1 A 117 117 ASP N N 117 120.887 121.859 -0.972 1
1 1323 . 10 1 1 A 118 118 PRO C C 118 179.180 178.588 0.592 1
1 1324 . 10 1 1 A 118 118 PRO CA C 118 65.942 64.701 1.241 1
1 1325 . 10 1 1 A 118 118 PRO CB C 118 32.197 31.844 0.353 1
1 1326 . 10 1 1 A 119 119 GLY H H 119 9.742 8.368 1.374 1
1 1327 . 10 1 1 A 119 119 GLY C C 119 175.622 175.030 0.592 1
1 1328 . 10 1 1 A 119 119 GLY CA C 119 46.785 46.430 0.355 1
1 1329 . 10 1 1 A 119 119 GLY N N 119 106.412 106.712 -0.300 1
1 1330 . 10 1 1 A 120 120 LEU H H 120 6.666 7.238 -0.572 1
1 1331 . 10 1 1 A 120 120 LEU HA H 120 3.365 3.321 0.044 1
1 1341 . 10 1 1 A 120 120 LEU C C 120 179.262 178.592 0.670 1
1 1342 . 10 1 1 A 120 120 LEU CA C 120 56.605 57.650 -1.045 1
1 1343 . 10 1 1 A 120 120 LEU CB C 120 39.262 41.460 -2.198 1
1 1347 . 10 1 1 A 120 120 LEU N N 120 126.226 122.233 3.993 1
1 1348 . 10 1 1 A 121 121 PHE H H 121 7.356 8.904 -1.548 1
1 1349 . 10 1 1 A 121 121 PHE HA H 121 4.459 3.972 0.487 1
1 1352 . 10 1 1 A 121 121 PHE C C 121 179.716 176.956 2.760 1
1 1353 . 10 1 1 A 121 121 PHE CA C 121 62.838 62.055 0.783 1
1 1354 . 10 1 1 A 121 121 PHE CB C 121 37.603 39.269 -1.666 1
1 1355 . 10 1 1 A 121 121 PHE N N 121 117.437 119.431 -1.994 1
1 1356 . 10 1 1 A 122 122 ALA H H 122 7.926 7.908 0.018 1
1 1357 . 10 1 1 A 122 122 ALA HA H 122 4.523 3.809 0.714 1
1 1361 . 10 1 1 A 122 122 ALA C C 122 180.435 179.776 0.659 1
1 1362 . 10 1 1 A 122 122 ALA CA C 122 55.527 55.239 0.288 1
1 1363 . 10 1 1 A 122 122 ALA CB C 122 17.814 17.944 -0.130 1
1 1364 . 10 1 1 A 122 122 ALA N N 122 121.068 121.328 -0.260 1
1 1365 . 10 1 1 A 123 123 GLN H H 123 7.507 8.057 -0.550 1
1 1366 . 10 1 1 A 123 123 GLN HA H 123 4.153 3.909 0.244 1
1 1371 . 10 1 1 A 123 123 GLN C C 123 180.561 178.843 1.718 1
1 1372 . 10 1 1 A 123 123 GLN CA C 123 59.948 59.089 0.859 1
1 1373 . 10 1 1 A 123 123 GLN CB C 123 29.135 28.223 0.912 1
1 1375 . 10 1 1 A 123 123 GLN N N 123 120.324 117.159 3.165 1
1 1376 . 10 1 1 A 124 124 ILE H H 124 8.318 7.903 0.415 1
1 1377 . 10 1 1 A 124 124 ILE HA H 124 3.635 3.829 -0.194 1
1 1387 . 10 1 1 A 124 124 ILE C C 124 176.481 178.084 -1.603 1
1 1388 . 10 1 1 A 124 124 ILE CA C 124 66.432 64.184 2.248 1
1 1389 . 10 1 1 A 124 124 ILE CB C 124 39.168 37.684 1.484 1
1 1393 . 10 1 1 A 124 124 ILE N N 124 123.747 118.214 5.533 1
1 1394 . 10 1 1 A 125 125 GLN H H 125 8.474 7.997 0.477 1
1 1395 . 10 1 1 A 125 125 GLN HA H 125 4.264 3.918 0.346 1
1 1402 . 10 1 1 A 125 125 GLN C C 125 178.947 177.847 1.100 1
1 1403 . 10 1 1 A 125 125 GLN CA C 125 59.651 58.461 1.190 1
1 1404 . 10 1 1 A 125 125 GLN CB C 125 28.880 28.392 0.488 1
1 1406 . 10 1 1 A 125 125 GLN N N 125 120.368 121.096 -0.728 1
1 1408 . 10 1 1 A 126 126 ALA H H 126 8.002 8.045 -0.043 1
1 1409 . 10 1 1 A 126 126 ALA HA H 126 4.144 4.032 0.112 1
1 1413 . 10 1 1 A 126 126 ALA C C 126 179.316 179.574 -0.258 1
1 1414 . 10 1 1 A 126 126 ALA CA C 126 55.036 54.936 0.100 1
1 1415 . 10 1 1 A 126 126 ALA CB C 126 18.087 18.012 0.075 1
1 1416 . 10 1 1 A 126 126 ALA N N 126 121.661 121.380 0.281 1
1 1417 . 10 1 1 A 127 127 ALA H H 127 7.823 8.119 -0.296 1
1 1418 . 10 1 1 A 127 127 ALA HA H 127 4.162 4.063 0.099 1
1 1422 . 10 1 1 A 127 127 ALA C C 127 180.707 179.455 1.252 1
1 1423 . 10 1 1 A 127 127 ALA CA C 127 55.080 54.789 0.291 1
1 1424 . 10 1 1 A 127 127 ALA CB C 127 19.354 18.413 0.941 1
1 1425 . 10 1 1 A 127 127 ALA N N 127 119.853 119.649 0.204 1
1 1426 . 10 1 1 A 128 128 ALA H H 128 8.936 7.893 1.043 1
1 1427 . 10 1 1 A 128 128 ALA HA H 128 3.928 3.878 0.050 1
1 1431 . 10 1 1 A 128 128 ALA C C 128 181.031 179.053 1.978 1
1 1432 . 10 1 1 A 128 128 ALA CA C 128 55.502 54.697 0.805 1
1 1433 . 10 1 1 A 128 128 ALA CB C 128 16.609 17.868 -1.259 1
1 1434 . 10 1 1 A 128 128 ALA N N 128 121.355 120.308 1.047 1
1 1435 . 10 1 1 A 129 129 THR H H 129 8.543 7.505 1.038 1
1 1436 . 10 1 1 A 129 129 THR HA H 129 4.015 3.666 0.349 1
1 1441 . 10 1 1 A 129 129 THR C C 129 177.332 176.061 1.271 1
1 1442 . 10 1 1 A 129 129 THR CA C 129 65.893 64.942 0.951 1
1 1443 . 10 1 1 A 129 129 THR CB C 129 68.566 68.490 0.076 1
1 1445 . 10 1 1 A 129 129 THR N N 129 112.709 112.111 0.598 1
1 1446 . 10 1 1 A 130 130 LYS H H 130 8.126 7.546 0.580 1
1 1447 . 10 1 1 A 130 130 LYS HA H 130 4.000 4.005 -0.005 1
1 1456 . 10 1 1 A 130 130 LYS C C 130 179.082 178.584 0.498 1
1 1457 . 10 1 1 A 130 130 LYS CA C 130 60.299 58.456 1.843 1
1 1458 . 10 1 1 A 130 130 LYS CB C 130 32.767 31.746 1.021 1
1 1462 . 10 1 1 A 130 130 LYS N N 130 123.879 120.757 3.122 1
1 1463 . 10 1 1 A 131 131 ALA H H 131 7.184 7.750 -0.566 1
1 1464 . 10 1 1 A 131 131 ALA HA H 131 4.005 4.217 -0.212 1
1 1468 . 10 1 1 A 131 131 ALA C C 131 178.482 179.489 -1.007 1
1 1469 . 10 1 1 A 131 131 ALA CA C 131 55.027 55.064 -0.037 1
1 1470 . 10 1 1 A 131 131 ALA CB C 131 18.669 19.623 -0.954 1
1 1471 . 10 1 1 A 131 131 ALA N N 131 118.590 121.184 -2.594 1
1 1472 . 10 1 1 A 132 132 TRP H H 132 7.977 8.561 -0.584 1
1 1473 . 10 1 1 A 132 132 TRP HA H 132 4.001 4.279 -0.278 1
1 1480 . 10 1 1 A 132 132 TRP C C 132 177.332 175.842 1.490 1
1 1481 . 10 1 1 A 132 132 TRP CA C 132 60.431 57.413 3.018 1
1 1482 . 10 1 1 A 132 132 TRP CB C 132 27.786 27.607 0.179 1
1 1486 . 10 1 1 A 132 132 TRP N N 132 119.168 116.973 2.195 1
1 1488 . 10 1 1 A 133 133 ARG H H 133 8.006 8.070 -0.064 1
1 1489 . 10 1 1 A 133 133 ARG HA H 133 4.027 4.328 -0.301 1
1 1497 . 10 1 1 A 133 133 ARG C C 133 176.664 177.781 -1.117 1
1 1498 . 10 1 1 A 133 133 ARG CA C 133 59.355 57.329 2.026 1
1 1499 . 10 1 1 A 133 133 ARG CB C 133 30.451 32.127 -1.676 1
1 1502 . 10 1 1 A 133 133 ARG N N 133 113.062 120.666 -7.604 1
1 1504 . 10 1 1 A 134 134 LYS H H 134 7.322 7.654 -0.332 1
1 1505 . 10 1 1 A 134 134 LYS HA H 134 4.313 4.392 -0.079 1
1 1514 . 10 1 1 A 134 134 LYS C C 134 176.282 175.864 0.418 1
1 1515 . 10 1 1 A 134 134 LYS CA C 134 54.922 56.650 -1.728 1
1 1516 . 10 1 1 A 134 134 LYS CB C 134 32.633 31.411 1.222 1
1 1520 . 10 1 1 A 134 134 LYS N N 134 118.170 118.730 -0.560 1
1 1521 . 10 1 1 A 135 135 LEU H H 135 7.440 7.964 -0.524 1
1 1522 . 10 1 1 A 135 135 LEU HA H 135 4.174 4.520 -0.346 1
1 1532 . 10 1 1 A 135 135 LEU CA C 135 54.408 53.050 1.358 1
1 1533 . 10 1 1 A 135 135 LEU CB C 135 40.407 41.388 -0.981 1
1 1537 . 10 1 1 A 135 135 LEU N N 135 123.358 121.384 1.974 1
1 1538 . 10 1 1 A 136 136 PRO HA H 136 4.437 4.438 -0.001 1
1 1545 . 10 1 1 A 136 136 PRO C C 136 177.106 176.106 1.000 1
1 1546 . 10 1 1 A 136 136 PRO CA C 136 62.889 66.060 -3.171 1
1 1547 . 10 1 1 A 136 136 PRO CB C 136 32.192 31.431 0.761 1
1 1550 . 10 1 1 A 137 137 VAL H H 137 8.219 7.687 0.532 1
1 1551 . 10 1 1 A 137 137 VAL HA H 137 4.077 4.492 -0.415 1
1 1559 . 10 1 1 A 137 137 VAL C C 137 176.305 175.247 1.058 1
1 1560 . 10 1 1 A 137 137 VAL CA C 137 61.958 59.641 2.317 1
1 1561 . 10 1 1 A 137 137 VAL CB C 137 32.755 34.198 -1.443 1
1 1564 . 10 1 1 A 137 137 VAL N N 137 120.079 115.335 4.744 1
1 1565 . 10 1 1 A 138 138 LYS H H 138 8.444 9.059 -0.615 1
1 1566 . 10 1 1 A 138 138 LYS HA H 138 4.316 4.454 -0.138 1
1 1575 . 10 1 1 A 138 138 LYS C C 138 176.790 176.331 0.459 1
1 1576 . 10 1 1 A 138 138 LYS CA C 138 56.792 57.529 -0.737 1
1 1577 . 10 1 1 A 138 138 LYS CB C 138 33.205 35.637 -2.432 1
1 1581 . 10 1 1 A 138 138 LYS N N 138 126.449 121.376 5.073 1
1 1582 . 10 1 1 A 139 139 GLY H H 139 8.518 7.484 1.034 1
1 1583 . 10 1 1 A 139 139 GLY HA2 H 139 4.070 4.108 -0.038 1
1 1584 . 10 1 1 A 139 139 GLY HA3 H 139 3.897 4.111 -0.214 1
1 1585 . 10 1 1 A 139 139 GLY C C 139 172.874 173.135 -0.261 1
1 1586 . 10 1 1 A 139 139 GLY CA C 139 45.157 45.293 -0.136 1
1 1587 . 10 1 1 A 139 139 GLY N N 139 112.617 107.153 5.464 1
1 6 . 11 1 1 A 2 2 VAL H H 2 8.992 8.277 0.715 1
1 7 . 11 1 1 A 2 2 VAL HA H 2 5.370 4.791 0.579 1
1 15 . 11 1 1 A 2 2 VAL C C 2 174.325 174.717 -0.392 1
1 16 . 11 1 1 A 2 2 VAL CA C 2 61.267 60.385 0.882 1
1 17 . 11 1 1 A 2 2 VAL CB C 2 33.890 34.528 -0.638 1
1 20 . 11 1 1 A 2 2 VAL N N 2 126.939 119.660 7.279 1
1 21 . 11 1 1 A 3 3 THR H H 3 8.912 9.087 -0.175 1
1 22 . 11 1 1 A 3 3 THR HA H 3 4.505 4.974 -0.469 1
1 27 . 11 1 1 A 3 3 THR C C 3 172.710 173.169 -0.459 1
1 28 . 11 1 1 A 3 3 THR CA C 3 59.689 59.560 0.129 1
1 29 . 11 1 1 A 3 3 THR CB C 3 72.398 71.979 0.419 1
1 31 . 11 1 1 A 3 3 THR N N 3 118.091 122.577 -4.486 1
1 32 . 11 1 1 A 4 4 GLU H H 4 8.631 8.663 -0.032 1
1 33 . 11 1 1 A 4 4 GLU HA H 4 5.788 5.345 0.443 1
1 38 . 11 1 1 A 4 4 GLU C C 4 175.758 174.772 0.986 1
1 39 . 11 1 1 A 4 4 GLU CA C 4 54.902 55.196 -0.294 1
1 40 . 11 1 1 A 4 4 GLU CB C 4 35.097 32.567 2.530 1
1 42 . 11 1 1 A 4 4 GLU N N 4 120.966 124.158 -3.192 1
1 43 . 11 1 1 A 5 5 THR H H 5 9.188 9.065 0.123 1
1 44 . 11 1 1 A 5 5 THR HA H 5 4.739 5.176 -0.437 1
1 49 . 11 1 1 A 5 5 THR C C 5 172.757 172.936 -0.179 1
1 50 . 11 1 1 A 5 5 THR CA C 5 60.382 60.396 -0.014 1
1 51 . 11 1 1 A 5 5 THR CB C 5 71.558 70.983 0.575 1
1 53 . 11 1 1 A 5 5 THR N N 5 119.366 116.128 3.238 1
1 54 . 11 1 1 A 6 6 VAL H H 6 8.476 9.048 -0.572 1
1 55 . 11 1 1 A 6 6 VAL HA H 6 5.026 5.941 -0.915 1
1 63 . 11 1 1 A 6 6 VAL C C 6 176.674 173.661 3.013 1
1 64 . 11 1 1 A 6 6 VAL CA C 6 61.008 59.439 1.569 1
1 65 . 11 1 1 A 6 6 VAL CB C 6 33.861 34.814 -0.953 1
1 68 . 11 1 1 A 6 6 VAL N N 6 121.384 122.586 -1.202 1
1 69 . 11 1 1 A 7 7 ASP H H 7 8.848 8.932 -0.084 1
1 70 . 11 1 1 A 7 7 ASP HA H 7 4.797 5.413 -0.616 1
1 73 . 11 1 1 A 7 7 ASP CA C 7 52.834 52.317 0.517 1
1 74 . 11 1 1 A 7 7 ASP CB C 7 42.219 44.732 -2.513 1
1 75 . 11 1 1 A 7 7 ASP N N 7 127.061 122.540 4.521 1
1 76 . 11 1 1 A 8 8 GLY C C 8 175.143 175.187 -0.044 1
1 77 . 11 1 1 A 8 8 GLY CA C 8 46.553 47.379 -0.826 1
1 78 . 11 1 1 A 9 9 GLN H H 9 8.408 8.895 -0.487 1
1 79 . 11 1 1 A 9 9 GLN HA H 9 4.541 4.474 0.067 1
1 86 . 11 1 1 A 9 9 GLN C C 9 176.463 176.057 0.406 1
1 87 . 11 1 1 A 9 9 GLN CA C 9 55.167 54.857 0.310 1
1 88 . 11 1 1 A 9 9 GLN CB C 9 29.376 29.914 -0.538 1
1 90 . 11 1 1 A 9 9 GLN N N 9 118.300 119.445 -1.145 1
1 92 . 11 1 1 A 10 10 GLY H H 10 8.162 8.107 0.055 1
1 93 . 11 1 1 A 10 10 GLY HA2 H 10 4.174 3.959 0.215 1
1 94 . 11 1 1 A 10 10 GLY HA3 H 10 3.521 3.973 -0.452 1
1 95 . 11 1 1 A 10 10 GLY C C 10 174.092 174.668 -0.576 1
1 96 . 11 1 1 A 10 10 GLY CA C 10 45.558 46.251 -0.693 1
1 97 . 11 1 1 A 10 10 GLY N N 10 108.747 110.075 -1.328 1
1 98 . 11 1 1 A 11 11 GLN H H 11 8.507 7.621 0.886 1
1 99 . 11 1 1 A 11 11 GLN HA H 11 4.202 4.302 -0.100 1
1 106 . 11 1 1 A 11 11 GLN C C 11 173.992 175.030 -1.038 1
1 107 . 11 1 1 A 11 11 GLN CA C 11 55.098 54.442 0.656 1
1 108 . 11 1 1 A 11 11 GLN CB C 11 29.097 28.365 0.732 1
1 110 . 11 1 1 A 11 11 GLN N N 11 122.979 119.886 3.093 1
1 112 . 11 1 1 A 12 12 ALA H H 12 8.259 8.804 -0.545 1
1 113 . 11 1 1 A 12 12 ALA HA H 12 5.156 4.902 0.254 1
1 117 . 11 1 1 A 12 12 ALA C C 12 177.284 176.945 0.339 1
1 118 . 11 1 1 A 12 12 ALA CA C 12 51.087 50.736 0.351 1
1 119 . 11 1 1 A 12 12 ALA CB C 12 20.500 19.922 0.578 1
1 120 . 11 1 1 A 12 12 ALA N N 12 127.100 128.452 -1.352 1
1 121 . 11 1 1 A 13 13 TRP H H 13 9.245 9.537 -0.292 1
1 122 . 11 1 1 A 13 13 TRP HA H 13 4.717 5.311 -0.594 1
1 131 . 11 1 1 A 13 13 TRP C C 13 175.108 175.763 -0.655 1
1 132 . 11 1 1 A 13 13 TRP CA C 13 55.966 56.642 -0.676 1
1 133 . 11 1 1 A 13 13 TRP CB C 13 31.912 32.353 -0.441 1
1 139 . 11 1 1 A 13 13 TRP N N 13 123.088 124.769 -1.681 1
1 141 . 11 1 1 A 14 14 ARG H H 14 8.575 9.270 -0.695 1
1 142 . 11 1 1 A 14 14 ARG HA H 14 5.335 5.478 -0.143 1
1 150 . 11 1 1 A 14 14 ARG C C 14 175.191 174.777 0.414 1
1 151 . 11 1 1 A 14 14 ARG CA C 14 53.106 54.849 -1.743 1
1 152 . 11 1 1 A 14 14 ARG CB C 14 32.749 34.244 -1.495 1
1 154 . 11 1 1 A 14 14 ARG N N 14 121.163 121.326 -0.163 1
1 156 . 11 1 1 A 15 15 HIS H H 15 8.595 9.559 -0.964 1
1 157 . 11 1 1 A 15 15 HIS HA H 15 4.790 5.012 -0.222 1
1 161 . 11 1 1 A 15 15 HIS C C 15 173.770 174.500 -0.730 1
1 162 . 11 1 1 A 15 15 HIS CA C 15 55.289 54.815 0.474 1
1 163 . 11 1 1 A 15 15 HIS CB C 15 33.208 33.614 -0.406 1
1 165 . 11 1 1 A 15 15 HIS N N 15 117.643 121.772 -4.129 1
1 166 . 11 1 1 A 16 16 HIS H H 16 8.993 9.267 -0.274 1
1 167 . 11 1 1 A 16 16 HIS HA H 16 5.158 4.867 0.291 1
1 171 . 11 1 1 A 16 16 HIS C C 16 173.608 175.375 -1.767 1
1 172 . 11 1 1 A 16 16 HIS CA C 16 56.450 55.908 0.542 1
1 173 . 11 1 1 A 16 16 HIS CB C 16 34.171 30.837 3.334 1
1 175 . 11 1 1 A 16 16 HIS N N 16 123.520 120.449 3.071 1
1 176 . 11 1 1 A 17 17 ASN H H 17 7.829 9.447 -1.618 1
1 177 . 11 1 1 A 17 17 ASN HA H 17 4.713 5.311 -0.598 1
1 182 . 11 1 1 A 17 17 ASN C C 17 173.682 175.759 -2.077 1
1 183 . 11 1 1 A 17 17 ASN CA C 17 51.822 51.645 0.177 1
1 184 . 11 1 1 A 17 17 ASN CB C 17 43.176 41.586 1.590 1
1 185 . 11 1 1 A 17 17 ASN N N 17 122.213 120.727 1.486 1
1 187 . 11 1 1 A 18 18 GLY H H 18 8.423 8.610 -0.187 1
1 188 . 11 1 1 A 18 18 GLY HA2 H 18 3.931 3.758 0.173 1
1 189 . 11 1 1 A 18 18 GLY HA3 H 18 3.707 3.966 -0.259 1
1 190 . 11 1 1 A 18 18 GLY C C 18 173.985 173.085 0.900 1
1 191 . 11 1 1 A 18 18 GLY CA C 18 43.949 45.372 -1.423 1
1 192 . 11 1 1 A 18 18 GLY N N 18 106.991 109.257 -2.266 1
1 193 . 11 1 1 A 19 19 PHE H H 19 8.338 7.993 0.345 1
1 194 . 11 1 1 A 19 19 PHE HA H 19 4.068 4.589 -0.521 1
1 197 . 11 1 1 A 19 19 PHE C C 19 176.568 174.946 1.622 1
1 198 . 11 1 1 A 19 19 PHE CA C 19 59.338 59.389 -0.051 1
1 199 . 11 1 1 A 19 19 PHE CB C 19 40.201 39.318 0.883 1
1 200 . 11 1 1 A 19 19 PHE N N 19 116.857 119.569 -2.712 1
1 201 . 11 1 1 A 20 20 ASP H H 20 8.794 8.929 -0.135 1
1 202 . 11 1 1 A 20 20 ASP HA H 20 4.485 4.768 -0.283 1
1 205 . 11 1 1 A 20 20 ASP C C 20 177.379 176.687 0.692 1
1 206 . 11 1 1 A 20 20 ASP CA C 20 54.140 54.798 -0.658 1
1 207 . 11 1 1 A 20 20 ASP CB C 20 41.915 40.428 1.487 1
1 208 . 11 1 1 A 20 20 ASP N N 20 123.025 125.446 -2.421 1
1 209 . 11 1 1 A 21 21 PHE H H 21 8.862 9.101 -0.239 1
1 210 . 11 1 1 A 21 21 PHE HA H 21 4.087 4.108 -0.021 1
1 218 . 11 1 1 A 21 21 PHE C C 21 176.952 177.271 -0.319 1
1 219 . 11 1 1 A 21 21 PHE CA C 21 61.095 62.420 -1.325 1
1 220 . 11 1 1 A 21 21 PHE CB C 21 38.678 39.375 -0.697 1
1 226 . 11 1 1 A 21 21 PHE N N 21 127.163 125.842 1.321 1
1 227 . 11 1 1 A 22 22 ALA H H 22 8.561 8.392 0.169 1
1 228 . 11 1 1 A 22 22 ALA HA H 22 3.878 4.051 -0.173 1
1 232 . 11 1 1 A 22 22 ALA C C 22 180.710 180.269 0.441 1
1 233 . 11 1 1 A 22 22 ALA CA C 22 55.211 55.253 -0.042 1
1 234 . 11 1 1 A 22 22 ALA CB C 22 18.321 18.363 -0.042 1
1 235 . 11 1 1 A 22 22 ALA N N 22 120.293 121.193 -0.900 1
1 236 . 11 1 1 A 23 23 VAL H H 23 7.241 7.600 -0.359 1
1 237 . 11 1 1 A 23 23 VAL HA H 23 3.684 3.500 0.184 1
1 245 . 11 1 1 A 23 23 VAL C C 23 177.101 178.118 -1.017 1
1 246 . 11 1 1 A 23 23 VAL CA C 23 65.237 67.073 -1.836 1
1 247 . 11 1 1 A 23 23 VAL CB C 23 31.780 31.597 0.183 1
1 250 . 11 1 1 A 23 23 VAL N N 23 118.775 117.896 0.879 1
1 251 . 11 1 1 A 24 24 ILE H H 24 6.761 7.996 -1.235 1
1 252 . 11 1 1 A 24 24 ILE HA H 24 3.196 3.457 -0.261 1
1 262 . 11 1 1 A 24 24 ILE C C 24 177.287 178.060 -0.773 1
1 263 . 11 1 1 A 24 24 ILE CA C 24 63.404 65.728 -2.324 1
1 264 . 11 1 1 A 24 24 ILE CB C 24 36.294 37.508 -1.214 1
1 268 . 11 1 1 A 24 24 ILE N N 24 119.036 120.094 -1.058 1
1 269 . 11 1 1 A 25 25 LYS H H 25 8.032 8.251 -0.219 1
1 270 . 11 1 1 A 25 25 LYS HA H 25 3.809 3.785 0.024 1
1 279 . 11 1 1 A 25 25 LYS C C 25 179.450 178.972 0.478 1
1 280 . 11 1 1 A 25 25 LYS CA C 25 59.621 59.596 0.025 1
1 281 . 11 1 1 A 25 25 LYS CB C 25 32.259 32.394 -0.135 1
1 285 . 11 1 1 A 25 25 LYS N N 25 118.368 120.175 -1.807 1
1 286 . 11 1 1 A 26 26 GLU H H 26 7.845 8.135 -0.290 1
1 287 . 11 1 1 A 26 26 GLU HA H 26 4.021 4.135 -0.114 1
1 292 . 11 1 1 A 26 26 GLU C C 26 179.191 179.468 -0.277 1
1 293 . 11 1 1 A 26 26 GLU CA C 26 59.530 59.054 0.476 1
1 294 . 11 1 1 A 26 26 GLU CB C 26 29.449 29.793 -0.344 1
1 296 . 11 1 1 A 26 26 GLU N N 26 120.522 119.798 0.724 1
1 297 . 11 1 1 A 27 27 LEU H H 27 8.165 8.529 -0.364 1
1 298 . 11 1 1 A 27 27 LEU HA H 27 4.163 4.199 -0.036 1
1 308 . 11 1 1 A 27 27 LEU C C 27 177.256 178.399 -1.143 1
1 309 . 11 1 1 A 27 27 LEU CA C 27 58.049 57.816 0.233 1
1 310 . 11 1 1 A 27 27 LEU CB C 27 41.365 41.919 -0.554 1
1 314 . 11 1 1 A 27 27 LEU N N 27 120.879 121.376 -0.497 1
1 315 . 11 1 1 A 28 28 LYS H H 28 8.902 8.404 0.498 1
1 316 . 11 1 1 A 28 28 LYS HA H 28 4.199 4.572 -0.373 1
1 317 . 11 1 1 A 28 28 LYS C C 28 179.707 179.111 0.596 1
1 318 . 11 1 1 A 28 28 LYS CA C 28 60.097 59.220 0.877 1
1 319 . 11 1 1 A 28 28 LYS CB C 28 33.420 31.988 1.432 1
1 320 . 11 1 1 A 28 28 LYS N N 28 120.050 119.722 0.328 1
1 321 . 11 1 1 A 29 29 THR H H 29 8.294 7.831 0.463 1
1 322 . 11 1 1 A 29 29 THR HA H 29 3.892 3.924 -0.032 1
1 327 . 11 1 1 A 29 29 THR C C 29 175.711 176.010 -0.299 1
1 328 . 11 1 1 A 29 29 THR CA C 29 66.846 66.546 0.300 1
1 329 . 11 1 1 A 29 29 THR CB C 29 68.794 68.828 -0.034 1
1 331 . 11 1 1 A 29 29 THR N N 29 115.933 115.999 -0.066 1
1 332 . 11 1 1 A 30 30 ALA H H 30 8.244 8.629 -0.385 1
1 333 . 11 1 1 A 30 30 ALA HA H 30 4.241 4.276 -0.035 1
1 337 . 11 1 1 A 30 30 ALA C C 30 179.128 179.943 -0.815 1
1 338 . 11 1 1 A 30 30 ALA CA C 30 55.714 55.813 -0.099 1
1 339 . 11 1 1 A 30 30 ALA CB C 30 18.955 18.551 0.404 1
1 340 . 11 1 1 A 30 30 ALA N N 30 124.617 123.194 1.423 1
1 341 . 11 1 1 A 31 31 ALA H H 31 8.968 8.833 0.135 1
1 342 . 11 1 1 A 31 31 ALA HA H 31 3.890 4.155 -0.265 1
1 346 . 11 1 1 A 31 31 ALA C C 31 180.352 179.561 0.791 1
1 347 . 11 1 1 A 31 31 ALA CA C 31 55.454 54.884 0.570 1
1 348 . 11 1 1 A 31 31 ALA CB C 31 17.124 18.136 -1.012 1
1 349 . 11 1 1 A 31 31 ALA N N 31 119.327 120.223 -0.896 1
1 350 . 11 1 1 A 32 32 SER H H 32 7.995 7.890 0.105 1
1 351 . 11 1 1 A 32 32 SER HA H 32 4.238 4.304 -0.066 1
1 354 . 11 1 1 A 32 32 SER C C 32 175.612 175.832 -0.220 1
1 355 . 11 1 1 A 32 32 SER CA C 32 61.203 61.213 -0.010 1
1 356 . 11 1 1 A 32 32 SER CB C 32 63.406 63.594 -0.188 1
1 357 . 11 1 1 A 32 32 SER N N 32 111.962 114.361 -2.399 1
1 358 . 11 1 1 A 33 33 GLN H H 33 8.333 7.981 0.352 1
1 359 . 11 1 1 A 33 33 GLN HA H 33 3.992 4.144 -0.152 1
1 366 . 11 1 1 A 33 33 GLN C C 33 177.486 177.350 0.136 1
1 367 . 11 1 1 A 33 33 GLN CA C 33 58.277 57.858 0.419 1
1 368 . 11 1 1 A 33 33 GLN CB C 33 29.140 29.232 -0.092 1
1 370 . 11 1 1 A 33 33 GLN N N 33 119.527 120.174 -0.647 1
1 372 . 11 1 1 A 34 34 TYR H H 34 8.587 8.197 0.390 1
1 373 . 11 1 1 A 34 34 TYR HA H 34 4.792 4.595 0.197 1
1 380 . 11 1 1 A 34 34 TYR C C 34 176.499 176.619 -0.120 1
1 381 . 11 1 1 A 34 34 TYR CA C 34 57.711 58.828 -1.117 1
1 382 . 11 1 1 A 34 34 TYR CB C 34 39.561 39.176 0.385 1
1 387 . 11 1 1 A 34 34 TYR N N 34 114.610 116.277 -1.667 1
1 388 . 11 1 1 A 35 35 GLY H H 35 7.346 8.371 -1.025 1
1 389 . 11 1 1 A 35 35 GLY HA2 H 35 4.785 4.116 0.669 1
1 390 . 11 1 1 A 35 35 GLY HA3 H 35 4.007 4.116 -0.109 1
1 391 . 11 1 1 A 35 35 GLY C C 35 175.796 173.525 2.271 1
1 392 . 11 1 1 A 35 35 GLY CA C 35 44.355 44.810 -0.455 1
1 393 . 11 1 1 A 35 35 GLY N N 35 108.501 107.118 1.383 1
1 394 . 11 1 1 A 36 36 ALA H H 36 9.363 8.311 1.052 1
1 395 . 11 1 1 A 36 36 ALA HA H 36 4.217 4.536 -0.319 1
1 399 . 11 1 1 A 36 36 ALA C C 36 178.039 178.291 -0.252 1
1 400 . 11 1 1 A 36 36 ALA CA C 36 56.114 51.762 4.352 1
1 401 . 11 1 1 A 36 36 ALA CB C 36 19.179 20.103 -0.924 1
1 402 . 11 1 1 A 36 36 ALA N N 36 125.811 123.932 1.879 1
1 403 . 11 1 1 A 37 37 THR H H 37 8.070 8.704 -0.634 1
1 404 . 11 1 1 A 37 37 THR HA H 37 4.570 4.022 0.548 1
1 409 . 11 1 1 A 37 37 THR C C 37 173.685 173.738 -0.053 1
1 410 . 11 1 1 A 37 37 THR CA C 37 59.822 65.159 -5.337 1
1 411 . 11 1 1 A 37 37 THR CB C 37 68.267 66.808 1.459 1
1 413 . 11 1 1 A 37 37 THR N N 37 129.410 109.286 20.124 1
1 414 . 11 1 1 A 38 38 ALA H H 38 6.853 7.843 -0.990 1
1 415 . 11 1 1 A 38 38 ALA HA H 38 4.601 4.536 0.065 1
1 419 . 11 1 1 A 38 38 ALA CA C 38 50.758 50.698 0.060 1
1 420 . 11 1 1 A 38 38 ALA CB C 38 18.325 19.519 -1.194 1
1 421 . 11 1 1 A 38 38 ALA N N 38 124.674 124.793 -0.119 1
1 422 . 11 1 1 A 40 40 TYR HA H 40 4.032 4.000 0.032 1
1 429 . 11 1 1 A 40 40 TYR C C 40 176.456 177.228 -0.772 1
1 430 . 11 1 1 A 40 40 TYR CA C 40 61.010 61.623 -0.613 1
1 431 . 11 1 1 A 40 40 TYR CB C 40 39.286 38.722 0.564 1
1 436 . 11 1 1 A 41 41 THR H H 41 6.874 8.349 -1.475 1
1 437 . 11 1 1 A 41 41 THR HA H 41 3.616 3.975 -0.359 1
1 442 . 11 1 1 A 41 41 THR C C 41 176.930 177.508 -0.578 1
1 443 . 11 1 1 A 41 41 THR CA C 41 65.557 66.871 -1.314 1
1 444 . 11 1 1 A 41 41 THR CB C 41 68.228 68.543 -0.315 1
1 446 . 11 1 1 A 41 41 THR N N 41 115.143 114.183 0.960 1
1 447 . 11 1 1 A 42 42 LEU H H 42 8.623 7.445 1.178 1
1 448 . 11 1 1 A 42 42 LEU HA H 42 3.708 4.016 -0.308 1
1 458 . 11 1 1 A 42 42 LEU C C 42 178.206 178.913 -0.707 1
1 459 . 11 1 1 A 42 42 LEU CA C 42 57.417 57.685 -0.268 1
1 460 . 11 1 1 A 42 42 LEU CB C 42 41.342 41.193 0.149 1
1 464 . 11 1 1 A 42 42 LEU N N 42 120.418 118.150 2.268 1
1 465 . 11 1 1 A 43 43 ALA H H 43 7.735 7.746 -0.011 1
1 466 . 11 1 1 A 43 43 ALA HA H 43 4.020 3.975 0.045 1
1 470 . 11 1 1 A 43 43 ALA C C 43 180.826 180.342 0.484 1
1 471 . 11 1 1 A 43 43 ALA CA C 43 54.925 54.978 -0.053 1
1 472 . 11 1 1 A 43 43 ALA CB C 43 17.506 18.207 -0.701 1
1 473 . 11 1 1 A 43 43 ALA N N 43 120.203 121.754 -1.551 1
1 474 . 11 1 1 A 44 44 ILE H H 44 7.149 7.398 -0.249 1
1 475 . 11 1 1 A 44 44 ILE HA H 44 3.603 3.773 -0.170 1
1 485 . 11 1 1 A 44 44 ILE C C 44 178.594 178.283 0.311 1
1 486 . 11 1 1 A 44 44 ILE CA C 44 64.782 64.430 0.352 1
1 487 . 11 1 1 A 44 44 ILE CB C 44 37.472 37.572 -0.100 1
1 491 . 11 1 1 A 44 44 ILE N N 44 118.881 119.566 -0.685 1
1 492 . 11 1 1 A 45 45 VAL H H 45 7.968 7.797 0.171 1
1 493 . 11 1 1 A 45 45 VAL HA H 45 2.925 3.394 -0.469 1
1 501 . 11 1 1 A 45 45 VAL C C 45 177.023 177.402 -0.379 1
1 502 . 11 1 1 A 45 45 VAL CA C 45 67.081 66.778 0.303 1
1 503 . 11 1 1 A 45 45 VAL CB C 45 30.854 30.966 -0.112 1
1 506 . 11 1 1 A 45 45 VAL N N 45 120.764 119.844 0.920 1
1 507 . 11 1 1 A 46 46 GLU H H 46 8.399 8.414 -0.015 1
1 508 . 11 1 1 A 46 46 GLU HA H 46 3.848 3.826 0.022 1
1 513 . 11 1 1 A 46 46 GLU C C 46 178.656 178.655 0.001 1
1 514 . 11 1 1 A 46 46 GLU CA C 46 59.491 59.659 -0.168 1
1 515 . 11 1 1 A 46 46 GLU CB C 46 28.991 29.427 -0.436 1
1 517 . 11 1 1 A 46 46 GLU N N 46 116.599 119.603 -3.004 1
1 518 . 11 1 1 A 47 47 SER H H 47 7.273 7.993 -0.720 1
1 519 . 11 1 1 A 47 47 SER HA H 47 4.287 4.218 0.069 1
1 521 . 11 1 1 A 47 47 SER CA C 47 61.047 61.261 -0.214 1
1 522 . 11 1 1 A 47 47 SER CB C 47 63.016 62.475 0.541 1
1 523 . 11 1 1 A 47 47 SER N N 47 113.609 115.591 -1.982 1
1 524 . 11 1 1 A 48 48 VAL H H 48 8.006 7.910 0.096 1
1 525 . 11 1 1 A 48 48 VAL HA H 48 3.556 3.887 -0.331 1
1 533 . 11 1 1 A 48 48 VAL C C 48 177.257 176.714 0.543 1
1 534 . 11 1 1 A 48 48 VAL CA C 48 65.025 64.566 0.459 1
1 535 . 11 1 1 A 48 48 VAL CB C 48 31.841 31.614 0.227 1
1 538 . 11 1 1 A 48 48 VAL N N 48 122.327 119.296 3.031 1
1 539 . 11 1 1 A 49 49 ALA H H 49 8.369 7.763 0.606 1
1 540 . 11 1 1 A 49 49 ALA HA H 49 4.115 4.419 -0.304 1
1 544 . 11 1 1 A 49 49 ALA C C 49 177.307 177.303 0.004 1
1 545 . 11 1 1 A 49 49 ALA CA C 49 53.253 52.597 0.656 1
1 546 . 11 1 1 A 49 49 ALA CB C 49 20.131 18.436 1.695 1
1 547 . 11 1 1 A 49 49 ALA N N 49 118.050 123.731 -5.681 1
1 548 . 11 1 1 A 50 50 ASP H H 50 7.052 7.664 -0.612 1
1 549 . 11 1 1 A 50 50 ASP HA H 50 4.788 4.852 -0.064 1
1 552 . 11 1 1 A 50 50 ASP C C 50 175.481 176.248 -0.767 1
1 553 . 11 1 1 A 50 50 ASP CA C 50 53.681 54.630 -0.949 1
1 554 . 11 1 1 A 50 50 ASP CB C 50 39.333 41.215 -1.882 1
1 555 . 11 1 1 A 50 50 ASP N N 50 116.997 117.612 -0.615 1
1 556 . 11 1 1 A 51 51 ASN H H 51 8.535 7.505 1.030 1
1 557 . 11 1 1 A 51 51 ASN HA H 51 4.628 4.786 -0.158 1
1 562 . 11 1 1 A 51 51 ASN C C 51 174.077 174.986 -0.909 1
1 563 . 11 1 1 A 51 51 ASN CA C 51 52.315 51.946 0.369 1
1 564 . 11 1 1 A 51 51 ASN CB C 51 41.928 40.195 1.733 1
1 565 . 11 1 1 A 51 51 ASN N N 51 118.626 118.001 0.625 1
1 567 . 11 1 1 A 52 52 TRP H H 52 8.555 8.068 0.487 1
1 574 . 11 1 1 A 52 52 TRP C C 52 173.269 175.958 -2.689 1
1 575 . 11 1 1 A 52 52 TRP CA C 52 55.031 56.523 -1.492 1
1 576 . 11 1 1 A 52 52 TRP CB C 52 26.801 29.104 -2.303 1
1 582 . 11 1 1 A 52 52 TRP N N 52 120.693 120.732 -0.039 1
1 584 . 11 1 1 A 53 53 LEU H H 53 7.847 7.454 0.393 1
1 585 . 11 1 1 A 53 53 LEU HA H 53 4.859 4.194 0.665 1
1 595 . 11 1 1 A 53 53 LEU C C 53 177.397 176.687 0.710 1
1 596 . 11 1 1 A 53 53 LEU CA C 53 53.619 55.191 -1.572 1
1 597 . 11 1 1 A 53 53 LEU CB C 53 41.812 42.508 -0.696 1
1 601 . 11 1 1 A 53 53 LEU N N 53 124.741 119.835 4.906 1
1 602 . 11 1 1 A 54 54 THR H H 54 8.850 8.956 -0.106 1
1 603 . 11 1 1 A 54 54 THR HA H 54 4.598 5.112 -0.514 1
1 608 . 11 1 1 A 54 54 THR CA C 54 60.531 60.344 0.187 1
1 609 . 11 1 1 A 54 54 THR CB C 54 67.183 69.041 -1.858 1
1 611 . 11 1 1 A 54 54 THR N N 54 113.407 112.359 1.048 1
1 612 . 11 1 1 A 55 55 PRO HA H 55 4.511 4.480 0.031 1
1 619 . 11 1 1 A 55 55 PRO C C 55 179.383 178.442 0.941 1
1 620 . 11 1 1 A 55 55 PRO CA C 55 67.159 64.311 2.848 1
1 621 . 11 1 1 A 55 55 PRO CB C 55 32.095 31.894 0.201 1
1 622 . 11 1 1 A 56 56 THR H H 56 8.575 7.778 0.797 1
1 623 . 11 1 1 A 56 56 THR HA H 56 4.229 4.134 0.095 1
1 628 . 11 1 1 A 56 56 THR C C 56 176.668 176.019 0.649 1
1 629 . 11 1 1 A 56 56 THR CA C 56 66.943 66.020 0.923 1
1 630 . 11 1 1 A 56 56 THR CB C 56 68.129 68.276 -0.147 1
1 632 . 11 1 1 A 56 56 THR N N 56 114.855 112.061 2.794 1
1 633 . 11 1 1 A 57 57 ASP H H 57 8.730 8.690 0.040 1
1 634 . 11 1 1 A 57 57 ASP HA H 57 4.425 4.657 -0.232 1
1 637 . 11 1 1 A 57 57 ASP C C 57 178.351 179.140 -0.789 1
1 638 . 11 1 1 A 57 57 ASP CA C 57 57.963 57.717 0.246 1
1 639 . 11 1 1 A 57 57 ASP CB C 57 40.134 40.793 -0.659 1
1 640 . 11 1 1 A 57 57 ASP N N 57 126.239 120.405 5.834 1
1 641 . 11 1 1 A 58 58 TRP H H 58 8.244 8.490 -0.246 1
1 642 . 11 1 1 A 58 58 TRP HA H 58 4.030 4.431 -0.401 1
1 650 . 11 1 1 A 58 58 TRP C C 58 177.432 178.964 -1.532 1
1 651 . 11 1 1 A 58 58 TRP CA C 58 62.731 60.117 2.614 1
1 652 . 11 1 1 A 58 58 TRP CB C 58 29.122 29.353 -0.231 1
1 657 . 11 1 1 A 58 58 TRP N N 58 119.241 120.434 -1.193 1
1 659 . 11 1 1 A 59 59 ASN H H 59 8.098 8.944 -0.846 1
1 660 . 11 1 1 A 59 59 ASN HA H 59 4.424 4.559 -0.135 1
1 663 . 11 1 1 A 59 59 ASN C C 59 176.952 177.946 -0.994 1
1 664 . 11 1 1 A 59 59 ASN CA C 59 58.135 56.671 1.464 1
1 665 . 11 1 1 A 59 59 ASN CB C 59 40.168 39.570 0.598 1
1 666 . 11 1 1 A 59 59 ASN N N 59 115.747 117.933 -2.186 1
1 667 . 11 1 1 A 60 60 THR H H 60 8.712 7.991 0.721 1
1 668 . 11 1 1 A 60 60 THR HA H 60 3.717 3.976 -0.259 1
1 673 . 11 1 1 A 60 60 THR C C 60 176.044 176.559 -0.515 1
1 674 . 11 1 1 A 60 60 THR CA C 60 66.576 66.903 -0.327 1
1 675 . 11 1 1 A 60 60 THR CB C 60 69.251 67.602 1.649 1
1 677 . 11 1 1 A 60 60 THR N N 60 114.896 116.243 -1.347 1
1 678 . 11 1 1 A 61 61 LEU H H 61 8.485 8.357 0.128 1
1 679 . 11 1 1 A 61 61 LEU HA H 61 3.391 4.001 -0.610 1
1 689 . 11 1 1 A 61 61 LEU C C 61 177.433 178.640 -1.207 1
1 690 . 11 1 1 A 61 61 LEU CA C 61 58.354 58.675 -0.321 1
1 691 . 11 1 1 A 61 61 LEU CB C 61 41.761 42.285 -0.524 1
1 695 . 11 1 1 A 61 61 LEU N N 61 123.433 122.064 1.369 1
1 696 . 11 1 1 A 62 62 VAL H H 62 8.073 8.349 -0.276 1
1 697 . 11 1 1 A 62 62 VAL HA H 62 3.207 3.781 -0.574 1
1 705 . 11 1 1 A 62 62 VAL C C 62 177.585 177.423 0.162 1
1 706 . 11 1 1 A 62 62 VAL CA C 62 67.345 65.206 2.139 1
1 707 . 11 1 1 A 62 62 VAL CB C 62 30.905 30.587 0.318 1
1 710 . 11 1 1 A 62 62 VAL N N 62 116.018 118.477 -2.459 1
1 711 . 11 1 1 A 63 63 ARG H H 63 7.765 8.058 -0.293 1
1 712 . 11 1 1 A 63 63 ARG HA H 63 3.602 4.022 -0.420 1
1 719 . 11 1 1 A 63 63 ARG C C 63 177.818 178.060 -0.242 1
1 720 . 11 1 1 A 63 63 ARG CA C 63 58.049 57.969 0.080 1
1 721 . 11 1 1 A 63 63 ARG CB C 63 29.955 29.137 0.818 1
1 724 . 11 1 1 A 63 63 ARG N N 63 116.700 120.376 -3.676 1
1 725 . 11 1 1 A 64 64 ALA H H 64 7.574 7.452 0.122 1
1 726 . 11 1 1 A 64 64 ALA HA H 64 4.158 4.376 -0.218 1
1 730 . 11 1 1 A 64 64 ALA C C 64 179.886 179.159 0.727 1
1 731 . 11 1 1 A 64 64 ALA CA C 64 54.007 53.821 0.186 1
1 732 . 11 1 1 A 64 64 ALA CB C 64 19.147 19.815 -0.668 1
1 733 . 11 1 1 A 64 64 ALA N N 64 117.555 122.086 -4.531 1
1 734 . 11 1 1 A 65 65 VAL H H 65 7.554 8.051 -0.497 1
1 735 . 11 1 1 A 65 65 VAL HA H 65 4.253 3.867 0.386 1
1 743 . 11 1 1 A 65 65 VAL C C 65 174.180 175.747 -1.567 1
1 744 . 11 1 1 A 65 65 VAL CA C 65 62.683 65.490 -2.807 1
1 745 . 11 1 1 A 65 65 VAL CB C 65 33.458 31.243 2.215 1
1 748 . 11 1 1 A 65 65 VAL N N 65 110.013 115.280 -5.267 1
1 749 . 11 1 1 A 66 66 LEU H H 66 7.792 7.451 0.341 1
1 750 . 11 1 1 A 66 66 LEU HA H 66 4.790 4.752 0.038 1
1 760 . 11 1 1 A 66 66 LEU C C 66 177.537 174.309 3.228 1
1 761 . 11 1 1 A 66 66 LEU CA C 66 52.823 53.520 -0.697 1
1 762 . 11 1 1 A 66 66 LEU CB C 66 44.071 45.700 -1.629 1
1 766 . 11 1 1 A 66 66 LEU N N 66 118.967 122.085 -3.118 1
1 767 . 11 1 1 A 67 67 SER H H 67 9.208 8.610 0.598 1
1 768 . 11 1 1 A 67 67 SER HA H 67 4.414 4.901 -0.487 1
1 771 . 11 1 1 A 67 67 SER CA C 67 57.943 56.624 1.319 1
1 772 . 11 1 1 A 67 67 SER CB C 67 64.743 66.423 -1.680 1
1 773 . 11 1 1 A 67 67 SER N N 67 116.378 118.689 -2.311 1
1 774 . 11 1 1 A 69 69 GLY HA2 H 69 3.916 3.828 0.088 1
1 775 . 11 1 1 A 69 69 GLY HA3 H 69 3.867 3.852 0.015 1
1 776 . 11 1 1 A 69 69 GLY C C 69 176.783 175.557 1.226 1
1 777 . 11 1 1 A 69 69 GLY CA C 69 46.977 46.328 0.649 1
1 778 . 11 1 1 A 70 70 ASP H H 70 7.674 8.132 -0.458 1
1 779 . 11 1 1 A 70 70 ASP HA H 70 4.511 3.735 0.776 1
1 782 . 11 1 1 A 70 70 ASP C C 70 178.096 178.156 -0.060 1
1 783 . 11 1 1 A 70 70 ASP CA C 70 57.262 56.502 0.760 1
1 784 . 11 1 1 A 70 70 ASP CB C 70 40.594 39.771 0.823 1
1 785 . 11 1 1 A 70 70 ASP N N 70 123.930 122.023 1.907 1
1 786 . 11 1 1 A 71 71 HIS H H 71 8.729 7.939 0.790 1
1 787 . 11 1 1 A 71 71 HIS HA H 71 4.235 4.148 0.087 1
1 790 . 11 1 1 A 71 71 HIS C C 71 176.769 176.771 -0.002 1
1 791 . 11 1 1 A 71 71 HIS CA C 71 60.041 59.896 0.145 1
1 792 . 11 1 1 A 71 71 HIS CB C 71 30.682 29.980 0.702 1
1 793 . 11 1 1 A 71 71 HIS N N 71 121.003 119.709 1.294 1
1 794 . 11 1 1 A 72 72 LEU H H 72 7.620 7.615 0.005 1
1 795 . 11 1 1 A 72 72 LEU HA H 72 3.769 3.852 -0.083 1
1 805 . 11 1 1 A 72 72 LEU C C 72 180.275 179.031 1.244 1
1 806 . 11 1 1 A 72 72 LEU CA C 72 58.192 57.974 0.218 1
1 807 . 11 1 1 A 72 72 LEU CB C 72 41.381 41.216 0.165 1
1 811 . 11 1 1 A 72 72 LEU N N 72 118.569 118.480 0.089 1
1 812 . 11 1 1 A 73 73 LEU H H 73 7.542 7.391 0.151 1
1 813 . 11 1 1 A 73 73 LEU HA H 73 4.107 4.250 -0.143 1
1 823 . 11 1 1 A 73 73 LEU C C 73 179.436 179.203 0.233 1
1 824 . 11 1 1 A 73 73 LEU CA C 73 58.026 57.294 0.732 1
1 825 . 11 1 1 A 73 73 LEU CB C 73 41.638 42.202 -0.564 1
1 829 . 11 1 1 A 73 73 LEU N N 73 121.418 119.939 1.479 1
1 830 . 11 1 1 A 74 74 TRP H H 74 8.786 7.916 0.870 1
1 831 . 11 1 1 A 74 74 TRP HA H 74 3.589 5.297 -1.708 1
1 840 . 11 1 1 A 74 74 TRP C C 74 176.816 178.752 -1.936 1
1 841 . 11 1 1 A 74 74 TRP CA C 74 63.046 59.684 3.362 1
1 842 . 11 1 1 A 74 74 TRP CB C 74 28.065 29.201 -1.136 1
1 848 . 11 1 1 A 74 74 TRP N N 74 121.111 118.597 2.514 1
1 850 . 11 1 1 A 75 75 LYS H H 75 8.939 7.588 1.351 1
1 851 . 11 1 1 A 75 75 LYS HA H 75 3.055 4.211 -1.156 1
1 860 . 11 1 1 A 75 75 LYS C C 75 177.967 179.319 -1.352 1
1 861 . 11 1 1 A 75 75 LYS CA C 75 60.029 58.575 1.454 1
1 862 . 11 1 1 A 75 75 LYS CB C 75 32.533 33.092 -0.559 1
1 866 . 11 1 1 A 75 75 LYS N N 75 119.783 118.673 1.110 1
1 867 . 11 1 1 A 76 76 SER H H 76 7.832 8.177 -0.345 1
1 868 . 11 1 1 A 76 76 SER HA H 76 4.040 4.291 -0.251 1
1 871 . 11 1 1 A 76 76 SER C C 76 177.816 175.890 1.926 1
1 872 . 11 1 1 A 76 76 SER CA C 76 62.105 61.972 0.133 1
1 873 . 11 1 1 A 76 76 SER CB C 76 62.679 63.004 -0.325 1
1 874 . 11 1 1 A 76 76 SER N N 76 113.395 117.075 -3.680 1
1 875 . 11 1 1 A 77 77 GLU H H 77 7.590 7.633 -0.043 1
1 876 . 11 1 1 A 77 77 GLU HA H 77 4.042 4.171 -0.129 1
1 881 . 11 1 1 A 77 77 GLU C C 77 177.809 178.962 -1.153 1
1 882 . 11 1 1 A 77 77 GLU CA C 77 58.270 58.982 -0.712 1
1 883 . 11 1 1 A 77 77 GLU CB C 77 29.208 29.187 0.021 1
1 885 . 11 1 1 A 77 77 GLU N N 77 121.574 121.996 -0.422 1
1 886 . 11 1 1 A 78 78 PHE H H 78 9.081 7.814 1.267 1
1 887 . 11 1 1 A 78 78 PHE HA H 78 3.778 4.226 -0.448 1
1 895 . 11 1 1 A 78 78 PHE C C 78 178.114 177.301 0.813 1
1 896 . 11 1 1 A 78 78 PHE CA C 78 60.629 61.306 -0.677 1
1 897 . 11 1 1 A 78 78 PHE CB C 78 38.295 38.550 -0.255 1
1 902 . 11 1 1 A 78 78 PHE N N 78 122.682 120.871 1.811 1
1 903 . 11 1 1 A 79 79 PHE H H 79 8.890 8.044 0.846 1
1 904 . 11 1 1 A 79 79 PHE HA H 79 3.800 4.095 -0.295 1
1 912 . 11 1 1 A 79 79 PHE C C 79 178.354 178.254 0.100 1
1 913 . 11 1 1 A 79 79 PHE CA C 79 60.704 61.596 -0.892 1
1 914 . 11 1 1 A 79 79 PHE CB C 79 37.184 38.671 -1.487 1
1 920 . 11 1 1 A 79 79 PHE N N 79 121.056 117.598 3.458 1
1 921 . 11 1 1 A 80 80 GLU H H 80 7.793 8.210 -0.417 1
1 922 . 11 1 1 A 80 80 GLU HA H 80 4.082 3.989 0.093 1
1 927 . 11 1 1 A 80 80 GLU C C 80 179.068 179.046 0.022 1
1 928 . 11 1 1 A 80 80 GLU CA C 80 59.735 59.880 -0.145 1
1 929 . 11 1 1 A 80 80 GLU CB C 80 28.722 29.320 -0.598 1
1 931 . 11 1 1 A 80 80 GLU N N 80 120.312 119.968 0.344 1
1 932 . 11 1 1 A 81 81 ASN H H 81 8.624 8.993 -0.369 1
1 933 . 11 1 1 A 81 81 ASN HA H 81 4.521 4.449 0.072 1
1 938 . 11 1 1 A 81 81 ASN C C 81 179.262 177.570 1.692 1
1 939 . 11 1 1 A 81 81 ASN CA C 81 55.504 56.049 -0.545 1
1 940 . 11 1 1 A 81 81 ASN CB C 81 37.517 37.480 0.037 1
1 941 . 11 1 1 A 81 81 ASN N N 81 119.338 117.648 1.690 1
1 943 . 11 1 1 A 82 82 CYS H H 82 8.554 7.883 0.671 1
1 944 . 11 1 1 A 82 82 CYS HA H 82 3.792 4.018 -0.226 1
1 947 . 11 1 1 A 82 82 CYS C C 82 176.478 177.212 -0.734 1
1 948 . 11 1 1 A 82 82 CYS CA C 82 65.232 63.840 1.392 1
1 949 . 11 1 1 A 82 82 CYS CB C 82 26.762 26.945 -0.183 1
1 950 . 11 1 1 A 82 82 CYS N N 82 120.576 117.656 2.920 1
1 951 . 11 1 1 A 83 83 ARG H H 83 8.522 7.943 0.579 1
1 952 . 11 1 1 A 83 83 ARG HA H 83 3.932 4.227 -0.295 1
1 960 . 11 1 1 A 83 83 ARG C C 83 179.138 178.593 0.545 1
1 961 . 11 1 1 A 83 83 ARG CA C 83 60.443 58.936 1.507 1
1 962 . 11 1 1 A 83 83 ARG CB C 83 29.550 29.625 -0.075 1
1 965 . 11 1 1 A 83 83 ARG N N 83 123.035 119.824 3.211 1
1 967 . 11 1 1 A 84 84 ASP H H 84 7.791 8.102 -0.311 1
1 968 . 11 1 1 A 84 84 ASP HA H 84 4.353 4.428 -0.075 1
1 971 . 11 1 1 A 84 84 ASP C C 84 178.649 178.430 0.219 1
1 972 . 11 1 1 A 84 84 ASP CA C 84 57.767 57.551 0.216 1
1 973 . 11 1 1 A 84 84 ASP CB C 84 41.305 41.443 -0.138 1
1 974 . 11 1 1 A 84 84 ASP N N 84 120.332 119.685 0.647 1
1 975 . 11 1 1 A 85 85 THR H H 85 8.370 7.757 0.613 1
1 976 . 11 1 1 A 85 85 THR HA H 85 3.730 4.006 -0.276 1
1 981 . 11 1 1 A 85 85 THR C C 85 175.198 176.237 -1.039 1
1 982 . 11 1 1 A 85 85 THR CA C 85 66.830 64.937 1.893 1
1 983 . 11 1 1 A 85 85 THR CB C 85 68.533 68.860 -0.327 1
1 985 . 11 1 1 A 85 85 THR N N 85 117.360 113.454 3.906 1
1 986 . 11 1 1 A 86 86 ALA H H 86 8.845 8.296 0.549 1
1 987 . 11 1 1 A 86 86 ALA HA H 86 3.991 4.161 -0.170 1
1 991 . 11 1 1 A 86 86 ALA C C 86 179.980 179.749 0.231 1
1 992 . 11 1 1 A 86 86 ALA CA C 86 55.769 55.474 0.295 1
1 993 . 11 1 1 A 86 86 ALA CB C 86 17.881 18.530 -0.649 1
1 994 . 11 1 1 A 86 86 ALA N N 86 123.613 123.354 0.259 1
1 995 . 11 1 1 A 87 87 LYS H H 87 7.686 7.822 -0.136 1
1 996 . 11 1 1 A 87 87 LYS HA H 87 4.099 3.964 0.135 1
1 1005 . 11 1 1 A 87 87 LYS C C 87 179.592 178.503 1.089 1
1 1006 . 11 1 1 A 87 87 LYS CA C 87 59.708 59.203 0.505 1
1 1007 . 11 1 1 A 87 87 LYS CB C 87 32.054 31.853 0.201 1
1 1011 . 11 1 1 A 87 87 LYS N N 87 119.623 117.006 2.617 1
1 1012 . 11 1 1 A 88 88 ARG H H 88 7.683 7.545 0.138 1
1 1013 . 11 1 1 A 88 88 ARG HA H 88 4.051 4.141 -0.090 1
1 1020 . 11 1 1 A 88 88 ARG C C 88 180.053 178.227 1.826 1
1 1021 . 11 1 1 A 88 88 ARG CA C 88 59.558 58.959 0.599 1
1 1022 . 11 1 1 A 88 88 ARG CB C 88 29.684 29.953 -0.269 1
1 1025 . 11 1 1 A 88 88 ARG N N 88 120.788 119.340 1.448 1
1 1026 . 11 1 1 A 89 89 ASN H H 89 8.973 8.239 0.734 1
1 1027 . 11 1 1 A 89 89 ASN HA H 89 4.354 4.600 -0.246 1
1 1032 . 11 1 1 A 89 89 ASN C C 89 178.382 177.670 0.712 1
1 1033 . 11 1 1 A 89 89 ASN CA C 89 55.334 55.394 -0.060 1
1 1034 . 11 1 1 A 89 89 ASN CB C 89 37.864 38.546 -0.682 1
1 1035 . 11 1 1 A 89 89 ASN N N 89 121.012 117.869 3.143 1
1 1037 . 11 1 1 A 90 90 GLN H H 90 8.152 7.960 0.192 1
1 1038 . 11 1 1 A 90 90 GLN HA H 90 4.020 4.089 -0.069 1
1 1045 . 11 1 1 A 90 90 GLN C C 90 179.075 178.497 0.578 1
1 1046 . 11 1 1 A 90 90 GLN CA C 90 59.318 58.896 0.422 1
1 1047 . 11 1 1 A 90 90 GLN CB C 90 28.049 28.177 -0.128 1
1 1049 . 11 1 1 A 90 90 GLN N N 90 122.122 119.134 2.988 1
1 1051 . 11 1 1 A 91 91 GLN H H 91 7.514 8.027 -0.513 1
1 1052 . 11 1 1 A 91 91 GLN HA H 91 4.053 4.091 -0.038 1
1 1059 . 11 1 1 A 91 91 GLN C C 91 177.081 177.968 -0.887 1
1 1060 . 11 1 1 A 91 91 GLN CA C 91 58.031 58.300 -0.269 1
1 1061 . 11 1 1 A 91 91 GLN CB C 91 28.365 27.554 0.811 1
1 1063 . 11 1 1 A 91 91 GLN N N 91 118.124 118.147 -0.023 1
1 1065 . 11 1 1 A 92 92 ALA H H 92 7.704 7.235 0.469 1
1 1066 . 11 1 1 A 92 92 ALA HA H 92 4.246 4.235 0.011 1
1 1070 . 11 1 1 A 92 92 ALA C C 92 178.450 178.046 0.404 1
1 1071 . 11 1 1 A 92 92 ALA CA C 92 52.671 52.646 0.025 1
1 1072 . 11 1 1 A 92 92 ALA CB C 92 19.316 19.656 -0.340 1
1 1073 . 11 1 1 A 92 92 ALA N N 92 119.880 120.568 -0.688 1
1 1074 . 11 1 1 A 93 93 GLY H H 93 7.693 7.745 -0.052 1
1 1075 . 11 1 1 A 93 93 GLY HA2 H 93 3.941 3.891 0.050 1
1 1076 . 11 1 1 A 93 93 GLY HA3 H 93 3.744 3.894 -0.150 1
1 1077 . 11 1 1 A 93 93 GLY C C 93 174.344 175.015 -0.671 1
1 1078 . 11 1 1 A 93 93 GLY CA C 93 45.949 45.664 0.285 1
1 1079 . 11 1 1 A 93 93 GLY N N 93 105.347 106.377 -1.030 1
1 1080 . 11 1 1 A 94 94 ASN H H 94 7.076 7.989 -0.913 1
1 1081 . 11 1 1 A 94 94 ASN HA H 94 4.115 4.429 -0.314 1
1 1085 . 11 1 1 A 94 94 ASN C C 94 175.410 175.515 -0.105 1
1 1086 . 11 1 1 A 94 94 ASN CA C 94 52.651 52.371 0.280 1
1 1087 . 11 1 1 A 94 94 ASN CB C 94 38.330 38.695 -0.365 1
1 1088 . 11 1 1 A 94 94 ASN N N 94 115.747 117.980 -2.233 1
1 1090 . 11 1 1 A 95 95 GLY H H 95 8.236 8.364 -0.128 1
1 1091 . 11 1 1 A 95 95 GLY HA2 H 95 3.633 3.804 -0.171 1
1 1092 . 11 1 1 A 95 95 GLY HA3 H 95 3.633 3.920 -0.287 1
1 1093 . 11 1 1 A 95 95 GLY C C 95 174.450 173.834 0.616 1
1 1094 . 11 1 1 A 95 95 GLY CA C 95 45.522 45.934 -0.412 1
1 1095 . 11 1 1 A 95 95 GLY N N 95 109.166 108.777 0.389 1
1 1096 . 11 1 1 A 96 96 TRP H H 96 7.899 7.752 0.147 1
1 1097 . 11 1 1 A 96 96 TRP HA H 96 5.241 5.067 0.174 1
1 1106 . 11 1 1 A 96 96 TRP C C 96 175.661 175.999 -0.338 1
1 1107 . 11 1 1 A 96 96 TRP CA C 96 55.090 56.571 -1.481 1
1 1108 . 11 1 1 A 96 96 TRP CB C 96 27.138 32.045 -4.907 1
1 1114 . 11 1 1 A 96 96 TRP N N 96 122.840 120.057 2.783 1
1 1116 . 11 1 1 A 97 97 ASP H H 97 7.344 9.001 -1.657 1
1 1117 . 11 1 1 A 97 97 ASP HA H 97 4.829 4.351 0.478 1
1 1120 . 11 1 1 A 97 97 ASP C C 97 175.019 176.115 -1.096 1
1 1121 . 11 1 1 A 97 97 ASP CA C 97 52.149 56.337 -4.188 1
1 1122 . 11 1 1 A 97 97 ASP CB C 97 42.697 38.607 4.090 1
1 1123 . 11 1 1 A 97 97 ASP N N 97 126.861 117.111 9.750 1
1 1124 . 11 1 1 A 98 98 PHE H H 98 8.566 8.472 0.094 1
1 1125 . 11 1 1 A 98 98 PHE HA H 98 3.727 4.201 -0.474 1
1 1133 . 11 1 1 A 98 98 PHE C C 98 177.443 177.260 0.183 1
1 1134 . 11 1 1 A 98 98 PHE CA C 98 62.471 61.240 1.231 1
1 1135 . 11 1 1 A 98 98 PHE CB C 98 39.919 39.859 0.060 1
1 1141 . 11 1 1 A 98 98 PHE N N 98 117.781 120.975 -3.194 1
1 1142 . 11 1 1 A 99 99 ASP H H 99 8.259 8.322 -0.063 1
1 1143 . 11 1 1 A 99 99 ASP HA H 99 3.960 4.091 -0.131 1
1 1146 . 11 1 1 A 99 99 ASP C C 99 178.132 178.425 -0.293 1
1 1147 . 11 1 1 A 99 99 ASP CA C 99 57.658 56.293 1.365 1
1 1148 . 11 1 1 A 99 99 ASP CB C 99 38.572 40.794 -2.222 1
1 1149 . 11 1 1 A 99 99 ASP N N 99 121.709 119.228 2.481 1
1 1150 . 11 1 1 A 100 100 MET H H 100 8.008 8.222 -0.214 1
1 1151 . 11 1 1 A 100 100 MET HA H 100 3.644 4.336 -0.692 1
1 1156 . 11 1 1 A 100 100 MET C C 100 180.008 175.937 4.071 1
1 1157 . 11 1 1 A 100 100 MET CA C 100 58.598 57.640 0.958 1
1 1158 . 11 1 1 A 100 100 MET CB C 100 33.423 32.823 0.600 1
1 1160 . 11 1 1 A 100 100 MET N N 100 119.668 117.450 2.218 1
1 1161 . 11 1 1 A 101 101 LEU H H 101 7.961 7.630 0.331 1
1 1162 . 11 1 1 A 101 101 LEU HA H 101 3.523 4.703 -1.180 1
1 1172 . 11 1 1 A 101 101 LEU C C 101 173.873 176.272 -2.399 1
1 1173 . 11 1 1 A 101 101 LEU CA C 101 58.743 53.614 5.129 1
1 1174 . 11 1 1 A 101 101 LEU CB C 101 42.632 44.052 -1.420 1
1 1178 . 11 1 1 A 101 101 LEU N N 101 119.752 120.411 -0.659 1
1 1179 . 11 1 1 A 102 102 THR H H 102 6.955 8.787 -1.832 1
1 1180 . 11 1 1 A 102 102 THR HA H 102 4.134 4.371 -0.237 1
1 1185 . 11 1 1 A 102 102 THR C C 102 176.513 173.586 2.927 1
1 1186 . 11 1 1 A 102 102 THR CA C 102 61.125 62.324 -1.199 1
1 1187 . 11 1 1 A 102 102 THR CB C 102 71.415 68.652 2.763 1
1 1189 . 11 1 1 A 102 102 THR N N 102 124.665 121.278 3.387 1
1 1190 . 11 1 1 A 103 103 GLY H H 103 7.816 8.818 -1.002 1
1 1191 . 11 1 1 A 103 103 GLY HA2 H 103 3.824 3.981 -0.157 1
1 1192 . 11 1 1 A 103 103 GLY HA3 H 103 3.824 4.103 -0.279 1
1 1193 . 11 1 1 A 103 103 GLY C C 103 174.126 173.982 0.144 1
1 1194 . 11 1 1 A 103 103 GLY CA C 103 47.805 47.383 0.422 1
1 1195 . 11 1 1 A 103 103 GLY N N 103 114.191 111.541 2.650 1
1 1196 . 11 1 1 A 104 104 SER H H 104 8.860 8.313 0.547 1
1 1197 . 11 1 1 A 104 104 SER HA H 104 4.758 4.580 0.178 1
1 1200 . 11 1 1 A 104 104 SER C C 104 174.591 174.151 0.440 1
1 1201 . 11 1 1 A 104 104 SER CA C 104 56.755 59.450 -2.695 1
1 1202 . 11 1 1 A 104 104 SER CB C 104 65.050 64.141 0.909 1
1 1203 . 11 1 1 A 104 104 SER N N 104 114.771 117.105 -2.334 1
1 1204 . 11 1 1 A 105 105 GLY H H 105 8.788 7.700 1.088 1
1 1205 . 11 1 1 A 105 105 GLY HA2 H 105 3.733 3.539 0.194 1
1 1206 . 11 1 1 A 105 105 GLY HA3 H 105 3.733 3.816 -0.083 1
1 1207 . 11 1 1 A 105 105 GLY CA C 105 47.247 44.898 2.349 1
1 1208 . 11 1 1 A 105 105 GLY N N 105 110.394 108.871 1.523 1
1 1209 . 11 1 1 A 106 106 ASN HA H 106 4.454 4.332 0.122 1
1 1212 . 11 1 1 A 106 106 ASN C C 106 175.180 176.334 -1.154 1
1 1213 . 11 1 1 A 106 106 ASN CA C 106 54.492 56.395 -1.903 1
1 1214 . 11 1 1 A 106 106 ASN CB C 106 37.282 38.411 -1.129 1
1 1215 . 11 1 1 A 107 107 TYR H H 107 8.241 8.076 0.165 1
1 1216 . 11 1 1 A 107 107 TYR HA H 107 4.335 4.478 -0.143 1
1 1223 . 11 1 1 A 107 107 TYR C C 107 173.954 177.286 -3.332 1
1 1224 . 11 1 1 A 107 107 TYR CA C 107 57.727 58.210 -0.483 1
1 1225 . 11 1 1 A 107 107 TYR CB C 107 37.063 38.057 -0.994 1
1 1230 . 11 1 1 A 107 107 TYR N N 107 120.708 118.663 2.045 1
1 1231 . 11 1 1 A 108 108 SER H H 108 7.117 7.524 -0.407 1
1 1232 . 11 1 1 A 108 108 SER HA H 108 4.221 4.180 0.041 1
1 1235 . 11 1 1 A 108 108 SER C C 108 174.834 174.201 0.633 1
1 1236 . 11 1 1 A 108 108 SER CA C 108 59.859 61.085 -1.226 1
1 1237 . 11 1 1 A 108 108 SER CB C 108 63.846 63.336 0.510 1
1 1238 . 11 1 1 A 108 108 SER N N 108 113.362 117.025 -3.663 1
1 1239 . 11 1 1 A 109 109 SER H H 109 8.053 8.101 -0.048 1
1 1240 . 11 1 1 A 109 109 SER HA H 109 4.560 4.407 0.153 1
1 1243 . 11 1 1 A 109 109 SER CA C 109 57.141 59.456 -2.315 1
1 1244 . 11 1 1 A 109 109 SER CB C 109 64.874 63.060 1.814 1
1 1245 . 11 1 1 A 109 109 SER N N 109 116.657 115.254 1.403 1
1 1246 . 11 1 1 A 110 110 THR HA H 110 3.541 4.096 -0.555 1
1 1251 . 11 1 1 A 110 110 THR C C 110 175.477 175.792 -0.315 1
1 1252 . 11 1 1 A 110 110 THR CA C 110 66.443 64.107 2.336 1
1 1253 . 11 1 1 A 110 110 THR CB C 110 68.091 69.073 -0.982 1
1 1255 . 11 1 1 A 111 111 ASP H H 111 8.224 7.804 0.420 1
1 1256 . 11 1 1 A 111 111 ASP HA H 111 4.237 4.322 -0.085 1
1 1259 . 11 1 1 A 111 111 ASP C C 111 177.520 177.957 -0.437 1
1 1260 . 11 1 1 A 111 111 ASP CA C 111 57.559 57.653 -0.094 1
1 1261 . 11 1 1 A 111 111 ASP CB C 111 40.292 41.829 -1.537 1
1 1262 . 11 1 1 A 111 111 ASP N N 111 119.490 121.658 -2.168 1
1 1263 . 11 1 1 A 112 112 ALA H H 112 7.431 7.925 -0.494 1
1 1264 . 11 1 1 A 112 112 ALA HA H 112 4.191 4.101 0.090 1
1 1268 . 11 1 1 A 112 112 ALA C C 112 180.646 179.860 0.786 1
1 1269 . 11 1 1 A 112 112 ALA CA C 112 54.534 54.883 -0.349 1
1 1270 . 11 1 1 A 112 112 ALA CB C 112 18.992 18.397 0.595 1
1 1271 . 11 1 1 A 112 112 ALA N N 112 119.710 121.139 -1.429 1
1 1272 . 11 1 1 A 113 113 GLN H H 113 7.576 8.091 -0.515 1
1 1273 . 11 1 1 A 113 113 GLN HA H 113 3.562 4.037 -0.475 1
1 1278 . 11 1 1 A 113 113 GLN C C 113 176.756 177.757 -1.001 1
1 1279 . 11 1 1 A 113 113 GLN CA C 113 57.736 58.333 -0.597 1
1 1280 . 11 1 1 A 113 113 GLN CB C 113 29.110 28.543 0.567 1
1 1281 . 11 1 1 A 113 113 GLN N N 113 117.518 115.711 1.807 1
1 1283 . 11 1 1 A 114 114 MET H H 114 8.192 8.371 -0.179 1
1 1284 . 11 1 1 A 114 114 MET HA H 114 4.231 4.243 -0.012 1
1 1289 . 11 1 1 A 114 114 MET C C 114 175.648 178.267 -2.619 1
1 1290 . 11 1 1 A 114 114 MET CA C 114 57.446 57.966 -0.520 1
1 1291 . 11 1 1 A 114 114 MET CB C 114 33.570 32.480 1.090 1
1 1293 . 11 1 1 A 114 114 MET N N 114 111.509 117.482 -5.973 1
1 1294 . 11 1 1 A 115 115 GLN H H 115 6.940 7.453 -0.513 1
1 1295 . 11 1 1 A 115 115 GLN HA H 115 4.307 4.206 0.101 1
1 1302 . 11 1 1 A 115 115 GLN C C 115 176.270 175.777 0.493 1
1 1303 . 11 1 1 A 115 115 GLN CA C 115 54.680 56.876 -2.196 1
1 1304 . 11 1 1 A 115 115 GLN CB C 115 28.233 28.970 -0.737 1
1 1306 . 11 1 1 A 115 115 GLN N N 115 114.300 117.391 -3.091 1
1 1308 . 11 1 1 A 116 116 TYR H H 116 6.677 7.942 -1.265 1
1 1309 . 11 1 1 A 116 116 TYR HA H 116 4.193 3.876 0.317 1
1 1312 . 11 1 1 A 116 116 TYR C C 116 175.268 174.084 1.184 1
1 1313 . 11 1 1 A 116 116 TYR CA C 116 54.357 58.401 -4.044 1
1 1314 . 11 1 1 A 116 116 TYR CB C 116 35.498 36.090 -0.592 1
1 1315 . 11 1 1 A 116 116 TYR N N 116 117.919 118.878 -0.959 1
1 1316 . 11 1 1 A 117 117 ASP H H 117 8.081 7.977 0.104 1
1 1317 . 11 1 1 A 117 117 ASP HA H 117 4.665 4.616 0.049 1
1 1320 . 11 1 1 A 117 117 ASP CA C 117 52.422 49.815 2.607 1
1 1321 . 11 1 1 A 117 117 ASP CB C 117 42.416 42.748 -0.332 1
1 1322 . 11 1 1 A 117 117 ASP N N 117 120.887 127.867 -6.980 1
1 1323 . 11 1 1 A 118 118 PRO C C 118 179.180 178.493 0.687 1
1 1324 . 11 1 1 A 118 118 PRO CA C 118 65.942 64.665 1.277 1
1 1325 . 11 1 1 A 118 118 PRO CB C 118 32.197 31.645 0.552 1
1 1326 . 11 1 1 A 119 119 GLY H H 119 9.742 8.340 1.402 1
1 1327 . 11 1 1 A 119 119 GLY C C 119 175.622 175.299 0.323 1
1 1328 . 11 1 1 A 119 119 GLY CA C 119 46.785 46.579 0.206 1
1 1329 . 11 1 1 A 119 119 GLY N N 119 106.412 106.332 0.080 1
1 1330 . 11 1 1 A 120 120 LEU H H 120 6.666 7.213 -0.547 1
1 1331 . 11 1 1 A 120 120 LEU HA H 120 3.365 3.623 -0.258 1
1 1341 . 11 1 1 A 120 120 LEU C C 120 179.262 178.523 0.739 1
1 1342 . 11 1 1 A 120 120 LEU CA C 120 56.605 57.206 -0.601 1
1 1343 . 11 1 1 A 120 120 LEU CB C 120 39.262 41.245 -1.983 1
1 1347 . 11 1 1 A 120 120 LEU N N 120 126.226 122.071 4.155 1
1 1348 . 11 1 1 A 121 121 PHE H H 121 7.356 8.571 -1.215 1
1 1349 . 11 1 1 A 121 121 PHE HA H 121 4.459 3.854 0.605 1
1 1352 . 11 1 1 A 121 121 PHE C C 121 179.716 177.778 1.938 1
1 1353 . 11 1 1 A 121 121 PHE CA C 121 62.838 62.030 0.808 1
1 1354 . 11 1 1 A 121 121 PHE CB C 121 37.603 39.163 -1.560 1
1 1355 . 11 1 1 A 121 121 PHE N N 121 117.437 119.201 -1.764 1
1 1356 . 11 1 1 A 122 122 ALA H H 122 7.926 7.967 -0.041 1
1 1357 . 11 1 1 A 122 122 ALA HA H 122 4.523 3.814 0.709 1
1 1361 . 11 1 1 A 122 122 ALA C C 122 180.435 179.694 0.741 1
1 1362 . 11 1 1 A 122 122 ALA CA C 122 55.527 55.090 0.437 1
1 1363 . 11 1 1 A 122 122 ALA CB C 122 17.814 18.116 -0.302 1
1 1364 . 11 1 1 A 122 122 ALA N N 122 121.068 121.389 -0.321 1
1 1365 . 11 1 1 A 123 123 GLN H H 123 7.507 7.679 -0.172 1
1 1366 . 11 1 1 A 123 123 GLN HA H 123 4.153 4.005 0.148 1
1 1371 . 11 1 1 A 123 123 GLN C C 123 180.561 178.171 2.390 1
1 1372 . 11 1 1 A 123 123 GLN CA C 123 59.948 58.859 1.089 1
1 1373 . 11 1 1 A 123 123 GLN CB C 123 29.135 28.389 0.746 1
1 1375 . 11 1 1 A 123 123 GLN N N 123 120.324 117.414 2.910 1
1 1376 . 11 1 1 A 124 124 ILE H H 124 8.318 8.124 0.194 1
1 1377 . 11 1 1 A 124 124 ILE HA H 124 3.635 3.876 -0.241 1
1 1387 . 11 1 1 A 124 124 ILE C C 124 176.481 178.139 -1.658 1
1 1388 . 11 1 1 A 124 124 ILE CA C 124 66.432 64.655 1.777 1
1 1389 . 11 1 1 A 124 124 ILE CB C 124 39.168 37.819 1.349 1
1 1393 . 11 1 1 A 124 124 ILE N N 124 123.747 119.060 4.687 1
1 1394 . 11 1 1 A 125 125 GLN H H 125 8.474 7.996 0.478 1
1 1395 . 11 1 1 A 125 125 GLN HA H 125 4.264 3.968 0.296 1
1 1402 . 11 1 1 A 125 125 GLN C C 125 178.947 177.886 1.061 1
1 1403 . 11 1 1 A 125 125 GLN CA C 125 59.651 58.560 1.091 1
1 1404 . 11 1 1 A 125 125 GLN CB C 125 28.880 28.490 0.390 1
1 1406 . 11 1 1 A 125 125 GLN N N 125 120.368 121.152 -0.784 1
1 1408 . 11 1 1 A 126 126 ALA H H 126 8.002 7.760 0.242 1
1 1409 . 11 1 1 A 126 126 ALA HA H 126 4.144 4.050 0.094 1
1 1413 . 11 1 1 A 126 126 ALA C C 126 179.316 179.908 -0.592 1
1 1414 . 11 1 1 A 126 126 ALA CA C 126 55.036 54.899 0.137 1
1 1415 . 11 1 1 A 126 126 ALA CB C 126 18.087 17.855 0.232 1
1 1416 . 11 1 1 A 126 126 ALA N N 126 121.661 121.368 0.293 1
1 1417 . 11 1 1 A 127 127 ALA H H 127 7.823 8.359 -0.536 1
1 1418 . 11 1 1 A 127 127 ALA HA H 127 4.162 4.044 0.118 1
1 1422 . 11 1 1 A 127 127 ALA C C 127 180.707 179.435 1.272 1
1 1423 . 11 1 1 A 127 127 ALA CA C 127 55.080 54.948 0.132 1
1 1424 . 11 1 1 A 127 127 ALA CB C 127 19.354 18.666 0.688 1
1 1425 . 11 1 1 A 127 127 ALA N N 127 119.853 119.644 0.209 1
1 1426 . 11 1 1 A 128 128 ALA H H 128 8.936 7.864 1.072 1
1 1427 . 11 1 1 A 128 128 ALA HA H 128 3.928 3.913 0.015 1
1 1431 . 11 1 1 A 128 128 ALA C C 128 181.031 179.308 1.723 1
1 1432 . 11 1 1 A 128 128 ALA CA C 128 55.502 54.781 0.721 1
1 1433 . 11 1 1 A 128 128 ALA CB C 128 16.609 17.692 -1.083 1
1 1434 . 11 1 1 A 128 128 ALA N N 128 121.355 120.323 1.032 1
1 1435 . 11 1 1 A 129 129 THR H H 129 8.543 8.071 0.472 1
1 1436 . 11 1 1 A 129 129 THR HA H 129 4.015 3.676 0.339 1
1 1441 . 11 1 1 A 129 129 THR C C 129 177.332 176.497 0.835 1
1 1442 . 11 1 1 A 129 129 THR CA C 129 65.893 65.521 0.372 1
1 1443 . 11 1 1 A 129 129 THR CB C 129 68.566 68.099 0.467 1
1 1445 . 11 1 1 A 129 129 THR N N 129 112.709 111.051 1.658 1
1 1446 . 11 1 1 A 130 130 LYS H H 130 8.126 7.617 0.509 1
1 1447 . 11 1 1 A 130 130 LYS HA H 130 4.000 3.902 0.098 1
1 1456 . 11 1 1 A 130 130 LYS C C 130 179.082 178.489 0.593 1
1 1457 . 11 1 1 A 130 130 LYS CA C 130 60.299 59.304 0.995 1
1 1458 . 11 1 1 A 130 130 LYS CB C 130 32.767 32.437 0.330 1
1 1462 . 11 1 1 A 130 130 LYS N N 130 123.879 121.892 1.987 1
1 1463 . 11 1 1 A 131 131 ALA H H 131 7.184 7.743 -0.559 1
1 1464 . 11 1 1 A 131 131 ALA HA H 131 4.005 4.189 -0.184 1
1 1468 . 11 1 1 A 131 131 ALA C C 131 178.482 179.679 -1.197 1
1 1469 . 11 1 1 A 131 131 ALA CA C 131 55.027 55.235 -0.208 1
1 1470 . 11 1 1 A 131 131 ALA CB C 131 18.669 18.795 -0.126 1
1 1471 . 11 1 1 A 131 131 ALA N N 131 118.590 120.800 -2.210 1
1 1472 . 11 1 1 A 132 132 TRP H H 132 7.977 8.543 -0.566 1
1 1473 . 11 1 1 A 132 132 TRP HA H 132 4.001 4.062 -0.061 1
1 1480 . 11 1 1 A 132 132 TRP C C 132 177.332 175.882 1.450 1
1 1481 . 11 1 1 A 132 132 TRP CA C 132 60.431 57.853 2.578 1
1 1482 . 11 1 1 A 132 132 TRP CB C 132 27.786 27.529 0.257 1
1 1486 . 11 1 1 A 132 132 TRP N N 132 119.168 116.935 2.233 1
1 1488 . 11 1 1 A 133 133 ARG H H 133 8.006 7.890 0.116 1
1 1489 . 11 1 1 A 133 133 ARG HA H 133 4.027 4.364 -0.337 1
1 1497 . 11 1 1 A 133 133 ARG C C 133 176.664 178.098 -1.434 1
1 1498 . 11 1 1 A 133 133 ARG CA C 133 59.355 57.265 2.090 1
1 1499 . 11 1 1 A 133 133 ARG CB C 133 30.451 32.330 -1.879 1
1 1502 . 11 1 1 A 133 133 ARG N N 133 113.062 120.565 -7.503 1
1 1504 . 11 1 1 A 134 134 LYS H H 134 7.322 7.920 -0.598 1
1 1505 . 11 1 1 A 134 134 LYS HA H 134 4.313 4.269 0.044 1
1 1514 . 11 1 1 A 134 134 LYS C C 134 176.282 176.114 0.168 1
1 1515 . 11 1 1 A 134 134 LYS CA C 134 54.922 56.838 -1.916 1
1 1516 . 11 1 1 A 134 134 LYS CB C 134 32.633 32.031 0.602 1
1 1520 . 11 1 1 A 134 134 LYS N N 134 118.170 116.330 1.840 1
1 1521 . 11 1 1 A 135 135 LEU H H 135 7.440 7.332 0.108 1
1 1522 . 11 1 1 A 135 135 LEU HA H 135 4.174 4.575 -0.401 1
1 1532 . 11 1 1 A 135 135 LEU CA C 135 54.408 53.126 1.282 1
1 1533 . 11 1 1 A 135 135 LEU CB C 135 40.407 41.078 -0.671 1
1 1537 . 11 1 1 A 135 135 LEU N N 135 123.358 121.688 1.670 1
1 1538 . 11 1 1 A 136 136 PRO HA H 136 4.437 4.426 0.011 1
1 1545 . 11 1 1 A 136 136 PRO C C 136 177.106 176.320 0.786 1
1 1546 . 11 1 1 A 136 136 PRO CA C 136 62.889 65.652 -2.763 1
1 1547 . 11 1 1 A 136 136 PRO CB C 136 32.192 31.539 0.653 1
1 1550 . 11 1 1 A 137 137 VAL H H 137 8.219 7.629 0.590 1
1 1551 . 11 1 1 A 137 137 VAL HA H 137 4.077 4.683 -0.606 1
1 1559 . 11 1 1 A 137 137 VAL C C 137 176.305 175.996 0.309 1
1 1560 . 11 1 1 A 137 137 VAL CA C 137 61.958 60.334 1.624 1
1 1561 . 11 1 1 A 137 137 VAL CB C 137 32.755 35.606 -2.851 1
1 1564 . 11 1 1 A 137 137 VAL N N 137 120.079 115.246 4.833 1
1 1565 . 11 1 1 A 138 138 LYS H H 138 8.444 8.817 -0.373 1
1 1566 . 11 1 1 A 138 138 LYS HA H 138 4.316 3.908 0.408 1
1 1575 . 11 1 1 A 138 138 LYS C C 138 176.790 176.784 0.006 1
1 1576 . 11 1 1 A 138 138 LYS CA C 138 56.792 58.411 -1.619 1
1 1577 . 11 1 1 A 138 138 LYS CB C 138 33.205 33.471 -0.266 1
1 1581 . 11 1 1 A 138 138 LYS N N 138 126.449 126.434 0.015 1
1 1582 . 11 1 1 A 139 139 GLY H H 139 8.518 8.464 0.054 1
1 1583 . 11 1 1 A 139 139 GLY HA2 H 139 4.070 3.920 0.150 1
1 1584 . 11 1 1 A 139 139 GLY HA3 H 139 3.897 3.924 -0.027 1
1 1585 . 11 1 1 A 139 139 GLY C C 139 172.874 173.227 -0.353 1
1 1586 . 11 1 1 A 139 139 GLY CA C 139 45.157 45.660 -0.503 1
1 1587 . 11 1 1 A 139 139 GLY N N 139 112.617 107.307 5.310 1
1 6 . 12 1 1 A 2 2 VAL H H 2 8.992 8.351 0.641 1
1 7 . 12 1 1 A 2 2 VAL HA H 2 5.370 4.830 0.540 1
1 15 . 12 1 1 A 2 2 VAL C C 2 174.325 174.307 0.018 1
1 16 . 12 1 1 A 2 2 VAL CA C 2 61.267 60.435 0.832 1
1 17 . 12 1 1 A 2 2 VAL CB C 2 33.890 35.109 -1.219 1
1 20 . 12 1 1 A 2 2 VAL N N 2 126.939 119.455 7.484 1
1 21 . 12 1 1 A 3 3 THR H H 3 8.912 9.021 -0.109 1
1 22 . 12 1 1 A 3 3 THR HA H 3 4.505 5.008 -0.503 1
1 27 . 12 1 1 A 3 3 THR C C 3 172.710 173.200 -0.490 1
1 28 . 12 1 1 A 3 3 THR CA C 3 59.689 59.781 -0.092 1
1 29 . 12 1 1 A 3 3 THR CB C 3 72.398 71.486 0.912 1
1 31 . 12 1 1 A 3 3 THR N N 3 118.091 122.898 -4.807 1
1 32 . 12 1 1 A 4 4 GLU H H 4 8.631 8.674 -0.043 1
1 33 . 12 1 1 A 4 4 GLU HA H 4 5.788 5.036 0.752 1
1 38 . 12 1 1 A 4 4 GLU C C 4 175.758 174.818 0.940 1
1 39 . 12 1 1 A 4 4 GLU CA C 4 54.902 55.350 -0.448 1
1 40 . 12 1 1 A 4 4 GLU CB C 4 35.097 31.883 3.214 1
1 42 . 12 1 1 A 4 4 GLU N N 4 120.966 125.728 -4.762 1
1 43 . 12 1 1 A 5 5 THR H H 5 9.188 8.752 0.436 1
1 44 . 12 1 1 A 5 5 THR HA H 5 4.739 4.834 -0.095 1
1 49 . 12 1 1 A 5 5 THR C C 5 172.757 172.367 0.390 1
1 50 . 12 1 1 A 5 5 THR CA C 5 60.382 60.021 0.361 1
1 51 . 12 1 1 A 5 5 THR CB C 5 71.558 70.617 0.941 1
1 53 . 12 1 1 A 5 5 THR N N 5 119.366 115.853 3.513 1
1 54 . 12 1 1 A 6 6 VAL H H 6 8.476 8.824 -0.348 1
1 55 . 12 1 1 A 6 6 VAL HA H 6 5.026 5.008 0.018 1
1 63 . 12 1 1 A 6 6 VAL C C 6 176.674 173.531 3.143 1
1 64 . 12 1 1 A 6 6 VAL CA C 6 61.008 59.215 1.793 1
1 65 . 12 1 1 A 6 6 VAL CB C 6 33.861 34.188 -0.327 1
1 68 . 12 1 1 A 6 6 VAL N N 6 121.384 122.770 -1.386 1
1 69 . 12 1 1 A 7 7 ASP H H 7 8.848 9.013 -0.165 1
1 70 . 12 1 1 A 7 7 ASP HA H 7 4.797 5.230 -0.433 1
1 73 . 12 1 1 A 7 7 ASP CA C 7 52.834 53.090 -0.256 1
1 74 . 12 1 1 A 7 7 ASP CB C 7 42.219 43.582 -1.363 1
1 75 . 12 1 1 A 7 7 ASP N N 7 127.061 124.392 2.669 1
1 76 . 12 1 1 A 8 8 GLY C C 8 175.143 174.664 0.479 1
1 77 . 12 1 1 A 8 8 GLY CA C 8 46.553 46.907 -0.354 1
1 78 . 12 1 1 A 9 9 GLN H H 9 8.408 8.173 0.235 1
1 79 . 12 1 1 A 9 9 GLN HA H 9 4.541 4.265 0.276 1
1 86 . 12 1 1 A 9 9 GLN C C 9 176.463 176.755 -0.292 1
1 87 . 12 1 1 A 9 9 GLN CA C 9 55.167 55.308 -0.141 1
1 88 . 12 1 1 A 9 9 GLN CB C 9 29.376 27.801 1.575 1
1 90 . 12 1 1 A 9 9 GLN N N 9 118.300 116.986 1.314 1
1 92 . 12 1 1 A 10 10 GLY H H 10 8.162 8.098 0.064 1
1 93 . 12 1 1 A 10 10 GLY HA2 H 10 4.174 3.924 0.250 1
1 94 . 12 1 1 A 10 10 GLY HA3 H 10 3.521 3.935 -0.414 1
1 95 . 12 1 1 A 10 10 GLY C C 10 174.092 174.255 -0.163 1
1 96 . 12 1 1 A 10 10 GLY CA C 10 45.558 45.651 -0.093 1
1 97 . 12 1 1 A 10 10 GLY N N 10 108.747 109.873 -1.126 1
1 98 . 12 1 1 A 11 11 GLN H H 11 8.507 7.969 0.538 1
1 99 . 12 1 1 A 11 11 GLN HA H 11 4.202 4.705 -0.503 1
1 106 . 12 1 1 A 11 11 GLN C C 11 173.992 175.041 -1.049 1
1 107 . 12 1 1 A 11 11 GLN CA C 11 55.098 55.196 -0.098 1
1 108 . 12 1 1 A 11 11 GLN CB C 11 29.097 30.341 -1.244 1
1 110 . 12 1 1 A 11 11 GLN N N 11 122.979 118.854 4.125 1
1 112 . 12 1 1 A 12 12 ALA H H 12 8.259 8.987 -0.728 1
1 113 . 12 1 1 A 12 12 ALA HA H 12 5.156 5.552 -0.396 1
1 117 . 12 1 1 A 12 12 ALA C C 12 177.284 176.747 0.537 1
1 118 . 12 1 1 A 12 12 ALA CA C 12 51.087 50.405 0.682 1
1 119 . 12 1 1 A 12 12 ALA CB C 12 20.500 21.852 -1.352 1
1 120 . 12 1 1 A 12 12 ALA N N 12 127.100 125.140 1.960 1
1 121 . 12 1 1 A 13 13 TRP H H 13 9.245 8.436 0.809 1
1 122 . 12 1 1 A 13 13 TRP HA H 13 4.717 5.701 -0.984 1
1 131 . 12 1 1 A 13 13 TRP C C 13 175.108 173.942 1.166 1
1 132 . 12 1 1 A 13 13 TRP CA C 13 55.966 55.246 0.720 1
1 133 . 12 1 1 A 13 13 TRP CB C 13 31.912 33.111 -1.199 1
1 139 . 12 1 1 A 13 13 TRP N N 13 123.088 118.568 4.520 1
1 141 . 12 1 1 A 14 14 ARG H H 14 8.575 9.033 -0.458 1
1 142 . 12 1 1 A 14 14 ARG HA H 14 5.335 5.007 0.328 1
1 150 . 12 1 1 A 14 14 ARG C C 14 175.191 173.803 1.388 1
1 151 . 12 1 1 A 14 14 ARG CA C 14 53.106 55.425 -2.319 1
1 152 . 12 1 1 A 14 14 ARG CB C 14 32.749 33.897 -1.148 1
1 154 . 12 1 1 A 14 14 ARG N N 14 121.163 118.704 2.459 1
1 156 . 12 1 1 A 15 15 HIS H H 15 8.595 9.025 -0.430 1
1 157 . 12 1 1 A 15 15 HIS HA H 15 4.790 4.880 -0.090 1
1 161 . 12 1 1 A 15 15 HIS C C 15 173.770 173.808 -0.038 1
1 162 . 12 1 1 A 15 15 HIS CA C 15 55.289 54.519 0.770 1
1 163 . 12 1 1 A 15 15 HIS CB C 15 33.208 33.968 -0.760 1
1 165 . 12 1 1 A 15 15 HIS N N 15 117.643 117.253 0.390 1
1 166 . 12 1 1 A 16 16 HIS H H 16 8.993 8.892 0.101 1
1 167 . 12 1 1 A 16 16 HIS HA H 16 5.158 4.982 0.176 1
1 171 . 12 1 1 A 16 16 HIS C C 16 173.608 175.341 -1.733 1
1 172 . 12 1 1 A 16 16 HIS CA C 16 56.450 55.191 1.259 1
1 173 . 12 1 1 A 16 16 HIS CB C 16 34.171 31.540 2.631 1
1 175 . 12 1 1 A 16 16 HIS N N 16 123.520 118.352 5.168 1
1 176 . 12 1 1 A 17 17 ASN H H 17 7.829 9.316 -1.487 1
1 177 . 12 1 1 A 17 17 ASN HA H 17 4.713 5.399 -0.686 1
1 182 . 12 1 1 A 17 17 ASN C C 17 173.682 175.348 -1.666 1
1 183 . 12 1 1 A 17 17 ASN CA C 17 51.822 51.742 0.080 1
1 184 . 12 1 1 A 17 17 ASN CB C 17 43.176 42.179 0.997 1
1 185 . 12 1 1 A 17 17 ASN N N 17 122.213 119.778 2.435 1
1 187 . 12 1 1 A 18 18 GLY H H 18 8.423 8.485 -0.062 1
1 188 . 12 1 1 A 18 18 GLY HA2 H 18 3.931 3.670 0.261 1
1 189 . 12 1 1 A 18 18 GLY HA3 H 18 3.707 3.924 -0.217 1
1 190 . 12 1 1 A 18 18 GLY C C 18 173.985 172.905 1.080 1
1 191 . 12 1 1 A 18 18 GLY CA C 18 43.949 44.347 -0.398 1
1 192 . 12 1 1 A 18 18 GLY N N 18 106.991 107.711 -0.720 1
1 193 . 12 1 1 A 19 19 PHE H H 19 8.338 7.891 0.447 1
1 194 . 12 1 1 A 19 19 PHE HA H 19 4.068 4.650 -0.582 1
1 197 . 12 1 1 A 19 19 PHE C C 19 176.568 175.319 1.249 1
1 198 . 12 1 1 A 19 19 PHE CA C 19 59.338 58.914 0.424 1
1 199 . 12 1 1 A 19 19 PHE CB C 19 40.201 39.230 0.971 1
1 200 . 12 1 1 A 19 19 PHE N N 19 116.857 118.788 -1.931 1
1 201 . 12 1 1 A 20 20 ASP H H 20 8.794 8.711 0.083 1
1 202 . 12 1 1 A 20 20 ASP HA H 20 4.485 4.837 -0.352 1
1 205 . 12 1 1 A 20 20 ASP C C 20 177.379 176.666 0.713 1
1 206 . 12 1 1 A 20 20 ASP CA C 20 54.140 53.961 0.179 1
1 207 . 12 1 1 A 20 20 ASP CB C 20 41.915 41.525 0.390 1
1 208 . 12 1 1 A 20 20 ASP N N 20 123.025 124.464 -1.439 1
1 209 . 12 1 1 A 21 21 PHE H H 21 8.862 9.086 -0.224 1
1 210 . 12 1 1 A 21 21 PHE HA H 21 4.087 4.098 -0.011 1
1 218 . 12 1 1 A 21 21 PHE C C 21 176.952 177.251 -0.299 1
1 219 . 12 1 1 A 21 21 PHE CA C 21 61.095 62.287 -1.192 1
1 220 . 12 1 1 A 21 21 PHE CB C 21 38.678 39.349 -0.671 1
1 226 . 12 1 1 A 21 21 PHE N N 21 127.163 127.361 -0.198 1
1 227 . 12 1 1 A 22 22 ALA H H 22 8.561 8.388 0.173 1
1 228 . 12 1 1 A 22 22 ALA HA H 22 3.878 3.967 -0.089 1
1 232 . 12 1 1 A 22 22 ALA C C 22 180.710 180.162 0.548 1
1 233 . 12 1 1 A 22 22 ALA CA C 22 55.211 55.148 0.063 1
1 234 . 12 1 1 A 22 22 ALA CB C 22 18.321 18.138 0.183 1
1 235 . 12 1 1 A 22 22 ALA N N 22 120.293 121.257 -0.964 1
1 236 . 12 1 1 A 23 23 VAL H H 23 7.241 7.819 -0.578 1
1 237 . 12 1 1 A 23 23 VAL HA H 23 3.684 3.500 0.184 1
1 245 . 12 1 1 A 23 23 VAL C C 23 177.101 178.129 -1.028 1
1 246 . 12 1 1 A 23 23 VAL CA C 23 65.237 66.937 -1.700 1
1 247 . 12 1 1 A 23 23 VAL CB C 23 31.780 31.611 0.169 1
1 250 . 12 1 1 A 23 23 VAL N N 23 118.775 117.880 0.895 1
1 251 . 12 1 1 A 24 24 ILE H H 24 6.761 7.987 -1.226 1
1 252 . 12 1 1 A 24 24 ILE HA H 24 3.196 3.509 -0.313 1
1 262 . 12 1 1 A 24 24 ILE C C 24 177.287 178.106 -0.819 1
1 263 . 12 1 1 A 24 24 ILE CA C 24 63.404 65.537 -2.133 1
1 264 . 12 1 1 A 24 24 ILE CB C 24 36.294 37.747 -1.453 1
1 268 . 12 1 1 A 24 24 ILE N N 24 119.036 119.547 -0.511 1
1 269 . 12 1 1 A 25 25 LYS H H 25 8.032 8.256 -0.224 1
1 270 . 12 1 1 A 25 25 LYS HA H 25 3.809 3.726 0.083 1
1 279 . 12 1 1 A 25 25 LYS C C 25 179.450 178.684 0.766 1
1 280 . 12 1 1 A 25 25 LYS CA C 25 59.621 59.185 0.436 1
1 281 . 12 1 1 A 25 25 LYS CB C 25 32.259 32.047 0.212 1
1 285 . 12 1 1 A 25 25 LYS N N 25 118.368 120.249 -1.881 1
1 286 . 12 1 1 A 26 26 GLU H H 26 7.845 8.074 -0.229 1
1 287 . 12 1 1 A 26 26 GLU HA H 26 4.021 4.094 -0.073 1
1 292 . 12 1 1 A 26 26 GLU C C 26 179.191 178.977 0.214 1
1 293 . 12 1 1 A 26 26 GLU CA C 26 59.530 59.130 0.400 1
1 294 . 12 1 1 A 26 26 GLU CB C 26 29.449 29.354 0.095 1
1 296 . 12 1 1 A 26 26 GLU N N 26 120.522 119.113 1.409 1
1 297 . 12 1 1 A 27 27 LEU H H 27 8.165 8.070 0.095 1
1 298 . 12 1 1 A 27 27 LEU HA H 27 4.163 4.093 0.070 1
1 308 . 12 1 1 A 27 27 LEU C C 27 177.256 178.394 -1.138 1
1 309 . 12 1 1 A 27 27 LEU CA C 27 58.049 57.678 0.371 1
1 310 . 12 1 1 A 27 27 LEU CB C 27 41.365 41.930 -0.565 1
1 314 . 12 1 1 A 27 27 LEU N N 27 120.879 121.082 -0.203 1
1 315 . 12 1 1 A 28 28 LYS H H 28 8.902 8.376 0.526 1
1 316 . 12 1 1 A 28 28 LYS HA H 28 4.199 4.271 -0.072 1
1 317 . 12 1 1 A 28 28 LYS C C 28 179.707 179.336 0.371 1
1 318 . 12 1 1 A 28 28 LYS CA C 28 60.097 59.299 0.798 1
1 319 . 12 1 1 A 28 28 LYS CB C 28 33.420 31.953 1.467 1
1 320 . 12 1 1 A 28 28 LYS N N 28 120.050 119.703 0.347 1
1 321 . 12 1 1 A 29 29 THR H H 29 8.294 7.968 0.326 1
1 322 . 12 1 1 A 29 29 THR HA H 29 3.892 3.962 -0.070 1
1 327 . 12 1 1 A 29 29 THR C C 29 175.711 175.906 -0.195 1
1 328 . 12 1 1 A 29 29 THR CA C 29 66.846 67.055 -0.209 1
1 329 . 12 1 1 A 29 29 THR CB C 29 68.794 68.855 -0.061 1
1 331 . 12 1 1 A 29 29 THR N N 29 115.933 116.495 -0.562 1
1 332 . 12 1 1 A 30 30 ALA H H 30 8.244 8.611 -0.367 1
1 333 . 12 1 1 A 30 30 ALA HA H 30 4.241 4.345 -0.104 1
1 337 . 12 1 1 A 30 30 ALA C C 30 179.128 179.622 -0.494 1
1 338 . 12 1 1 A 30 30 ALA CA C 30 55.714 55.779 -0.065 1
1 339 . 12 1 1 A 30 30 ALA CB C 30 18.955 18.240 0.715 1
1 340 . 12 1 1 A 30 30 ALA N N 30 124.617 123.141 1.476 1
1 341 . 12 1 1 A 31 31 ALA H H 31 8.968 8.711 0.257 1
1 342 . 12 1 1 A 31 31 ALA HA H 31 3.890 4.060 -0.170 1
1 346 . 12 1 1 A 31 31 ALA C C 31 180.352 180.253 0.099 1
1 347 . 12 1 1 A 31 31 ALA CA C 31 55.454 55.422 0.032 1
1 348 . 12 1 1 A 31 31 ALA CB C 31 17.124 18.741 -1.617 1
1 349 . 12 1 1 A 31 31 ALA N N 31 119.327 120.406 -1.079 1
1 350 . 12 1 1 A 32 32 SER H H 32 7.995 7.988 0.007 1
1 351 . 12 1 1 A 32 32 SER HA H 32 4.238 4.107 0.131 1
1 354 . 12 1 1 A 32 32 SER C C 32 175.612 176.640 -1.028 1
1 355 . 12 1 1 A 32 32 SER CA C 32 61.203 61.284 -0.081 1
1 356 . 12 1 1 A 32 32 SER CB C 32 63.406 63.020 0.386 1
1 357 . 12 1 1 A 32 32 SER N N 32 111.962 112.699 -0.737 1
1 358 . 12 1 1 A 33 33 GLN H H 33 8.333 7.929 0.404 1
1 359 . 12 1 1 A 33 33 GLN HA H 33 3.992 4.225 -0.233 1
1 366 . 12 1 1 A 33 33 GLN C C 33 177.486 177.234 0.252 1
1 367 . 12 1 1 A 33 33 GLN CA C 33 58.277 57.822 0.455 1
1 368 . 12 1 1 A 33 33 GLN CB C 33 29.140 29.949 -0.809 1
1 370 . 12 1 1 A 33 33 GLN N N 33 119.527 120.465 -0.938 1
1 372 . 12 1 1 A 34 34 TYR H H 34 8.587 8.314 0.273 1
1 373 . 12 1 1 A 34 34 TYR HA H 34 4.792 4.629 0.163 1
1 380 . 12 1 1 A 34 34 TYR C C 34 176.499 176.638 -0.139 1
1 381 . 12 1 1 A 34 34 TYR CA C 34 57.711 58.812 -1.101 1
1 382 . 12 1 1 A 34 34 TYR CB C 34 39.561 39.434 0.127 1
1 387 . 12 1 1 A 34 34 TYR N N 34 114.610 114.716 -0.106 1
1 388 . 12 1 1 A 35 35 GLY H H 35 7.346 8.174 -0.828 1
1 389 . 12 1 1 A 35 35 GLY HA2 H 35 4.785 4.115 0.670 1
1 390 . 12 1 1 A 35 35 GLY HA3 H 35 4.007 4.118 -0.111 1
1 391 . 12 1 1 A 35 35 GLY C C 35 175.796 173.249 2.547 1
1 392 . 12 1 1 A 35 35 GLY CA C 35 44.355 44.797 -0.442 1
1 393 . 12 1 1 A 35 35 GLY N N 35 108.501 106.328 2.173 1
1 394 . 12 1 1 A 36 36 ALA H H 36 9.363 8.273 1.090 1
1 395 . 12 1 1 A 36 36 ALA HA H 36 4.217 4.658 -0.441 1
1 399 . 12 1 1 A 36 36 ALA C C 36 178.039 177.090 0.949 1
1 400 . 12 1 1 A 36 36 ALA CA C 36 56.114 51.535 4.579 1
1 401 . 12 1 1 A 36 36 ALA CB C 36 19.179 18.457 0.722 1
1 402 . 12 1 1 A 36 36 ALA N N 36 125.811 122.698 3.113 1
1 403 . 12 1 1 A 37 37 THR H H 37 8.070 8.328 -0.258 1
1 404 . 12 1 1 A 37 37 THR HA H 37 4.570 4.563 0.007 1
1 409 . 12 1 1 A 37 37 THR C C 37 173.685 174.268 -0.583 1
1 410 . 12 1 1 A 37 37 THR CA C 37 59.822 63.162 -3.340 1
1 411 . 12 1 1 A 37 37 THR CB C 37 68.267 71.672 -3.405 1
1 413 . 12 1 1 A 37 37 THR N N 37 129.410 118.220 11.190 1
1 414 . 12 1 1 A 38 38 ALA H H 38 6.853 7.744 -0.891 1
1 415 . 12 1 1 A 38 38 ALA HA H 38 4.601 4.596 0.005 1
1 419 . 12 1 1 A 38 38 ALA CA C 38 50.758 50.687 0.071 1
1 420 . 12 1 1 A 38 38 ALA CB C 38 18.325 19.429 -1.104 1
1 421 . 12 1 1 A 38 38 ALA N N 38 124.674 124.486 0.188 1
1 422 . 12 1 1 A 40 40 TYR HA H 40 4.032 3.957 0.075 1
1 429 . 12 1 1 A 40 40 TYR C C 40 176.456 177.047 -0.591 1
1 430 . 12 1 1 A 40 40 TYR CA C 40 61.010 61.811 -0.801 1
1 431 . 12 1 1 A 40 40 TYR CB C 40 39.286 38.289 0.997 1
1 436 . 12 1 1 A 41 41 THR H H 41 6.874 8.147 -1.273 1
1 437 . 12 1 1 A 41 41 THR HA H 41 3.616 3.825 -0.209 1
1 442 . 12 1 1 A 41 41 THR C C 41 176.930 177.344 -0.414 1
1 443 . 12 1 1 A 41 41 THR CA C 41 65.557 66.725 -1.168 1
1 444 . 12 1 1 A 41 41 THR CB C 41 68.228 68.378 -0.150 1
1 446 . 12 1 1 A 41 41 THR N N 41 115.143 113.801 1.342 1
1 447 . 12 1 1 A 42 42 LEU H H 42 8.623 7.447 1.176 1
1 448 . 12 1 1 A 42 42 LEU HA H 42 3.708 3.979 -0.271 1
1 458 . 12 1 1 A 42 42 LEU C C 42 178.206 178.963 -0.757 1
1 459 . 12 1 1 A 42 42 LEU CA C 42 57.417 57.805 -0.388 1
1 460 . 12 1 1 A 42 42 LEU CB C 42 41.342 41.198 0.144 1
1 464 . 12 1 1 A 42 42 LEU N N 42 120.418 118.108 2.310 1
1 465 . 12 1 1 A 43 43 ALA H H 43 7.735 8.214 -0.479 1
1 466 . 12 1 1 A 43 43 ALA HA H 43 4.020 4.007 0.013 1
1 470 . 12 1 1 A 43 43 ALA C C 43 180.826 180.126 0.700 1
1 471 . 12 1 1 A 43 43 ALA CA C 43 54.925 54.919 0.006 1
1 472 . 12 1 1 A 43 43 ALA CB C 43 17.506 18.119 -0.613 1
1 473 . 12 1 1 A 43 43 ALA N N 43 120.203 121.765 -1.562 1
1 474 . 12 1 1 A 44 44 ILE H H 44 7.149 7.314 -0.165 1
1 475 . 12 1 1 A 44 44 ILE HA H 44 3.603 3.630 -0.027 1
1 485 . 12 1 1 A 44 44 ILE C C 44 178.594 178.209 0.385 1
1 486 . 12 1 1 A 44 44 ILE CA C 44 64.782 63.909 0.873 1
1 487 . 12 1 1 A 44 44 ILE CB C 44 37.472 37.330 0.142 1
1 491 . 12 1 1 A 44 44 ILE N N 44 118.881 119.210 -0.329 1
1 492 . 12 1 1 A 45 45 VAL H H 45 7.968 7.659 0.309 1
1 493 . 12 1 1 A 45 45 VAL HA H 45 2.925 3.313 -0.388 1
1 501 . 12 1 1 A 45 45 VAL C C 45 177.023 177.700 -0.677 1
1 502 . 12 1 1 A 45 45 VAL CA C 45 67.081 66.966 0.115 1
1 503 . 12 1 1 A 45 45 VAL CB C 45 30.854 31.333 -0.479 1
1 506 . 12 1 1 A 45 45 VAL N N 45 120.764 119.954 0.810 1
1 507 . 12 1 1 A 46 46 GLU H H 46 8.399 8.262 0.137 1
1 508 . 12 1 1 A 46 46 GLU HA H 46 3.848 3.926 -0.078 1
1 513 . 12 1 1 A 46 46 GLU C C 46 178.656 178.684 -0.028 1
1 514 . 12 1 1 A 46 46 GLU CA C 46 59.491 59.069 0.422 1
1 515 . 12 1 1 A 46 46 GLU CB C 46 28.991 28.758 0.233 1
1 517 . 12 1 1 A 46 46 GLU N N 46 116.599 119.806 -3.207 1
1 518 . 12 1 1 A 47 47 SER H H 47 7.273 7.449 -0.176 1
1 519 . 12 1 1 A 47 47 SER HA H 47 4.287 4.189 0.098 1
1 521 . 12 1 1 A 47 47 SER CA C 47 61.047 61.496 -0.449 1
1 522 . 12 1 1 A 47 47 SER CB C 47 63.016 63.017 -0.001 1
1 523 . 12 1 1 A 47 47 SER N N 47 113.609 115.812 -2.203 1
1 524 . 12 1 1 A 48 48 VAL H H 48 8.006 8.158 -0.152 1
1 525 . 12 1 1 A 48 48 VAL HA H 48 3.556 3.547 0.009 1
1 533 . 12 1 1 A 48 48 VAL C C 48 177.257 177.252 0.005 1
1 534 . 12 1 1 A 48 48 VAL CA C 48 65.025 66.517 -1.492 1
1 535 . 12 1 1 A 48 48 VAL CB C 48 31.841 31.440 0.401 1
1 538 . 12 1 1 A 48 48 VAL N N 48 122.327 120.945 1.382 1
1 539 . 12 1 1 A 49 49 ALA H H 49 8.369 8.002 0.367 1
1 540 . 12 1 1 A 49 49 ALA HA H 49 4.115 4.316 -0.201 1
1 544 . 12 1 1 A 49 49 ALA C C 49 177.307 177.492 -0.185 1
1 545 . 12 1 1 A 49 49 ALA CA C 49 53.253 53.176 0.077 1
1 546 . 12 1 1 A 49 49 ALA CB C 49 20.131 18.355 1.776 1
1 547 . 12 1 1 A 49 49 ALA N N 49 118.050 120.756 -2.706 1
1 548 . 12 1 1 A 50 50 ASP H H 50 7.052 7.607 -0.555 1
1 549 . 12 1 1 A 50 50 ASP HA H 50 4.788 4.727 0.061 1
1 552 . 12 1 1 A 50 50 ASP C C 50 175.481 176.259 -0.778 1
1 553 . 12 1 1 A 50 50 ASP CA C 50 53.681 54.261 -0.580 1
1 554 . 12 1 1 A 50 50 ASP CB C 50 39.333 41.120 -1.787 1
1 555 . 12 1 1 A 50 50 ASP N N 50 116.997 117.162 -0.165 1
1 556 . 12 1 1 A 51 51 ASN H H 51 8.535 7.715 0.820 1
1 557 . 12 1 1 A 51 51 ASN HA H 51 4.628 4.852 -0.224 1
1 562 . 12 1 1 A 51 51 ASN C C 51 174.077 175.250 -1.173 1
1 563 . 12 1 1 A 51 51 ASN CA C 51 52.315 51.864 0.451 1
1 564 . 12 1 1 A 51 51 ASN CB C 51 41.928 40.217 1.711 1
1 565 . 12 1 1 A 51 51 ASN N N 51 118.626 117.942 0.684 1
1 567 . 12 1 1 A 52 52 TRP H H 52 8.555 8.089 0.466 1
1 574 . 12 1 1 A 52 52 TRP C C 52 173.269 176.038 -2.769 1
1 575 . 12 1 1 A 52 52 TRP CA C 52 55.031 56.633 -1.602 1
1 576 . 12 1 1 A 52 52 TRP CB C 52 26.801 29.084 -2.283 1
1 582 . 12 1 1 A 52 52 TRP N N 52 120.693 120.604 0.089 1
1 584 . 12 1 1 A 53 53 LEU H H 53 7.847 7.498 0.349 1
1 585 . 12 1 1 A 53 53 LEU HA H 53 4.859 4.304 0.555 1
1 595 . 12 1 1 A 53 53 LEU C C 53 177.397 176.684 0.713 1
1 596 . 12 1 1 A 53 53 LEU CA C 53 53.619 55.257 -1.638 1
1 597 . 12 1 1 A 53 53 LEU CB C 53 41.812 42.562 -0.750 1
1 601 . 12 1 1 A 53 53 LEU N N 53 124.741 119.384 5.357 1
1 602 . 12 1 1 A 54 54 THR H H 54 8.850 8.999 -0.149 1
1 603 . 12 1 1 A 54 54 THR HA H 54 4.598 4.933 -0.335 1
1 608 . 12 1 1 A 54 54 THR CA C 54 60.531 60.207 0.324 1
1 609 . 12 1 1 A 54 54 THR CB C 54 67.183 68.936 -1.753 1
1 611 . 12 1 1 A 54 54 THR N N 54 113.407 112.547 0.860 1
1 612 . 12 1 1 A 55 55 PRO HA H 55 4.511 4.112 0.399 1
1 619 . 12 1 1 A 55 55 PRO C C 55 179.383 178.502 0.881 1
1 620 . 12 1 1 A 55 55 PRO CA C 55 67.159 64.436 2.723 1
1 621 . 12 1 1 A 55 55 PRO CB C 55 32.095 31.695 0.400 1
1 622 . 12 1 1 A 56 56 THR H H 56 8.575 7.692 0.883 1
1 623 . 12 1 1 A 56 56 THR HA H 56 4.229 4.074 0.155 1
1 628 . 12 1 1 A 56 56 THR C C 56 176.668 175.931 0.737 1
1 629 . 12 1 1 A 56 56 THR CA C 56 66.943 65.991 0.952 1
1 630 . 12 1 1 A 56 56 THR CB C 56 68.129 68.154 -0.025 1
1 632 . 12 1 1 A 56 56 THR N N 56 114.855 111.952 2.903 1
1 633 . 12 1 1 A 57 57 ASP H H 57 8.730 8.481 0.249 1
1 634 . 12 1 1 A 57 57 ASP HA H 57 4.425 4.704 -0.279 1
1 637 . 12 1 1 A 57 57 ASP C C 57 178.351 179.280 -0.929 1
1 638 . 12 1 1 A 57 57 ASP CA C 57 57.963 57.719 0.244 1
1 639 . 12 1 1 A 57 57 ASP CB C 57 40.134 40.799 -0.665 1
1 640 . 12 1 1 A 57 57 ASP N N 57 126.239 120.526 5.713 1
1 641 . 12 1 1 A 58 58 TRP H H 58 8.244 8.444 -0.200 1
1 642 . 12 1 1 A 58 58 TRP HA H 58 4.030 4.467 -0.437 1
1 650 . 12 1 1 A 58 58 TRP C C 58 177.432 178.739 -1.307 1
1 651 . 12 1 1 A 58 58 TRP CA C 58 62.731 59.934 2.797 1
1 652 . 12 1 1 A 58 58 TRP CB C 58 29.122 29.307 -0.185 1
1 657 . 12 1 1 A 58 58 TRP N N 58 119.241 120.608 -1.367 1
1 659 . 12 1 1 A 59 59 ASN H H 59 8.098 8.650 -0.552 1
1 660 . 12 1 1 A 59 59 ASN HA H 59 4.424 4.507 -0.083 1
1 663 . 12 1 1 A 59 59 ASN C C 59 176.952 178.191 -1.239 1
1 664 . 12 1 1 A 59 59 ASN CA C 59 58.135 56.529 1.606 1
1 665 . 12 1 1 A 59 59 ASN CB C 59 40.168 39.379 0.789 1
1 666 . 12 1 1 A 59 59 ASN N N 59 115.747 117.599 -1.852 1
1 667 . 12 1 1 A 60 60 THR H H 60 8.712 7.894 0.818 1
1 668 . 12 1 1 A 60 60 THR HA H 60 3.717 3.788 -0.071 1
1 673 . 12 1 1 A 60 60 THR C C 60 176.044 176.654 -0.610 1
1 674 . 12 1 1 A 60 60 THR CA C 60 66.576 67.258 -0.682 1
1 675 . 12 1 1 A 60 60 THR CB C 60 69.251 67.540 1.711 1
1 677 . 12 1 1 A 60 60 THR N N 60 114.896 115.564 -0.668 1
1 678 . 12 1 1 A 61 61 LEU H H 61 8.485 8.268 0.217 1
1 679 . 12 1 1 A 61 61 LEU HA H 61 3.391 4.057 -0.666 1
1 689 . 12 1 1 A 61 61 LEU C C 61 177.433 178.660 -1.227 1
1 690 . 12 1 1 A 61 61 LEU CA C 61 58.354 58.565 -0.211 1
1 691 . 12 1 1 A 61 61 LEU CB C 61 41.761 42.300 -0.539 1
1 695 . 12 1 1 A 61 61 LEU N N 61 123.433 121.913 1.520 1
1 696 . 12 1 1 A 62 62 VAL H H 62 8.073 8.191 -0.118 1
1 697 . 12 1 1 A 62 62 VAL HA H 62 3.207 3.835 -0.628 1
1 705 . 12 1 1 A 62 62 VAL C C 62 177.585 177.662 -0.077 1
1 706 . 12 1 1 A 62 62 VAL CA C 62 67.345 65.434 1.911 1
1 707 . 12 1 1 A 62 62 VAL CB C 62 30.905 30.849 0.056 1
1 710 . 12 1 1 A 62 62 VAL N N 62 116.018 118.595 -2.577 1
1 711 . 12 1 1 A 63 63 ARG H H 63 7.765 8.104 -0.339 1
1 712 . 12 1 1 A 63 63 ARG HA H 63 3.602 4.020 -0.418 1
1 719 . 12 1 1 A 63 63 ARG C C 63 177.818 178.240 -0.422 1
1 720 . 12 1 1 A 63 63 ARG CA C 63 58.049 58.055 -0.006 1
1 721 . 12 1 1 A 63 63 ARG CB C 63 29.955 29.169 0.786 1
1 724 . 12 1 1 A 63 63 ARG N N 63 116.700 120.614 -3.914 1
1 725 . 12 1 1 A 64 64 ALA H H 64 7.574 7.452 0.122 1
1 726 . 12 1 1 A 64 64 ALA HA H 64 4.158 4.338 -0.180 1
1 730 . 12 1 1 A 64 64 ALA C C 64 179.886 179.264 0.622 1
1 731 . 12 1 1 A 64 64 ALA CA C 64 54.007 54.095 -0.088 1
1 732 . 12 1 1 A 64 64 ALA CB C 64 19.147 19.733 -0.586 1
1 733 . 12 1 1 A 64 64 ALA N N 64 117.555 122.046 -4.491 1
1 734 . 12 1 1 A 65 65 VAL H H 65 7.554 7.980 -0.426 1
1 735 . 12 1 1 A 65 65 VAL HA H 65 4.253 3.881 0.372 1
1 743 . 12 1 1 A 65 65 VAL C C 65 174.180 176.366 -2.186 1
1 744 . 12 1 1 A 65 65 VAL CA C 65 62.683 65.421 -2.738 1
1 745 . 12 1 1 A 65 65 VAL CB C 65 33.458 31.395 2.063 1
1 748 . 12 1 1 A 65 65 VAL N N 65 110.013 115.434 -5.421 1
1 749 . 12 1 1 A 66 66 LEU H H 66 7.792 7.086 0.706 1
1 750 . 12 1 1 A 66 66 LEU HA H 66 4.790 4.756 0.034 1
1 760 . 12 1 1 A 66 66 LEU C C 66 177.537 175.667 1.870 1
1 761 . 12 1 1 A 66 66 LEU CA C 66 52.823 52.713 0.110 1
1 762 . 12 1 1 A 66 66 LEU CB C 66 44.071 45.278 -1.207 1
1 766 . 12 1 1 A 66 66 LEU N N 66 118.967 121.449 -2.482 1
1 767 . 12 1 1 A 67 67 SER H H 67 9.208 8.422 0.786 1
1 768 . 12 1 1 A 67 67 SER HA H 67 4.414 4.698 -0.284 1
1 771 . 12 1 1 A 67 67 SER CA C 67 57.943 57.269 0.674 1
1 772 . 12 1 1 A 67 67 SER CB C 67 64.743 65.251 -0.508 1
1 773 . 12 1 1 A 67 67 SER N N 67 116.378 116.352 0.026 1
1 774 . 12 1 1 A 69 69 GLY HA2 H 69 3.916 3.757 0.159 1
1 775 . 12 1 1 A 69 69 GLY HA3 H 69 3.867 3.800 0.067 1
1 776 . 12 1 1 A 69 69 GLY C C 69 176.783 175.338 1.445 1
1 777 . 12 1 1 A 69 69 GLY CA C 69 46.977 47.056 -0.079 1
1 778 . 12 1 1 A 70 70 ASP H H 70 7.674 8.126 -0.452 1
1 779 . 12 1 1 A 70 70 ASP HA H 70 4.511 3.652 0.859 1
1 782 . 12 1 1 A 70 70 ASP C C 70 178.096 178.429 -0.333 1
1 783 . 12 1 1 A 70 70 ASP CA C 70 57.262 56.257 1.005 1
1 784 . 12 1 1 A 70 70 ASP CB C 70 40.594 39.684 0.910 1
1 785 . 12 1 1 A 70 70 ASP N N 70 123.930 122.180 1.750 1
1 786 . 12 1 1 A 71 71 HIS H H 71 8.729 7.880 0.849 1
1 787 . 12 1 1 A 71 71 HIS HA H 71 4.235 4.140 0.095 1
1 790 . 12 1 1 A 71 71 HIS C C 71 176.769 176.666 0.103 1
1 791 . 12 1 1 A 71 71 HIS CA C 71 60.041 59.895 0.146 1
1 792 . 12 1 1 A 71 71 HIS CB C 71 30.682 29.968 0.714 1
1 793 . 12 1 1 A 71 71 HIS N N 71 121.003 119.653 1.350 1
1 794 . 12 1 1 A 72 72 LEU H H 72 7.620 7.436 0.184 1
1 795 . 12 1 1 A 72 72 LEU HA H 72 3.769 3.846 -0.077 1
1 805 . 12 1 1 A 72 72 LEU C C 72 180.275 179.185 1.090 1
1 806 . 12 1 1 A 72 72 LEU CA C 72 58.192 57.992 0.200 1
1 807 . 12 1 1 A 72 72 LEU CB C 72 41.381 41.196 0.185 1
1 811 . 12 1 1 A 72 72 LEU N N 72 118.569 118.186 0.383 1
1 812 . 12 1 1 A 73 73 LEU H H 73 7.542 7.585 -0.043 1
1 813 . 12 1 1 A 73 73 LEU HA H 73 4.107 4.260 -0.153 1
1 823 . 12 1 1 A 73 73 LEU C C 73 179.436 179.159 0.277 1
1 824 . 12 1 1 A 73 73 LEU CA C 73 58.026 57.282 0.744 1
1 825 . 12 1 1 A 73 73 LEU CB C 73 41.638 42.132 -0.494 1
1 829 . 12 1 1 A 73 73 LEU N N 73 121.418 120.498 0.920 1
1 830 . 12 1 1 A 74 74 TRP H H 74 8.786 7.935 0.851 1
1 831 . 12 1 1 A 74 74 TRP HA H 74 3.589 5.365 -1.776 1
1 840 . 12 1 1 A 74 74 TRP C C 74 176.816 178.781 -1.965 1
1 841 . 12 1 1 A 74 74 TRP CA C 74 63.046 59.728 3.318 1
1 842 . 12 1 1 A 74 74 TRP CB C 74 28.065 28.933 -0.868 1
1 848 . 12 1 1 A 74 74 TRP N N 74 121.111 118.484 2.627 1
1 850 . 12 1 1 A 75 75 LYS H H 75 8.939 7.679 1.260 1
1 851 . 12 1 1 A 75 75 LYS HA H 75 3.055 4.117 -1.062 1
1 860 . 12 1 1 A 75 75 LYS C C 75 177.967 179.289 -1.322 1
1 861 . 12 1 1 A 75 75 LYS CA C 75 60.029 58.567 1.462 1
1 862 . 12 1 1 A 75 75 LYS CB C 75 32.533 32.810 -0.277 1
1 866 . 12 1 1 A 75 75 LYS N N 75 119.783 118.543 1.240 1
1 867 . 12 1 1 A 76 76 SER H H 76 7.832 8.039 -0.207 1
1 868 . 12 1 1 A 76 76 SER HA H 76 4.040 4.326 -0.286 1
1 871 . 12 1 1 A 76 76 SER C C 76 177.816 177.320 0.496 1
1 872 . 12 1 1 A 76 76 SER CA C 76 62.105 62.133 -0.028 1
1 873 . 12 1 1 A 76 76 SER CB C 76 62.679 62.947 -0.268 1
1 874 . 12 1 1 A 76 76 SER N N 76 113.395 117.053 -3.658 1
1 875 . 12 1 1 A 77 77 GLU H H 77 7.590 7.548 0.042 1
1 876 . 12 1 1 A 77 77 GLU HA H 77 4.042 4.198 -0.156 1
1 881 . 12 1 1 A 77 77 GLU C C 77 177.809 178.531 -0.722 1
1 882 . 12 1 1 A 77 77 GLU CA C 77 58.270 58.797 -0.527 1
1 883 . 12 1 1 A 77 77 GLU CB C 77 29.208 29.526 -0.318 1
1 885 . 12 1 1 A 77 77 GLU N N 77 121.574 122.719 -1.145 1
1 886 . 12 1 1 A 78 78 PHE H H 78 9.081 7.791 1.290 1
1 887 . 12 1 1 A 78 78 PHE HA H 78 3.778 4.248 -0.470 1
1 895 . 12 1 1 A 78 78 PHE C C 78 178.114 177.412 0.702 1
1 896 . 12 1 1 A 78 78 PHE CA C 78 60.629 61.191 -0.562 1
1 897 . 12 1 1 A 78 78 PHE CB C 78 38.295 38.794 -0.499 1
1 902 . 12 1 1 A 78 78 PHE N N 78 122.682 121.671 1.011 1
1 903 . 12 1 1 A 79 79 PHE H H 79 8.890 7.812 1.078 1
1 904 . 12 1 1 A 79 79 PHE HA H 79 3.800 4.160 -0.360 1
1 912 . 12 1 1 A 79 79 PHE C C 79 178.354 178.177 0.177 1
1 913 . 12 1 1 A 79 79 PHE CA C 79 60.704 62.361 -1.657 1
1 914 . 12 1 1 A 79 79 PHE CB C 79 37.184 38.419 -1.235 1
1 920 . 12 1 1 A 79 79 PHE N N 79 121.056 117.751 3.305 1
1 921 . 12 1 1 A 80 80 GLU H H 80 7.793 8.171 -0.378 1
1 922 . 12 1 1 A 80 80 GLU HA H 80 4.082 4.027 0.055 1
1 927 . 12 1 1 A 80 80 GLU C C 80 179.068 179.078 -0.010 1
1 928 . 12 1 1 A 80 80 GLU CA C 80 59.735 59.516 0.219 1
1 929 . 12 1 1 A 80 80 GLU CB C 80 28.722 29.200 -0.478 1
1 931 . 12 1 1 A 80 80 GLU N N 80 120.312 119.014 1.298 1
1 932 . 12 1 1 A 81 81 ASN H H 81 8.624 8.855 -0.231 1
1 933 . 12 1 1 A 81 81 ASN HA H 81 4.521 4.417 0.104 1
1 938 . 12 1 1 A 81 81 ASN C C 81 179.262 177.739 1.523 1
1 939 . 12 1 1 A 81 81 ASN CA C 81 55.504 55.811 -0.307 1
1 940 . 12 1 1 A 81 81 ASN CB C 81 37.517 37.370 0.147 1
1 941 . 12 1 1 A 81 81 ASN N N 81 119.338 117.162 2.176 1
1 943 . 12 1 1 A 82 82 CYS H H 82 8.554 8.427 0.127 1
1 944 . 12 1 1 A 82 82 CYS HA H 82 3.792 3.924 -0.132 1
1 947 . 12 1 1 A 82 82 CYS C C 82 176.478 176.625 -0.147 1
1 948 . 12 1 1 A 82 82 CYS CA C 82 65.232 61.888 3.344 1
1 949 . 12 1 1 A 82 82 CYS CB C 82 26.762 26.870 -0.108 1
1 950 . 12 1 1 A 82 82 CYS N N 82 120.576 117.711 2.865 1
1 951 . 12 1 1 A 83 83 ARG H H 83 8.522 7.867 0.655 1
1 952 . 12 1 1 A 83 83 ARG HA H 83 3.932 4.178 -0.246 1
1 960 . 12 1 1 A 83 83 ARG C C 83 179.138 178.648 0.490 1
1 961 . 12 1 1 A 83 83 ARG CA C 83 60.443 59.003 1.440 1
1 962 . 12 1 1 A 83 83 ARG CB C 83 29.550 29.779 -0.229 1
1 965 . 12 1 1 A 83 83 ARG N N 83 123.035 120.581 2.454 1
1 967 . 12 1 1 A 84 84 ASP H H 84 7.791 8.143 -0.352 1
1 968 . 12 1 1 A 84 84 ASP HA H 84 4.353 4.415 -0.062 1
1 971 . 12 1 1 A 84 84 ASP C C 84 178.649 178.338 0.311 1
1 972 . 12 1 1 A 84 84 ASP CA C 84 57.767 57.593 0.174 1
1 973 . 12 1 1 A 84 84 ASP CB C 84 41.305 41.451 -0.146 1
1 974 . 12 1 1 A 84 84 ASP N N 84 120.332 119.646 0.686 1
1 975 . 12 1 1 A 85 85 THR H H 85 8.370 7.674 0.696 1
1 976 . 12 1 1 A 85 85 THR HA H 85 3.730 3.968 -0.238 1
1 981 . 12 1 1 A 85 85 THR C C 85 175.198 176.758 -1.560 1
1 982 . 12 1 1 A 85 85 THR CA C 85 66.830 65.119 1.711 1
1 983 . 12 1 1 A 85 85 THR CB C 85 68.533 68.807 -0.274 1
1 985 . 12 1 1 A 85 85 THR N N 85 117.360 113.376 3.984 1
1 986 . 12 1 1 A 86 86 ALA H H 86 8.845 8.213 0.632 1
1 987 . 12 1 1 A 86 86 ALA HA H 86 3.991 4.073 -0.082 1
1 991 . 12 1 1 A 86 86 ALA C C 86 179.980 180.145 -0.165 1
1 992 . 12 1 1 A 86 86 ALA CA C 86 55.769 55.662 0.107 1
1 993 . 12 1 1 A 86 86 ALA CB C 86 17.881 18.724 -0.843 1
1 994 . 12 1 1 A 86 86 ALA N N 86 123.613 123.422 0.191 1
1 995 . 12 1 1 A 87 87 LYS H H 87 7.686 8.380 -0.694 1
1 996 . 12 1 1 A 87 87 LYS HA H 87 4.099 4.005 0.094 1
1 1005 . 12 1 1 A 87 87 LYS C C 87 179.592 179.509 0.083 1
1 1006 . 12 1 1 A 87 87 LYS CA C 87 59.708 59.871 -0.163 1
1 1007 . 12 1 1 A 87 87 LYS CB C 87 32.054 32.367 -0.313 1
1 1011 . 12 1 1 A 87 87 LYS N N 87 119.623 117.295 2.328 1
1 1012 . 12 1 1 A 88 88 ARG H H 88 7.683 7.571 0.112 1
1 1013 . 12 1 1 A 88 88 ARG HA H 88 4.051 4.146 -0.095 1
1 1020 . 12 1 1 A 88 88 ARG C C 88 180.053 178.660 1.393 1
1 1021 . 12 1 1 A 88 88 ARG CA C 88 59.558 58.875 0.683 1
1 1022 . 12 1 1 A 88 88 ARG CB C 88 29.684 29.682 0.002 1
1 1025 . 12 1 1 A 88 88 ARG N N 88 120.788 118.782 2.006 1
1 1026 . 12 1 1 A 89 89 ASN H H 89 8.973 8.057 0.916 1
1 1027 . 12 1 1 A 89 89 ASN HA H 89 4.354 4.637 -0.283 1
1 1032 . 12 1 1 A 89 89 ASN C C 89 178.382 178.472 -0.090 1
1 1033 . 12 1 1 A 89 89 ASN CA C 89 55.334 55.750 -0.416 1
1 1034 . 12 1 1 A 89 89 ASN CB C 89 37.864 38.407 -0.543 1
1 1035 . 12 1 1 A 89 89 ASN N N 89 121.012 117.178 3.834 1
1 1037 . 12 1 1 A 90 90 GLN H H 90 8.152 8.406 -0.254 1
1 1038 . 12 1 1 A 90 90 GLN HA H 90 4.020 4.141 -0.121 1
1 1045 . 12 1 1 A 90 90 GLN C C 90 179.075 179.030 0.045 1
1 1046 . 12 1 1 A 90 90 GLN CA C 90 59.318 58.976 0.342 1
1 1047 . 12 1 1 A 90 90 GLN CB C 90 28.049 28.268 -0.219 1
1 1049 . 12 1 1 A 90 90 GLN N N 90 122.122 121.056 1.066 1
1 1051 . 12 1 1 A 91 91 GLN H H 91 7.514 8.231 -0.717 1
1 1052 . 12 1 1 A 91 91 GLN HA H 91 4.053 4.066 -0.013 1
1 1059 . 12 1 1 A 91 91 GLN C C 91 177.081 177.549 -0.468 1
1 1060 . 12 1 1 A 91 91 GLN CA C 91 58.031 58.301 -0.270 1
1 1061 . 12 1 1 A 91 91 GLN CB C 91 28.365 27.750 0.615 1
1 1063 . 12 1 1 A 91 91 GLN N N 91 118.124 118.049 0.075 1
1 1065 . 12 1 1 A 92 92 ALA H H 92 7.704 7.341 0.363 1
1 1066 . 12 1 1 A 92 92 ALA HA H 92 4.246 4.365 -0.119 1
1 1070 . 12 1 1 A 92 92 ALA C C 92 178.450 177.826 0.624 1
1 1071 . 12 1 1 A 92 92 ALA CA C 92 52.671 52.161 0.510 1
1 1072 . 12 1 1 A 92 92 ALA CB C 92 19.316 19.813 -0.497 1
1 1073 . 12 1 1 A 92 92 ALA N N 92 119.880 120.861 -0.981 1
1 1074 . 12 1 1 A 93 93 GLY H H 93 7.693 7.872 -0.179 1
1 1075 . 12 1 1 A 93 93 GLY HA2 H 93 3.941 3.916 0.025 1
1 1076 . 12 1 1 A 93 93 GLY HA3 H 93 3.744 3.919 -0.175 1
1 1077 . 12 1 1 A 93 93 GLY C C 93 174.344 175.142 -0.798 1
1 1078 . 12 1 1 A 93 93 GLY CA C 93 45.949 46.524 -0.575 1
1 1079 . 12 1 1 A 93 93 GLY N N 93 105.347 107.024 -1.677 1
1 1080 . 12 1 1 A 94 94 ASN H H 94 7.076 8.904 -1.828 1
1 1081 . 12 1 1 A 94 94 ASN HA H 94 4.115 4.739 -0.624 1
1 1085 . 12 1 1 A 94 94 ASN C C 94 175.410 175.602 -0.192 1
1 1086 . 12 1 1 A 94 94 ASN CA C 94 52.651 53.391 -0.740 1
1 1087 . 12 1 1 A 94 94 ASN CB C 94 38.330 39.188 -0.858 1
1 1088 . 12 1 1 A 94 94 ASN N N 94 115.747 116.794 -1.047 1
1 1090 . 12 1 1 A 95 95 GLY H H 95 8.236 8.670 -0.434 1
1 1091 . 12 1 1 A 95 95 GLY HA2 H 95 3.633 3.564 0.069 1
1 1092 . 12 1 1 A 95 95 GLY HA3 H 95 3.633 3.769 -0.136 1
1 1093 . 12 1 1 A 95 95 GLY C C 95 174.450 173.212 1.238 1
1 1094 . 12 1 1 A 95 95 GLY CA C 95 45.522 45.556 -0.034 1
1 1095 . 12 1 1 A 95 95 GLY N N 95 109.166 106.586 2.580 1
1 1096 . 12 1 1 A 96 96 TRP H H 96 7.899 8.040 -0.141 1
1 1097 . 12 1 1 A 96 96 TRP HA H 96 5.241 5.163 0.078 1
1 1106 . 12 1 1 A 96 96 TRP C C 96 175.661 175.950 -0.289 1
1 1107 . 12 1 1 A 96 96 TRP CA C 96 55.090 55.828 -0.738 1
1 1108 . 12 1 1 A 96 96 TRP CB C 96 27.138 33.222 -6.084 1
1 1114 . 12 1 1 A 96 96 TRP N N 96 122.840 120.316 2.524 1
1 1116 . 12 1 1 A 97 97 ASP H H 97 7.344 9.153 -1.809 1
1 1117 . 12 1 1 A 97 97 ASP HA H 97 4.829 4.431 0.398 1
1 1120 . 12 1 1 A 97 97 ASP C C 97 175.019 176.684 -1.665 1
1 1121 . 12 1 1 A 97 97 ASP CA C 97 52.149 56.760 -4.611 1
1 1122 . 12 1 1 A 97 97 ASP CB C 97 42.697 39.342 3.355 1
1 1123 . 12 1 1 A 97 97 ASP N N 97 126.861 117.379 9.482 1
1 1124 . 12 1 1 A 98 98 PHE H H 98 8.566 8.295 0.271 1
1 1125 . 12 1 1 A 98 98 PHE HA H 98 3.727 4.031 -0.304 1
1 1133 . 12 1 1 A 98 98 PHE C C 98 177.443 177.350 0.093 1
1 1134 . 12 1 1 A 98 98 PHE CA C 98 62.471 62.173 0.298 1
1 1135 . 12 1 1 A 98 98 PHE CB C 98 39.919 39.244 0.675 1
1 1141 . 12 1 1 A 98 98 PHE N N 98 117.781 120.255 -2.474 1
1 1142 . 12 1 1 A 99 99 ASP H H 99 8.259 8.334 -0.075 1
1 1143 . 12 1 1 A 99 99 ASP HA H 99 3.960 4.576 -0.616 1
1 1146 . 12 1 1 A 99 99 ASP C C 99 178.132 178.260 -0.128 1
1 1147 . 12 1 1 A 99 99 ASP CA C 99 57.658 56.579 1.079 1
1 1148 . 12 1 1 A 99 99 ASP CB C 99 38.572 41.355 -2.783 1
1 1149 . 12 1 1 A 99 99 ASP N N 99 121.709 119.340 2.369 1
1 1150 . 12 1 1 A 100 100 MET H H 100 8.008 8.194 -0.186 1
1 1151 . 12 1 1 A 100 100 MET HA H 100 3.644 3.988 -0.344 1
1 1156 . 12 1 1 A 100 100 MET C C 100 180.008 177.548 2.460 1
1 1157 . 12 1 1 A 100 100 MET CA C 100 58.598 58.864 -0.266 1
1 1158 . 12 1 1 A 100 100 MET CB C 100 33.423 32.980 0.443 1
1 1160 . 12 1 1 A 100 100 MET N N 100 119.668 118.155 1.513 1
1 1161 . 12 1 1 A 101 101 LEU H H 101 7.961 8.151 -0.190 1
1 1162 . 12 1 1 A 101 101 LEU HA H 101 3.523 4.452 -0.929 1
1 1172 . 12 1 1 A 101 101 LEU C C 101 173.873 176.370 -2.497 1
1 1173 . 12 1 1 A 101 101 LEU CA C 101 58.743 54.215 4.528 1
1 1174 . 12 1 1 A 101 101 LEU CB C 101 42.632 41.199 1.433 1
1 1178 . 12 1 1 A 101 101 LEU N N 101 119.752 118.764 0.988 1
1 1179 . 12 1 1 A 102 102 THR H H 102 6.955 8.314 -1.359 1
1 1180 . 12 1 1 A 102 102 THR HA H 102 4.134 4.662 -0.528 1
1 1185 . 12 1 1 A 102 102 THR C C 102 176.513 175.635 0.878 1
1 1186 . 12 1 1 A 102 102 THR CA C 102 61.125 63.013 -1.888 1
1 1187 . 12 1 1 A 102 102 THR CB C 102 71.415 71.635 -0.220 1
1 1189 . 12 1 1 A 102 102 THR N N 102 124.665 119.838 4.827 1
1 1190 . 12 1 1 A 103 103 GLY H H 103 7.816 8.260 -0.444 1
1 1191 . 12 1 1 A 103 103 GLY HA2 H 103 3.824 4.047 -0.223 1
1 1192 . 12 1 1 A 103 103 GLY HA3 H 103 3.824 4.124 -0.300 1
1 1193 . 12 1 1 A 103 103 GLY C C 103 174.126 173.519 0.607 1
1 1194 . 12 1 1 A 103 103 GLY CA C 103 47.805 45.307 2.498 1
1 1195 . 12 1 1 A 103 103 GLY N N 103 114.191 110.286 3.905 1
1 1196 . 12 1 1 A 104 104 SER H H 104 8.860 7.901 0.959 1
1 1197 . 12 1 1 A 104 104 SER HA H 104 4.758 4.953 -0.195 1
1 1200 . 12 1 1 A 104 104 SER C C 104 174.591 173.799 0.792 1
1 1201 . 12 1 1 A 104 104 SER CA C 104 56.755 57.635 -0.880 1
1 1202 . 12 1 1 A 104 104 SER CB C 104 65.050 67.314 -2.264 1
1 1203 . 12 1 1 A 104 104 SER N N 104 114.771 115.394 -0.623 1
1 1204 . 12 1 1 A 105 105 GLY H H 105 8.788 8.308 0.480 1
1 1205 . 12 1 1 A 105 105 GLY HA2 H 105 3.733 3.884 -0.151 1
1 1206 . 12 1 1 A 105 105 GLY HA3 H 105 3.733 3.997 -0.264 1
1 1207 . 12 1 1 A 105 105 GLY CA C 105 47.247 45.561 1.686 1
1 1208 . 12 1 1 A 105 105 GLY N N 105 110.394 110.078 0.316 1
1 1209 . 12 1 1 A 106 106 ASN HA H 106 4.454 5.159 -0.705 1
1 1212 . 12 1 1 A 106 106 ASN C C 106 175.180 175.967 -0.787 1
1 1213 . 12 1 1 A 106 106 ASN CA C 106 54.492 54.871 -0.379 1
1 1214 . 12 1 1 A 106 106 ASN CB C 106 37.282 41.039 -3.757 1
1 1215 . 12 1 1 A 107 107 TYR H H 107 8.241 8.599 -0.358 1
1 1216 . 12 1 1 A 107 107 TYR HA H 107 4.335 4.689 -0.354 1
1 1223 . 12 1 1 A 107 107 TYR C C 107 173.954 176.833 -2.879 1
1 1224 . 12 1 1 A 107 107 TYR CA C 107 57.727 57.866 -0.139 1
1 1225 . 12 1 1 A 107 107 TYR CB C 107 37.063 40.267 -3.204 1
1 1230 . 12 1 1 A 107 107 TYR N N 107 120.708 114.888 5.820 1
1 1231 . 12 1 1 A 108 108 SER H H 108 7.117 7.506 -0.389 1
1 1232 . 12 1 1 A 108 108 SER HA H 108 4.221 3.773 0.448 1
1 1235 . 12 1 1 A 108 108 SER C C 108 174.834 173.480 1.354 1
1 1236 . 12 1 1 A 108 108 SER CA C 108 59.859 59.818 0.041 1
1 1237 . 12 1 1 A 108 108 SER CB C 108 63.846 63.001 0.845 1
1 1238 . 12 1 1 A 108 108 SER N N 108 113.362 116.142 -2.780 1
1 1239 . 12 1 1 A 109 109 SER H H 109 8.053 8.093 -0.040 1
1 1240 . 12 1 1 A 109 109 SER HA H 109 4.560 4.228 0.332 1
1 1243 . 12 1 1 A 109 109 SER CA C 109 57.141 60.772 -3.631 1
1 1244 . 12 1 1 A 109 109 SER CB C 109 64.874 61.967 2.907 1
1 1245 . 12 1 1 A 109 109 SER N N 109 116.657 115.563 1.094 1
1 1246 . 12 1 1 A 110 110 THR HA H 110 3.541 4.116 -0.575 1
1 1251 . 12 1 1 A 110 110 THR C C 110 175.477 175.999 -0.522 1
1 1252 . 12 1 1 A 110 110 THR CA C 110 66.443 64.402 2.041 1
1 1253 . 12 1 1 A 110 110 THR CB C 110 68.091 69.060 -0.969 1
1 1255 . 12 1 1 A 111 111 ASP H H 111 8.224 8.209 0.015 1
1 1256 . 12 1 1 A 111 111 ASP HA H 111 4.237 4.417 -0.180 1
1 1259 . 12 1 1 A 111 111 ASP C C 111 177.520 178.534 -1.014 1
1 1260 . 12 1 1 A 111 111 ASP CA C 111 57.559 57.212 0.347 1
1 1261 . 12 1 1 A 111 111 ASP CB C 111 40.292 40.721 -0.429 1
1 1262 . 12 1 1 A 111 111 ASP N N 111 119.490 121.391 -1.901 1
1 1263 . 12 1 1 A 112 112 ALA H H 112 7.431 7.956 -0.525 1
1 1264 . 12 1 1 A 112 112 ALA HA H 112 4.191 4.154 0.037 1
1 1268 . 12 1 1 A 112 112 ALA C C 112 180.646 179.901 0.745 1
1 1269 . 12 1 1 A 112 112 ALA CA C 112 54.534 55.078 -0.544 1
1 1270 . 12 1 1 A 112 112 ALA CB C 112 18.992 18.201 0.791 1
1 1271 . 12 1 1 A 112 112 ALA N N 112 119.710 122.060 -2.350 1
1 1272 . 12 1 1 A 113 113 GLN H H 113 7.576 7.663 -0.087 1
1 1273 . 12 1 1 A 113 113 GLN HA H 113 3.562 4.079 -0.517 1
1 1278 . 12 1 1 A 113 113 GLN C C 113 176.756 178.146 -1.390 1
1 1279 . 12 1 1 A 113 113 GLN CA C 113 57.736 59.014 -1.278 1
1 1280 . 12 1 1 A 113 113 GLN CB C 113 29.110 28.550 0.560 1
1 1281 . 12 1 1 A 113 113 GLN N N 113 117.518 118.695 -1.177 1
1 1283 . 12 1 1 A 114 114 MET H H 114 8.192 8.155 0.037 1
1 1284 . 12 1 1 A 114 114 MET HA H 114 4.231 4.452 -0.221 1
1 1289 . 12 1 1 A 114 114 MET C C 114 175.648 177.562 -1.914 1
1 1290 . 12 1 1 A 114 114 MET CA C 114 57.446 57.698 -0.252 1
1 1291 . 12 1 1 A 114 114 MET CB C 114 33.570 32.637 0.933 1
1 1293 . 12 1 1 A 114 114 MET N N 114 111.509 119.658 -8.149 1
1 1294 . 12 1 1 A 115 115 GLN H H 115 6.940 7.477 -0.537 1
1 1295 . 12 1 1 A 115 115 GLN HA H 115 4.307 4.607 -0.300 1
1 1302 . 12 1 1 A 115 115 GLN C C 115 176.270 175.832 0.438 1
1 1303 . 12 1 1 A 115 115 GLN CA C 115 54.680 55.154 -0.474 1
1 1304 . 12 1 1 A 115 115 GLN CB C 115 28.233 29.337 -1.104 1
1 1306 . 12 1 1 A 115 115 GLN N N 115 114.300 117.347 -3.047 1
1 1308 . 12 1 1 A 116 116 TYR H H 116 6.677 7.865 -1.188 1
1 1309 . 12 1 1 A 116 116 TYR HA H 116 4.193 4.186 0.007 1
1 1312 . 12 1 1 A 116 116 TYR C C 116 175.268 175.288 -0.020 1
1 1313 . 12 1 1 A 116 116 TYR CA C 116 54.357 61.145 -6.788 1
1 1314 . 12 1 1 A 116 116 TYR CB C 116 35.498 37.249 -1.751 1
1 1315 . 12 1 1 A 116 116 TYR N N 116 117.919 120.389 -2.470 1
1 1316 . 12 1 1 A 117 117 ASP H H 117 8.081 7.543 0.538 1
1 1317 . 12 1 1 A 117 117 ASP HA H 117 4.665 4.331 0.334 1
1 1320 . 12 1 1 A 117 117 ASP CA C 117 52.422 54.682 -2.260 1
1 1321 . 12 1 1 A 117 117 ASP CB C 117 42.416 39.590 2.826 1
1 1322 . 12 1 1 A 117 117 ASP N N 117 120.887 119.577 1.310 1
1 1323 . 12 1 1 A 118 118 PRO C C 118 179.180 179.104 0.076 1
1 1324 . 12 1 1 A 118 118 PRO CA C 118 65.942 65.638 0.304 1
1 1325 . 12 1 1 A 118 118 PRO CB C 118 32.197 31.852 0.345 1
1 1326 . 12 1 1 A 119 119 GLY H H 119 9.742 8.589 1.153 1
1 1327 . 12 1 1 A 119 119 GLY C C 119 175.622 175.550 0.072 1
1 1328 . 12 1 1 A 119 119 GLY CA C 119 46.785 46.730 0.055 1
1 1329 . 12 1 1 A 119 119 GLY N N 119 106.412 106.357 0.055 1
1 1330 . 12 1 1 A 120 120 LEU H H 120 6.666 7.667 -1.001 1
1 1331 . 12 1 1 A 120 120 LEU HA H 120 3.365 3.828 -0.463 1
1 1341 . 12 1 1 A 120 120 LEU C C 120 179.262 178.621 0.641 1
1 1342 . 12 1 1 A 120 120 LEU CA C 120 56.605 56.919 -0.314 1
1 1343 . 12 1 1 A 120 120 LEU CB C 120 39.262 41.131 -1.869 1
1 1347 . 12 1 1 A 120 120 LEU N N 120 126.226 122.421 3.805 1
1 1348 . 12 1 1 A 121 121 PHE H H 121 7.356 8.836 -1.480 1
1 1349 . 12 1 1 A 121 121 PHE HA H 121 4.459 3.882 0.577 1
1 1352 . 12 1 1 A 121 121 PHE C C 121 179.716 177.174 2.542 1
1 1353 . 12 1 1 A 121 121 PHE CA C 121 62.838 62.111 0.727 1
1 1354 . 12 1 1 A 121 121 PHE CB C 121 37.603 39.228 -1.625 1
1 1355 . 12 1 1 A 121 121 PHE N N 121 117.437 119.139 -1.702 1
1 1356 . 12 1 1 A 122 122 ALA H H 122 7.926 7.867 0.059 1
1 1357 . 12 1 1 A 122 122 ALA HA H 122 4.523 3.761 0.762 1
1 1361 . 12 1 1 A 122 122 ALA C C 122 180.435 179.680 0.755 1
1 1362 . 12 1 1 A 122 122 ALA CA C 122 55.527 55.251 0.276 1
1 1363 . 12 1 1 A 122 122 ALA CB C 122 17.814 18.018 -0.204 1
1 1364 . 12 1 1 A 122 122 ALA N N 122 121.068 121.242 -0.174 1
1 1365 . 12 1 1 A 123 123 GLN H H 123 7.507 7.937 -0.430 1
1 1366 . 12 1 1 A 123 123 GLN HA H 123 4.153 3.846 0.307 1
1 1371 . 12 1 1 A 123 123 GLN C C 123 180.561 178.385 2.176 1
1 1372 . 12 1 1 A 123 123 GLN CA C 123 59.948 59.049 0.899 1
1 1373 . 12 1 1 A 123 123 GLN CB C 123 29.135 28.404 0.731 1
1 1375 . 12 1 1 A 123 123 GLN N N 123 120.324 117.388 2.936 1
1 1376 . 12 1 1 A 124 124 ILE H H 124 8.318 8.049 0.269 1
1 1377 . 12 1 1 A 124 124 ILE HA H 124 3.635 3.899 -0.264 1
1 1387 . 12 1 1 A 124 124 ILE C C 124 176.481 178.048 -1.567 1
1 1388 . 12 1 1 A 124 124 ILE CA C 124 66.432 64.305 2.127 1
1 1389 . 12 1 1 A 124 124 ILE CB C 124 39.168 37.895 1.273 1
1 1393 . 12 1 1 A 124 124 ILE N N 124 123.747 117.707 6.040 1
1 1394 . 12 1 1 A 125 125 GLN H H 125 8.474 8.248 0.226 1
1 1395 . 12 1 1 A 125 125 GLN HA H 125 4.264 3.896 0.368 1
1 1402 . 12 1 1 A 125 125 GLN C C 125 178.947 178.204 0.743 1
1 1403 . 12 1 1 A 125 125 GLN CA C 125 59.651 58.502 1.149 1
1 1404 . 12 1 1 A 125 125 GLN CB C 125 28.880 28.377 0.503 1
1 1406 . 12 1 1 A 125 125 GLN N N 125 120.368 121.092 -0.724 1
1 1408 . 12 1 1 A 126 126 ALA H H 126 8.002 7.583 0.419 1
1 1409 . 12 1 1 A 126 126 ALA HA H 126 4.144 4.036 0.108 1
1 1413 . 12 1 1 A 126 126 ALA C C 126 179.316 179.760 -0.444 1
1 1414 . 12 1 1 A 126 126 ALA CA C 126 55.036 54.885 0.151 1
1 1415 . 12 1 1 A 126 126 ALA CB C 126 18.087 18.432 -0.345 1
1 1416 . 12 1 1 A 126 126 ALA N N 126 121.661 120.880 0.781 1
1 1417 . 12 1 1 A 127 127 ALA H H 127 7.823 8.344 -0.521 1
1 1418 . 12 1 1 A 127 127 ALA HA H 127 4.162 4.290 -0.128 1
1 1422 . 12 1 1 A 127 127 ALA C C 127 180.707 179.466 1.241 1
1 1423 . 12 1 1 A 127 127 ALA CA C 127 55.080 54.904 0.176 1
1 1424 . 12 1 1 A 127 127 ALA CB C 127 19.354 18.040 1.314 1
1 1425 . 12 1 1 A 127 127 ALA N N 127 119.853 119.783 0.070 1
1 1426 . 12 1 1 A 128 128 ALA H H 128 8.936 7.955 0.981 1
1 1427 . 12 1 1 A 128 128 ALA HA H 128 3.928 3.700 0.228 1
1 1431 . 12 1 1 A 128 128 ALA C C 128 181.031 179.413 1.618 1
1 1432 . 12 1 1 A 128 128 ALA CA C 128 55.502 54.639 0.863 1
1 1433 . 12 1 1 A 128 128 ALA CB C 128 16.609 17.820 -1.211 1
1 1434 . 12 1 1 A 128 128 ALA N N 128 121.355 120.218 1.137 1
1 1435 . 12 1 1 A 129 129 THR H H 129 8.543 7.408 1.135 1
1 1436 . 12 1 1 A 129 129 THR HA H 129 4.015 3.667 0.348 1
1 1441 . 12 1 1 A 129 129 THR C C 129 177.332 176.436 0.896 1
1 1442 . 12 1 1 A 129 129 THR CA C 129 65.893 65.222 0.671 1
1 1443 . 12 1 1 A 129 129 THR CB C 129 68.566 68.510 0.056 1
1 1445 . 12 1 1 A 129 129 THR N N 129 112.709 112.231 0.478 1
1 1446 . 12 1 1 A 130 130 LYS H H 130 8.126 7.729 0.397 1
1 1447 . 12 1 1 A 130 130 LYS HA H 130 4.000 4.025 -0.025 1
1 1456 . 12 1 1 A 130 130 LYS C C 130 179.082 178.559 0.523 1
1 1457 . 12 1 1 A 130 130 LYS CA C 130 60.299 58.498 1.801 1
1 1458 . 12 1 1 A 130 130 LYS CB C 130 32.767 32.001 0.766 1
1 1462 . 12 1 1 A 130 130 LYS N N 130 123.879 120.591 3.288 1
1 1463 . 12 1 1 A 131 131 ALA H H 131 7.184 7.650 -0.466 1
1 1464 . 12 1 1 A 131 131 ALA HA H 131 4.005 4.239 -0.234 1
1 1468 . 12 1 1 A 131 131 ALA C C 131 178.482 179.600 -1.118 1
1 1469 . 12 1 1 A 131 131 ALA CA C 131 55.027 55.121 -0.094 1
1 1470 . 12 1 1 A 131 131 ALA CB C 131 18.669 19.675 -1.006 1
1 1471 . 12 1 1 A 131 131 ALA N N 131 118.590 121.204 -2.614 1
1 1472 . 12 1 1 A 132 132 TRP H H 132 7.977 8.668 -0.691 1
1 1473 . 12 1 1 A 132 132 TRP HA H 132 4.001 4.285 -0.284 1
1 1480 . 12 1 1 A 132 132 TRP C C 132 177.332 175.850 1.482 1
1 1481 . 12 1 1 A 132 132 TRP CA C 132 60.431 57.419 3.012 1
1 1482 . 12 1 1 A 132 132 TRP CB C 132 27.786 27.630 0.156 1
1 1486 . 12 1 1 A 132 132 TRP N N 132 119.168 117.068 2.100 1
1 1488 . 12 1 1 A 133 133 ARG H H 133 8.006 8.109 -0.103 1
1 1489 . 12 1 1 A 133 133 ARG HA H 133 4.027 4.330 -0.303 1
1 1497 . 12 1 1 A 133 133 ARG C C 133 176.664 178.707 -2.043 1
1 1498 . 12 1 1 A 133 133 ARG CA C 133 59.355 57.354 2.001 1
1 1499 . 12 1 1 A 133 133 ARG CB C 133 30.451 32.132 -1.681 1
1 1502 . 12 1 1 A 133 133 ARG N N 133 113.062 121.027 -7.965 1
1 1504 . 12 1 1 A 134 134 LYS H H 134 7.322 7.723 -0.401 1
1 1505 . 12 1 1 A 134 134 LYS HA H 134 4.313 4.322 -0.009 1
1 1514 . 12 1 1 A 134 134 LYS C C 134 176.282 176.876 -0.594 1
1 1515 . 12 1 1 A 134 134 LYS CA C 134 54.922 57.694 -2.772 1
1 1516 . 12 1 1 A 134 134 LYS CB C 134 32.633 31.767 0.866 1
1 1520 . 12 1 1 A 134 134 LYS N N 134 118.170 119.701 -1.531 1
1 1521 . 12 1 1 A 135 135 LEU H H 135 7.440 8.091 -0.651 1
1 1522 . 12 1 1 A 135 135 LEU HA H 135 4.174 4.418 -0.244 1
1 1532 . 12 1 1 A 135 135 LEU CA C 135 54.408 53.286 1.122 1
1 1533 . 12 1 1 A 135 135 LEU CB C 135 40.407 42.294 -1.887 1
1 1537 . 12 1 1 A 135 135 LEU N N 135 123.358 122.334 1.024 1
1 1538 . 12 1 1 A 136 136 PRO HA H 136 4.437 4.741 -0.304 1
1 1545 . 12 1 1 A 136 136 PRO C C 136 177.106 176.854 0.252 1
1 1546 . 12 1 1 A 136 136 PRO CA C 136 62.889 62.490 0.399 1
1 1547 . 12 1 1 A 136 136 PRO CB C 136 32.192 30.159 2.033 1
1 1550 . 12 1 1 A 137 137 VAL H H 137 8.219 8.246 -0.027 1
1 1551 . 12 1 1 A 137 137 VAL HA H 137 4.077 4.090 -0.013 1
1 1559 . 12 1 1 A 137 137 VAL C C 137 176.305 177.250 -0.945 1
1 1560 . 12 1 1 A 137 137 VAL CA C 137 61.958 64.297 -2.339 1
1 1561 . 12 1 1 A 137 137 VAL CB C 137 32.755 30.573 2.182 1
1 1564 . 12 1 1 A 137 137 VAL N N 137 120.079 117.170 2.909 1
1 1565 . 12 1 1 A 138 138 LYS H H 138 8.444 8.780 -0.336 1
1 1566 . 12 1 1 A 138 138 LYS HA H 138 4.316 3.904 0.412 1
1 1575 . 12 1 1 A 138 138 LYS C C 138 176.790 177.394 -0.604 1
1 1576 . 12 1 1 A 138 138 LYS CA C 138 56.792 58.677 -1.885 1
1 1577 . 12 1 1 A 138 138 LYS CB C 138 33.205 32.609 0.596 1
1 1581 . 12 1 1 A 138 138 LYS N N 138 126.449 124.325 2.124 1
1 1582 . 12 1 1 A 139 139 GLY H H 139 8.518 8.072 0.446 1
1 1583 . 12 1 1 A 139 139 GLY HA2 H 139 4.070 3.878 0.192 1
1 1584 . 12 1 1 A 139 139 GLY HA3 H 139 3.897 3.893 0.004 1
1 1585 . 12 1 1 A 139 139 GLY C C 139 172.874 175.091 -2.217 1
1 1586 . 12 1 1 A 139 139 GLY CA C 139 45.157 46.492 -1.335 1
1 1587 . 12 1 1 A 139 139 GLY N N 139 112.617 106.617 6.000 1
1 6 . 13 1 1 A 2 2 VAL H H 2 8.992 8.385 0.607 1
1 7 . 13 1 1 A 2 2 VAL HA H 2 5.370 4.870 0.500 1
1 15 . 13 1 1 A 2 2 VAL C C 2 174.325 173.843 0.482 1
1 16 . 13 1 1 A 2 2 VAL CA C 2 61.267 60.350 0.917 1
1 17 . 13 1 1 A 2 2 VAL CB C 2 33.890 36.096 -2.206 1
1 20 . 13 1 1 A 2 2 VAL N N 2 126.939 123.896 3.043 1
1 21 . 13 1 1 A 3 3 THR H H 3 8.912 8.747 0.165 1
1 22 . 13 1 1 A 3 3 THR HA H 3 4.505 5.408 -0.903 1
1 27 . 13 1 1 A 3 3 THR C C 3 172.710 173.007 -0.297 1
1 28 . 13 1 1 A 3 3 THR CA C 3 59.689 59.830 -0.141 1
1 29 . 13 1 1 A 3 3 THR CB C 3 72.398 72.213 0.185 1
1 31 . 13 1 1 A 3 3 THR N N 3 118.091 122.092 -4.001 1
1 32 . 13 1 1 A 4 4 GLU H H 4 8.631 9.177 -0.546 1
1 33 . 13 1 1 A 4 4 GLU HA H 4 5.788 5.010 0.778 1
1 38 . 13 1 1 A 4 4 GLU C C 4 175.758 174.449 1.309 1
1 39 . 13 1 1 A 4 4 GLU CA C 4 54.902 54.274 0.628 1
1 40 . 13 1 1 A 4 4 GLU CB C 4 35.097 33.959 1.138 1
1 42 . 13 1 1 A 4 4 GLU N N 4 120.966 125.470 -4.504 1
1 43 . 13 1 1 A 5 5 THR H H 5 9.188 8.891 0.297 1
1 44 . 13 1 1 A 5 5 THR HA H 5 4.739 5.068 -0.329 1
1 49 . 13 1 1 A 5 5 THR C C 5 172.757 172.816 -0.059 1
1 50 . 13 1 1 A 5 5 THR CA C 5 60.382 60.130 0.252 1
1 51 . 13 1 1 A 5 5 THR CB C 5 71.558 72.089 -0.531 1
1 53 . 13 1 1 A 5 5 THR N N 5 119.366 114.857 4.509 1
1 54 . 13 1 1 A 6 6 VAL H H 6 8.476 8.947 -0.471 1
1 55 . 13 1 1 A 6 6 VAL HA H 6 5.026 5.371 -0.345 1
1 63 . 13 1 1 A 6 6 VAL C C 6 176.674 173.846 2.828 1
1 64 . 13 1 1 A 6 6 VAL CA C 6 61.008 60.132 0.876 1
1 65 . 13 1 1 A 6 6 VAL CB C 6 33.861 34.219 -0.358 1
1 68 . 13 1 1 A 6 6 VAL N N 6 121.384 120.822 0.562 1
1 69 . 13 1 1 A 7 7 ASP H H 7 8.848 8.588 0.260 1
1 70 . 13 1 1 A 7 7 ASP HA H 7 4.797 4.983 -0.186 1
1 73 . 13 1 1 A 7 7 ASP CA C 7 52.834 54.111 -1.277 1
1 74 . 13 1 1 A 7 7 ASP CB C 7 42.219 42.482 -0.263 1
1 75 . 13 1 1 A 7 7 ASP N N 7 127.061 127.243 -0.182 1
1 76 . 13 1 1 A 8 8 GLY C C 8 175.143 174.975 0.168 1
1 77 . 13 1 1 A 8 8 GLY CA C 8 46.553 46.795 -0.242 1
1 78 . 13 1 1 A 9 9 GLN H H 9 8.408 7.375 1.033 1
1 79 . 13 1 1 A 9 9 GLN HA H 9 4.541 4.323 0.218 1
1 86 . 13 1 1 A 9 9 GLN C C 9 176.463 176.207 0.256 1
1 87 . 13 1 1 A 9 9 GLN CA C 9 55.167 55.608 -0.441 1
1 88 . 13 1 1 A 9 9 GLN CB C 9 29.376 28.961 0.415 1
1 90 . 13 1 1 A 9 9 GLN N N 9 118.300 117.773 0.527 1
1 92 . 13 1 1 A 10 10 GLY H H 10 8.162 8.353 -0.191 1
1 93 . 13 1 1 A 10 10 GLY HA2 H 10 4.174 3.829 0.345 1
1 94 . 13 1 1 A 10 10 GLY HA3 H 10 3.521 3.842 -0.321 1
1 95 . 13 1 1 A 10 10 GLY C C 10 174.092 173.958 0.134 1
1 96 . 13 1 1 A 10 10 GLY CA C 10 45.558 45.966 -0.408 1
1 97 . 13 1 1 A 10 10 GLY N N 10 108.747 109.195 -0.448 1
1 98 . 13 1 1 A 11 11 GLN H H 11 8.507 7.208 1.299 1
1 99 . 13 1 1 A 11 11 GLN HA H 11 4.202 4.786 -0.584 1
1 106 . 13 1 1 A 11 11 GLN C C 11 173.992 174.433 -0.441 1
1 107 . 13 1 1 A 11 11 GLN CA C 11 55.098 53.740 1.358 1
1 108 . 13 1 1 A 11 11 GLN CB C 11 29.097 31.511 -2.414 1
1 110 . 13 1 1 A 11 11 GLN N N 11 122.979 116.404 6.575 1
1 112 . 13 1 1 A 12 12 ALA H H 12 8.259 8.542 -0.283 1
1 113 . 13 1 1 A 12 12 ALA HA H 12 5.156 5.450 -0.294 1
1 117 . 13 1 1 A 12 12 ALA C C 12 177.284 176.181 1.103 1
1 118 . 13 1 1 A 12 12 ALA CA C 12 51.087 50.815 0.272 1
1 119 . 13 1 1 A 12 12 ALA CB C 12 20.500 22.019 -1.519 1
1 120 . 13 1 1 A 12 12 ALA N N 12 127.100 121.875 5.225 1
1 121 . 13 1 1 A 13 13 TRP H H 13 9.245 9.073 0.172 1
1 122 . 13 1 1 A 13 13 TRP HA H 13 4.717 5.370 -0.653 1
1 131 . 13 1 1 A 13 13 TRP C C 13 175.108 174.286 0.822 1
1 132 . 13 1 1 A 13 13 TRP CA C 13 55.966 55.525 0.441 1
1 133 . 13 1 1 A 13 13 TRP CB C 13 31.912 32.272 -0.360 1
1 139 . 13 1 1 A 13 13 TRP N N 13 123.088 119.559 3.529 1
1 141 . 13 1 1 A 14 14 ARG H H 14 8.575 8.593 -0.018 1
1 142 . 13 1 1 A 14 14 ARG HA H 14 5.335 4.201 1.134 1
1 150 . 13 1 1 A 14 14 ARG C C 14 175.191 174.180 1.011 1
1 151 . 13 1 1 A 14 14 ARG CA C 14 53.106 54.983 -1.877 1
1 152 . 13 1 1 A 14 14 ARG CB C 14 32.749 31.613 1.136 1
1 154 . 13 1 1 A 14 14 ARG N N 14 121.163 119.450 1.713 1
1 156 . 13 1 1 A 15 15 HIS H H 15 8.595 8.080 0.515 1
1 157 . 13 1 1 A 15 15 HIS HA H 15 4.790 5.201 -0.411 1
1 161 . 13 1 1 A 15 15 HIS C C 15 173.770 174.276 -0.506 1
1 162 . 13 1 1 A 15 15 HIS CA C 15 55.289 54.065 1.224 1
1 163 . 13 1 1 A 15 15 HIS CB C 15 33.208 32.528 0.680 1
1 165 . 13 1 1 A 15 15 HIS N N 15 117.643 119.512 -1.869 1
1 166 . 13 1 1 A 16 16 HIS H H 16 8.993 9.004 -0.011 1
1 167 . 13 1 1 A 16 16 HIS HA H 16 5.158 5.045 0.113 1
1 171 . 13 1 1 A 16 16 HIS C C 16 173.608 174.883 -1.275 1
1 172 . 13 1 1 A 16 16 HIS CA C 16 56.450 55.082 1.368 1
1 173 . 13 1 1 A 16 16 HIS CB C 16 34.171 31.529 2.642 1
1 175 . 13 1 1 A 16 16 HIS N N 16 123.520 120.286 3.234 1
1 176 . 13 1 1 A 17 17 ASN H H 17 7.829 9.254 -1.425 1
1 177 . 13 1 1 A 17 17 ASN HA H 17 4.713 5.496 -0.783 1
1 182 . 13 1 1 A 17 17 ASN C C 17 173.682 175.348 -1.666 1
1 183 . 13 1 1 A 17 17 ASN CA C 17 51.822 51.775 0.047 1
1 184 . 13 1 1 A 17 17 ASN CB C 17 43.176 41.815 1.361 1
1 185 . 13 1 1 A 17 17 ASN N N 17 122.213 120.657 1.556 1
1 187 . 13 1 1 A 18 18 GLY H H 18 8.423 8.379 0.044 1
1 188 . 13 1 1 A 18 18 GLY HA2 H 18 3.931 3.977 -0.046 1
1 189 . 13 1 1 A 18 18 GLY HA3 H 18 3.707 4.134 -0.427 1
1 190 . 13 1 1 A 18 18 GLY C C 18 173.985 173.164 0.821 1
1 191 . 13 1 1 A 18 18 GLY CA C 18 43.949 43.728 0.221 1
1 192 . 13 1 1 A 18 18 GLY N N 18 106.991 107.364 -0.373 1
1 193 . 13 1 1 A 19 19 PHE H H 19 8.338 8.492 -0.154 1
1 194 . 13 1 1 A 19 19 PHE HA H 19 4.068 4.836 -0.768 1
1 197 . 13 1 1 A 19 19 PHE C C 19 176.568 174.864 1.704 1
1 198 . 13 1 1 A 19 19 PHE CA C 19 59.338 58.183 1.155 1
1 199 . 13 1 1 A 19 19 PHE CB C 19 40.201 39.632 0.569 1
1 200 . 13 1 1 A 19 19 PHE N N 19 116.857 118.953 -2.096 1
1 201 . 13 1 1 A 20 20 ASP H H 20 8.794 8.691 0.103 1
1 202 . 13 1 1 A 20 20 ASP HA H 20 4.485 4.847 -0.362 1
1 205 . 13 1 1 A 20 20 ASP C C 20 177.379 176.522 0.857 1
1 206 . 13 1 1 A 20 20 ASP CA C 20 54.140 53.735 0.405 1
1 207 . 13 1 1 A 20 20 ASP CB C 20 41.915 41.577 0.338 1
1 208 . 13 1 1 A 20 20 ASP N N 20 123.025 124.525 -1.500 1
1 209 . 13 1 1 A 21 21 PHE H H 21 8.862 9.060 -0.198 1
1 210 . 13 1 1 A 21 21 PHE HA H 21 4.087 4.065 0.022 1
1 218 . 13 1 1 A 21 21 PHE C C 21 176.952 177.310 -0.358 1
1 219 . 13 1 1 A 21 21 PHE CA C 21 61.095 62.381 -1.286 1
1 220 . 13 1 1 A 21 21 PHE CB C 21 38.678 39.416 -0.738 1
1 226 . 13 1 1 A 21 21 PHE N N 21 127.163 127.347 -0.184 1
1 227 . 13 1 1 A 22 22 ALA H H 22 8.561 8.360 0.201 1
1 228 . 13 1 1 A 22 22 ALA HA H 22 3.878 3.979 -0.101 1
1 232 . 13 1 1 A 22 22 ALA C C 22 180.710 180.248 0.462 1
1 233 . 13 1 1 A 22 22 ALA CA C 22 55.211 55.157 0.054 1
1 234 . 13 1 1 A 22 22 ALA CB C 22 18.321 18.236 0.085 1
1 235 . 13 1 1 A 22 22 ALA N N 22 120.293 121.241 -0.948 1
1 236 . 13 1 1 A 23 23 VAL H H 23 7.241 7.902 -0.661 1
1 237 . 13 1 1 A 23 23 VAL HA H 23 3.684 3.476 0.208 1
1 245 . 13 1 1 A 23 23 VAL C C 23 177.101 177.820 -0.719 1
1 246 . 13 1 1 A 23 23 VAL CA C 23 65.237 66.956 -1.719 1
1 247 . 13 1 1 A 23 23 VAL CB C 23 31.780 31.517 0.263 1
1 250 . 13 1 1 A 23 23 VAL N N 23 118.775 118.016 0.759 1
1 251 . 13 1 1 A 24 24 ILE H H 24 6.761 7.923 -1.162 1
1 252 . 13 1 1 A 24 24 ILE HA H 24 3.196 3.499 -0.303 1
1 262 . 13 1 1 A 24 24 ILE C C 24 177.287 178.039 -0.752 1
1 263 . 13 1 1 A 24 24 ILE CA C 24 63.404 65.615 -2.211 1
1 264 . 13 1 1 A 24 24 ILE CB C 24 36.294 37.627 -1.333 1
1 268 . 13 1 1 A 24 24 ILE N N 24 119.036 119.294 -0.258 1
1 269 . 13 1 1 A 25 25 LYS H H 25 8.032 8.127 -0.095 1
1 270 . 13 1 1 A 25 25 LYS HA H 25 3.809 3.639 0.170 1
1 279 . 13 1 1 A 25 25 LYS C C 25 179.450 177.812 1.638 1
1 280 . 13 1 1 A 25 25 LYS CA C 25 59.621 59.000 0.621 1
1 281 . 13 1 1 A 25 25 LYS CB C 25 32.259 31.734 0.525 1
1 285 . 13 1 1 A 25 25 LYS N N 25 118.368 120.020 -1.652 1
1 286 . 13 1 1 A 26 26 GLU H H 26 7.845 7.796 0.049 1
1 287 . 13 1 1 A 26 26 GLU HA H 26 4.021 4.213 -0.192 1
1 292 . 13 1 1 A 26 26 GLU C C 26 179.191 178.908 0.283 1
1 293 . 13 1 1 A 26 26 GLU CA C 26 59.530 58.812 0.718 1
1 294 . 13 1 1 A 26 26 GLU CB C 26 29.449 29.384 0.065 1
1 296 . 13 1 1 A 26 26 GLU N N 26 120.522 118.936 1.586 1
1 297 . 13 1 1 A 27 27 LEU H H 27 8.165 7.922 0.243 1
1 298 . 13 1 1 A 27 27 LEU HA H 27 4.163 4.210 -0.047 1
1 308 . 13 1 1 A 27 27 LEU C C 27 177.256 178.414 -1.158 1
1 309 . 13 1 1 A 27 27 LEU CA C 27 58.049 57.576 0.473 1
1 310 . 13 1 1 A 27 27 LEU CB C 27 41.365 41.417 -0.052 1
1 314 . 13 1 1 A 27 27 LEU N N 27 120.879 121.102 -0.223 1
1 315 . 13 1 1 A 28 28 LYS H H 28 8.902 8.219 0.683 1
1 316 . 13 1 1 A 28 28 LYS HA H 28 4.199 4.003 0.196 1
1 317 . 13 1 1 A 28 28 LYS C C 28 179.707 179.047 0.660 1
1 318 . 13 1 1 A 28 28 LYS CA C 28 60.097 59.443 0.654 1
1 319 . 13 1 1 A 28 28 LYS CB C 28 33.420 32.120 1.300 1
1 320 . 13 1 1 A 28 28 LYS N N 28 120.050 119.575 0.475 1
1 321 . 13 1 1 A 29 29 THR H H 29 8.294 8.264 0.030 1
1 322 . 13 1 1 A 29 29 THR HA H 29 3.892 3.928 -0.036 1
1 327 . 13 1 1 A 29 29 THR C C 29 175.711 176.708 -0.997 1
1 328 . 13 1 1 A 29 29 THR CA C 29 66.846 66.455 0.391 1
1 329 . 13 1 1 A 29 29 THR CB C 29 68.794 68.717 0.077 1
1 331 . 13 1 1 A 29 29 THR N N 29 115.933 116.838 -0.905 1
1 332 . 13 1 1 A 30 30 ALA H H 30 8.244 8.778 -0.534 1
1 333 . 13 1 1 A 30 30 ALA HA H 30 4.241 4.223 0.018 1
1 337 . 13 1 1 A 30 30 ALA C C 30 179.128 179.773 -0.645 1
1 338 . 13 1 1 A 30 30 ALA CA C 30 55.714 55.229 0.485 1
1 339 . 13 1 1 A 30 30 ALA CB C 30 18.955 18.822 0.133 1
1 340 . 13 1 1 A 30 30 ALA N N 30 124.617 123.562 1.055 1
1 341 . 13 1 1 A 31 31 ALA H H 31 8.968 8.579 0.389 1
1 342 . 13 1 1 A 31 31 ALA HA H 31 3.890 4.118 -0.228 1
1 346 . 13 1 1 A 31 31 ALA C C 31 180.352 179.620 0.732 1
1 347 . 13 1 1 A 31 31 ALA CA C 31 55.454 55.242 0.212 1
1 348 . 13 1 1 A 31 31 ALA CB C 31 17.124 18.317 -1.193 1
1 349 . 13 1 1 A 31 31 ALA N N 31 119.327 120.734 -1.407 1
1 350 . 13 1 1 A 32 32 SER H H 32 7.995 7.927 0.068 1
1 351 . 13 1 1 A 32 32 SER HA H 32 4.238 4.301 -0.063 1
1 354 . 13 1 1 A 32 32 SER C C 32 175.612 176.300 -0.688 1
1 355 . 13 1 1 A 32 32 SER CA C 32 61.203 61.234 -0.031 1
1 356 . 13 1 1 A 32 32 SER CB C 32 63.406 63.123 0.283 1
1 357 . 13 1 1 A 32 32 SER N N 32 111.962 112.540 -0.578 1
1 358 . 13 1 1 A 33 33 GLN H H 33 8.333 7.639 0.694 1
1 359 . 13 1 1 A 33 33 GLN HA H 33 3.992 4.103 -0.111 1
1 366 . 13 1 1 A 33 33 GLN C C 33 177.486 177.589 -0.103 1
1 367 . 13 1 1 A 33 33 GLN CA C 33 58.277 58.094 0.183 1
1 368 . 13 1 1 A 33 33 GLN CB C 33 29.140 29.083 0.057 1
1 370 . 13 1 1 A 33 33 GLN N N 33 119.527 121.066 -1.539 1
1 372 . 13 1 1 A 34 34 TYR H H 34 8.587 8.156 0.431 1
1 373 . 13 1 1 A 34 34 TYR HA H 34 4.792 4.474 0.318 1
1 380 . 13 1 1 A 34 34 TYR C C 34 176.499 176.641 -0.142 1
1 381 . 13 1 1 A 34 34 TYR CA C 34 57.711 59.719 -2.008 1
1 382 . 13 1 1 A 34 34 TYR CB C 34 39.561 39.062 0.499 1
1 387 . 13 1 1 A 34 34 TYR N N 34 114.610 116.610 -2.000 1
1 388 . 13 1 1 A 35 35 GLY H H 35 7.346 8.377 -1.031 1
1 389 . 13 1 1 A 35 35 GLY HA2 H 35 4.785 4.132 0.653 1
1 390 . 13 1 1 A 35 35 GLY HA3 H 35 4.007 4.136 -0.129 1
1 391 . 13 1 1 A 35 35 GLY C C 35 175.796 173.312 2.484 1
1 392 . 13 1 1 A 35 35 GLY CA C 35 44.355 44.666 -0.311 1
1 393 . 13 1 1 A 35 35 GLY N N 35 108.501 106.367 2.134 1
1 394 . 13 1 1 A 36 36 ALA H H 36 9.363 8.316 1.047 1
1 395 . 13 1 1 A 36 36 ALA HA H 36 4.217 4.556 -0.339 1
1 399 . 13 1 1 A 36 36 ALA C C 36 178.039 178.380 -0.341 1
1 400 . 13 1 1 A 36 36 ALA CA C 36 56.114 51.932 4.182 1
1 401 . 13 1 1 A 36 36 ALA CB C 36 19.179 19.967 -0.788 1
1 402 . 13 1 1 A 36 36 ALA N N 36 125.811 123.252 2.559 1
1 403 . 13 1 1 A 37 37 THR H H 37 8.070 8.710 -0.640 1
1 404 . 13 1 1 A 37 37 THR HA H 37 4.570 4.035 0.535 1
1 409 . 13 1 1 A 37 37 THR C C 37 173.685 173.799 -0.114 1
1 410 . 13 1 1 A 37 37 THR CA C 37 59.822 65.267 -5.445 1
1 411 . 13 1 1 A 37 37 THR CB C 37 68.267 66.791 1.476 1
1 413 . 13 1 1 A 37 37 THR N N 37 129.410 109.347 20.063 1
1 414 . 13 1 1 A 38 38 ALA H H 38 6.853 7.784 -0.931 1
1 415 . 13 1 1 A 38 38 ALA HA H 38 4.601 4.544 0.057 1
1 419 . 13 1 1 A 38 38 ALA CA C 38 50.758 50.614 0.144 1
1 420 . 13 1 1 A 38 38 ALA CB C 38 18.325 19.772 -1.447 1
1 421 . 13 1 1 A 38 38 ALA N N 38 124.674 124.901 -0.227 1
1 422 . 13 1 1 A 40 40 TYR HA H 40 4.032 4.028 0.004 1
1 429 . 13 1 1 A 40 40 TYR C C 40 176.456 177.406 -0.950 1
1 430 . 13 1 1 A 40 40 TYR CA C 40 61.010 61.622 -0.612 1
1 431 . 13 1 1 A 40 40 TYR CB C 40 39.286 38.542 0.744 1
1 436 . 13 1 1 A 41 41 THR H H 41 6.874 8.057 -1.183 1
1 437 . 13 1 1 A 41 41 THR HA H 41 3.616 4.097 -0.481 1
1 442 . 13 1 1 A 41 41 THR C C 41 176.930 176.805 0.125 1
1 443 . 13 1 1 A 41 41 THR CA C 41 65.557 65.687 -0.130 1
1 444 . 13 1 1 A 41 41 THR CB C 41 68.228 69.341 -1.113 1
1 446 . 13 1 1 A 41 41 THR N N 41 115.143 113.920 1.223 1
1 447 . 13 1 1 A 42 42 LEU H H 42 8.623 7.318 1.305 1
1 448 . 13 1 1 A 42 42 LEU HA H 42 3.708 4.077 -0.369 1
1 458 . 13 1 1 A 42 42 LEU C C 42 178.206 179.057 -0.851 1
1 459 . 13 1 1 A 42 42 LEU CA C 42 57.417 57.846 -0.429 1
1 460 . 13 1 1 A 42 42 LEU CB C 42 41.342 41.227 0.115 1
1 464 . 13 1 1 A 42 42 LEU N N 42 120.418 118.613 1.805 1
1 465 . 13 1 1 A 43 43 ALA H H 43 7.735 7.773 -0.038 1
1 466 . 13 1 1 A 43 43 ALA HA H 43 4.020 3.930 0.090 1
1 470 . 13 1 1 A 43 43 ALA C C 43 180.826 180.609 0.217 1
1 471 . 13 1 1 A 43 43 ALA CA C 43 54.925 55.009 -0.084 1
1 472 . 13 1 1 A 43 43 ALA CB C 43 17.506 18.173 -0.667 1
1 473 . 13 1 1 A 43 43 ALA N N 43 120.203 121.777 -1.574 1
1 474 . 13 1 1 A 44 44 ILE H H 44 7.149 7.330 -0.181 1
1 475 . 13 1 1 A 44 44 ILE HA H 44 3.603 3.589 0.014 1
1 485 . 13 1 1 A 44 44 ILE C C 44 178.594 178.242 0.352 1
1 486 . 13 1 1 A 44 44 ILE CA C 44 64.782 64.403 0.379 1
1 487 . 13 1 1 A 44 44 ILE CB C 44 37.472 36.969 0.503 1
1 491 . 13 1 1 A 44 44 ILE N N 44 118.881 119.529 -0.648 1
1 492 . 13 1 1 A 45 45 VAL H H 45 7.968 7.903 0.065 1
1 493 . 13 1 1 A 45 45 VAL HA H 45 2.925 3.389 -0.464 1
1 501 . 13 1 1 A 45 45 VAL C C 45 177.023 177.434 -0.411 1
1 502 . 13 1 1 A 45 45 VAL CA C 45 67.081 66.697 0.384 1
1 503 . 13 1 1 A 45 45 VAL CB C 45 30.854 31.028 -0.174 1
1 506 . 13 1 1 A 45 45 VAL N N 45 120.764 120.839 -0.075 1
1 507 . 13 1 1 A 46 46 GLU H H 46 8.399 8.035 0.364 1
1 508 . 13 1 1 A 46 46 GLU HA H 46 3.848 3.959 -0.111 1
1 513 . 13 1 1 A 46 46 GLU C C 46 178.656 179.189 -0.533 1
1 514 . 13 1 1 A 46 46 GLU CA C 46 59.491 59.098 0.393 1
1 515 . 13 1 1 A 46 46 GLU CB C 46 28.991 28.780 0.211 1
1 517 . 13 1 1 A 46 46 GLU N N 46 116.599 119.956 -3.357 1
1 518 . 13 1 1 A 47 47 SER H H 47 7.273 7.780 -0.507 1
1 519 . 13 1 1 A 47 47 SER HA H 47 4.287 4.126 0.161 1
1 521 . 13 1 1 A 47 47 SER CA C 47 61.047 62.284 -1.237 1
1 522 . 13 1 1 A 47 47 SER CB C 47 63.016 63.032 -0.016 1
1 523 . 13 1 1 A 47 47 SER N N 47 113.609 118.379 -4.770 1
1 524 . 13 1 1 A 48 48 VAL H H 48 8.006 7.635 0.371 1
1 525 . 13 1 1 A 48 48 VAL HA H 48 3.556 3.517 0.039 1
1 533 . 13 1 1 A 48 48 VAL C C 48 177.257 176.403 0.854 1
1 534 . 13 1 1 A 48 48 VAL CA C 48 65.025 65.614 -0.589 1
1 535 . 13 1 1 A 48 48 VAL CB C 48 31.841 30.846 0.995 1
1 538 . 13 1 1 A 48 48 VAL N N 48 122.327 121.077 1.250 1
1 539 . 13 1 1 A 49 49 ALA H H 49 8.369 7.436 0.933 1
1 540 . 13 1 1 A 49 49 ALA HA H 49 4.115 3.996 0.119 1
1 544 . 13 1 1 A 49 49 ALA C C 49 177.307 177.451 -0.144 1
1 545 . 13 1 1 A 49 49 ALA CA C 49 53.253 52.637 0.616 1
1 546 . 13 1 1 A 49 49 ALA CB C 49 20.131 18.645 1.486 1
1 547 . 13 1 1 A 49 49 ALA N N 49 118.050 120.362 -2.312 1
1 548 . 13 1 1 A 50 50 ASP H H 50 7.052 7.866 -0.814 1
1 549 . 13 1 1 A 50 50 ASP HA H 50 4.788 4.572 0.216 1
1 552 . 13 1 1 A 50 50 ASP C C 50 175.481 175.712 -0.231 1
1 553 . 13 1 1 A 50 50 ASP CA C 50 53.681 54.017 -0.336 1
1 554 . 13 1 1 A 50 50 ASP CB C 50 39.333 41.147 -1.814 1
1 555 . 13 1 1 A 50 50 ASP N N 50 116.997 117.248 -0.251 1
1 556 . 13 1 1 A 51 51 ASN H H 51 8.535 7.650 0.885 1
1 557 . 13 1 1 A 51 51 ASN HA H 51 4.628 4.801 -0.173 1
1 562 . 13 1 1 A 51 51 ASN C C 51 174.077 174.047 0.030 1
1 563 . 13 1 1 A 51 51 ASN CA C 51 52.315 51.275 1.040 1
1 564 . 13 1 1 A 51 51 ASN CB C 51 41.928 41.643 0.285 1
1 565 . 13 1 1 A 51 51 ASN N N 51 118.626 115.126 3.500 1
1 567 . 13 1 1 A 52 52 TRP H H 52 8.555 7.947 0.608 1
1 574 . 13 1 1 A 52 52 TRP C C 52 173.269 176.522 -3.253 1
1 575 . 13 1 1 A 52 52 TRP CA C 52 55.031 57.737 -2.706 1
1 576 . 13 1 1 A 52 52 TRP CB C 52 26.801 29.333 -2.532 1
1 582 . 13 1 1 A 52 52 TRP N N 52 120.693 122.544 -1.851 1
1 584 . 13 1 1 A 53 53 LEU H H 53 7.847 9.168 -1.321 1
1 585 . 13 1 1 A 53 53 LEU HA H 53 4.859 5.212 -0.353 1
1 595 . 13 1 1 A 53 53 LEU C C 53 177.397 175.089 2.308 1
1 596 . 13 1 1 A 53 53 LEU CA C 53 53.619 53.364 0.255 1
1 597 . 13 1 1 A 53 53 LEU CB C 53 41.812 46.077 -4.265 1
1 601 . 13 1 1 A 53 53 LEU N N 53 124.741 120.693 4.048 1
1 602 . 13 1 1 A 54 54 THR H H 54 8.850 9.034 -0.184 1
1 603 . 13 1 1 A 54 54 THR HA H 54 4.598 4.870 -0.272 1
1 608 . 13 1 1 A 54 54 THR CA C 54 60.531 59.442 1.089 1
1 609 . 13 1 1 A 54 54 THR CB C 54 67.183 70.100 -2.917 1
1 611 . 13 1 1 A 54 54 THR N N 54 113.407 114.335 -0.928 1
1 612 . 13 1 1 A 55 55 PRO HA H 55 4.511 4.218 0.293 1
1 619 . 13 1 1 A 55 55 PRO C C 55 179.383 177.903 1.480 1
1 620 . 13 1 1 A 55 55 PRO CA C 55 67.159 65.459 1.700 1
1 621 . 13 1 1 A 55 55 PRO CB C 55 32.095 31.681 0.414 1
1 622 . 13 1 1 A 56 56 THR H H 56 8.575 7.835 0.740 1
1 623 . 13 1 1 A 56 56 THR HA H 56 4.229 4.197 0.032 1
1 628 . 13 1 1 A 56 56 THR C C 56 176.668 176.737 -0.069 1
1 629 . 13 1 1 A 56 56 THR CA C 56 66.943 65.154 1.789 1
1 630 . 13 1 1 A 56 56 THR CB C 56 68.129 68.839 -0.710 1
1 632 . 13 1 1 A 56 56 THR N N 56 114.855 110.724 4.131 1
1 633 . 13 1 1 A 57 57 ASP H H 57 8.730 8.524 0.206 1
1 634 . 13 1 1 A 57 57 ASP HA H 57 4.425 4.895 -0.470 1
1 637 . 13 1 1 A 57 57 ASP C C 57 178.351 179.067 -0.716 1
1 638 . 13 1 1 A 57 57 ASP CA C 57 57.963 56.701 1.262 1
1 639 . 13 1 1 A 57 57 ASP CB C 57 40.134 40.113 0.021 1
1 640 . 13 1 1 A 57 57 ASP N N 57 126.239 120.226 6.013 1
1 641 . 13 1 1 A 58 58 TRP H H 58 8.244 7.986 0.258 1
1 642 . 13 1 1 A 58 58 TRP HA H 58 4.030 4.394 -0.364 1
1 650 . 13 1 1 A 58 58 TRP C C 58 177.432 179.364 -1.932 1
1 651 . 13 1 1 A 58 58 TRP CA C 58 62.731 60.136 2.595 1
1 652 . 13 1 1 A 58 58 TRP CB C 58 29.122 29.076 0.046 1
1 657 . 13 1 1 A 58 58 TRP N N 58 119.241 119.949 -0.708 1
1 659 . 13 1 1 A 59 59 ASN H H 59 8.098 8.681 -0.583 1
1 660 . 13 1 1 A 59 59 ASN HA H 59 4.424 4.780 -0.356 1
1 663 . 13 1 1 A 59 59 ASN C C 59 176.952 177.986 -1.034 1
1 664 . 13 1 1 A 59 59 ASN CA C 59 58.135 56.411 1.724 1
1 665 . 13 1 1 A 59 59 ASN CB C 59 40.168 39.606 0.562 1
1 666 . 13 1 1 A 59 59 ASN N N 59 115.747 118.047 -2.300 1
1 667 . 13 1 1 A 60 60 THR H H 60 8.712 7.901 0.811 1
1 668 . 13 1 1 A 60 60 THR HA H 60 3.717 4.057 -0.340 1
1 673 . 13 1 1 A 60 60 THR C C 60 176.044 176.990 -0.946 1
1 674 . 13 1 1 A 60 60 THR CA C 60 66.576 66.957 -0.381 1
1 675 . 13 1 1 A 60 60 THR CB C 60 69.251 67.918 1.333 1
1 677 . 13 1 1 A 60 60 THR N N 60 114.896 116.323 -1.427 1
1 678 . 13 1 1 A 61 61 LEU H H 61 8.485 8.570 -0.085 1
1 679 . 13 1 1 A 61 61 LEU HA H 61 3.391 3.972 -0.581 1
1 689 . 13 1 1 A 61 61 LEU C C 61 177.433 178.957 -1.524 1
1 690 . 13 1 1 A 61 61 LEU CA C 61 58.354 58.471 -0.117 1
1 691 . 13 1 1 A 61 61 LEU CB C 61 41.761 42.420 -0.659 1
1 695 . 13 1 1 A 61 61 LEU N N 61 123.433 121.793 1.640 1
1 696 . 13 1 1 A 62 62 VAL H H 62 8.073 8.318 -0.245 1
1 697 . 13 1 1 A 62 62 VAL HA H 62 3.207 3.700 -0.493 1
1 705 . 13 1 1 A 62 62 VAL C C 62 177.585 177.438 0.147 1
1 706 . 13 1 1 A 62 62 VAL CA C 62 67.345 64.923 2.422 1
1 707 . 13 1 1 A 62 62 VAL CB C 62 30.905 30.587 0.318 1
1 710 . 13 1 1 A 62 62 VAL N N 62 116.018 118.541 -2.523 1
1 711 . 13 1 1 A 63 63 ARG H H 63 7.765 8.165 -0.400 1
1 712 . 13 1 1 A 63 63 ARG HA H 63 3.602 4.053 -0.451 1
1 719 . 13 1 1 A 63 63 ARG C C 63 177.818 178.181 -0.363 1
1 720 . 13 1 1 A 63 63 ARG CA C 63 58.049 58.134 -0.085 1
1 721 . 13 1 1 A 63 63 ARG CB C 63 29.955 29.345 0.610 1
1 724 . 13 1 1 A 63 63 ARG N N 63 116.700 120.873 -4.173 1
1 725 . 13 1 1 A 64 64 ALA H H 64 7.574 7.477 0.097 1
1 726 . 13 1 1 A 64 64 ALA HA H 64 4.158 4.389 -0.231 1
1 730 . 13 1 1 A 64 64 ALA C C 64 179.886 179.171 0.715 1
1 731 . 13 1 1 A 64 64 ALA CA C 64 54.007 53.894 0.113 1
1 732 . 13 1 1 A 64 64 ALA CB C 64 19.147 19.827 -0.680 1
1 733 . 13 1 1 A 64 64 ALA N N 64 117.555 122.107 -4.552 1
1 734 . 13 1 1 A 65 65 VAL H H 65 7.554 8.078 -0.524 1
1 735 . 13 1 1 A 65 65 VAL HA H 65 4.253 3.634 0.619 1
1 743 . 13 1 1 A 65 65 VAL C C 65 174.180 176.037 -1.857 1
1 744 . 13 1 1 A 65 65 VAL CA C 65 62.683 66.863 -4.180 1
1 745 . 13 1 1 A 65 65 VAL CB C 65 33.458 32.065 1.393 1
1 748 . 13 1 1 A 65 65 VAL N N 65 110.013 117.753 -7.740 1
1 749 . 13 1 1 A 66 66 LEU H H 66 7.792 7.010 0.782 1
1 750 . 13 1 1 A 66 66 LEU HA H 66 4.790 4.775 0.015 1
1 760 . 13 1 1 A 66 66 LEU C C 66 177.537 175.148 2.389 1
1 761 . 13 1 1 A 66 66 LEU CA C 66 52.823 52.683 0.140 1
1 762 . 13 1 1 A 66 66 LEU CB C 66 44.071 45.538 -1.467 1
1 766 . 13 1 1 A 66 66 LEU N N 66 118.967 118.685 0.282 1
1 767 . 13 1 1 A 67 67 SER H H 67 9.208 8.509 0.699 1
1 768 . 13 1 1 A 67 67 SER HA H 67 4.414 4.783 -0.369 1
1 771 . 13 1 1 A 67 67 SER CA C 67 57.943 57.053 0.890 1
1 772 . 13 1 1 A 67 67 SER CB C 67 64.743 65.822 -1.079 1
1 773 . 13 1 1 A 67 67 SER N N 67 116.378 115.348 1.030 1
1 774 . 13 1 1 A 69 69 GLY HA2 H 69 3.916 3.839 0.077 1
1 775 . 13 1 1 A 69 69 GLY HA3 H 69 3.867 3.856 0.011 1
1 776 . 13 1 1 A 69 69 GLY C C 69 176.783 175.612 1.171 1
1 777 . 13 1 1 A 69 69 GLY CA C 69 46.977 46.487 0.490 1
1 778 . 13 1 1 A 70 70 ASP H H 70 7.674 8.251 -0.577 1
1 779 . 13 1 1 A 70 70 ASP HA H 70 4.511 3.962 0.549 1
1 782 . 13 1 1 A 70 70 ASP C C 70 178.096 178.202 -0.106 1
1 783 . 13 1 1 A 70 70 ASP CA C 70 57.262 56.612 0.650 1
1 784 . 13 1 1 A 70 70 ASP CB C 70 40.594 39.956 0.638 1
1 785 . 13 1 1 A 70 70 ASP N N 70 123.930 121.709 2.221 1
1 786 . 13 1 1 A 71 71 HIS H H 71 8.729 8.141 0.588 1
1 787 . 13 1 1 A 71 71 HIS HA H 71 4.235 4.215 0.020 1
1 790 . 13 1 1 A 71 71 HIS C C 71 176.769 178.012 -1.243 1
1 791 . 13 1 1 A 71 71 HIS CA C 71 60.041 59.001 1.040 1
1 792 . 13 1 1 A 71 71 HIS CB C 71 30.682 29.881 0.801 1
1 793 . 13 1 1 A 71 71 HIS N N 71 121.003 117.114 3.889 1
1 794 . 13 1 1 A 72 72 LEU H H 72 7.620 8.028 -0.408 1
1 795 . 13 1 1 A 72 72 LEU HA H 72 3.769 4.054 -0.285 1
1 805 . 13 1 1 A 72 72 LEU C C 72 180.275 179.181 1.094 1
1 806 . 13 1 1 A 72 72 LEU CA C 72 58.192 58.005 0.187 1
1 807 . 13 1 1 A 72 72 LEU CB C 72 41.381 41.251 0.130 1
1 811 . 13 1 1 A 72 72 LEU N N 72 118.569 116.976 1.593 1
1 812 . 13 1 1 A 73 73 LEU H H 73 7.542 7.524 0.018 1
1 813 . 13 1 1 A 73 73 LEU HA H 73 4.107 4.262 -0.155 1
1 823 . 13 1 1 A 73 73 LEU C C 73 179.436 179.278 0.158 1
1 824 . 13 1 1 A 73 73 LEU CA C 73 58.026 57.279 0.747 1
1 825 . 13 1 1 A 73 73 LEU CB C 73 41.638 42.190 -0.552 1
1 829 . 13 1 1 A 73 73 LEU N N 73 121.418 120.414 1.004 1
1 830 . 13 1 1 A 74 74 TRP H H 74 8.786 7.980 0.806 1
1 831 . 13 1 1 A 74 74 TRP HA H 74 3.589 5.460 -1.871 1
1 840 . 13 1 1 A 74 74 TRP C C 74 176.816 178.729 -1.913 1
1 841 . 13 1 1 A 74 74 TRP CA C 74 63.046 59.919 3.127 1
1 842 . 13 1 1 A 74 74 TRP CB C 74 28.065 29.001 -0.936 1
1 848 . 13 1 1 A 74 74 TRP N N 74 121.111 118.214 2.897 1
1 850 . 13 1 1 A 75 75 LYS H H 75 8.939 7.658 1.281 1
1 851 . 13 1 1 A 75 75 LYS HA H 75 3.055 4.240 -1.185 1
1 860 . 13 1 1 A 75 75 LYS C C 75 177.967 179.454 -1.487 1
1 861 . 13 1 1 A 75 75 LYS CA C 75 60.029 58.678 1.351 1
1 862 . 13 1 1 A 75 75 LYS CB C 75 32.533 33.052 -0.519 1
1 866 . 13 1 1 A 75 75 LYS N N 75 119.783 118.745 1.038 1
1 867 . 13 1 1 A 76 76 SER H H 76 7.832 8.426 -0.594 1
1 868 . 13 1 1 A 76 76 SER HA H 76 4.040 4.466 -0.426 1
1 871 . 13 1 1 A 76 76 SER C C 76 177.816 176.076 1.740 1
1 872 . 13 1 1 A 76 76 SER CA C 76 62.105 61.964 0.141 1
1 873 . 13 1 1 A 76 76 SER CB C 76 62.679 62.976 -0.297 1
1 874 . 13 1 1 A 76 76 SER N N 76 113.395 117.362 -3.967 1
1 875 . 13 1 1 A 77 77 GLU H H 77 7.590 7.782 -0.192 1
1 876 . 13 1 1 A 77 77 GLU HA H 77 4.042 4.183 -0.141 1
1 881 . 13 1 1 A 77 77 GLU C C 77 177.809 178.833 -1.024 1
1 882 . 13 1 1 A 77 77 GLU CA C 77 58.270 59.169 -0.899 1
1 883 . 13 1 1 A 77 77 GLU CB C 77 29.208 29.181 0.027 1
1 885 . 13 1 1 A 77 77 GLU N N 77 121.574 122.004 -0.430 1
1 886 . 13 1 1 A 78 78 PHE H H 78 9.081 7.845 1.236 1
1 887 . 13 1 1 A 78 78 PHE HA H 78 3.778 4.291 -0.513 1
1 895 . 13 1 1 A 78 78 PHE C C 78 178.114 177.261 0.853 1
1 896 . 13 1 1 A 78 78 PHE CA C 78 60.629 61.331 -0.702 1
1 897 . 13 1 1 A 78 78 PHE CB C 78 38.295 38.447 -0.152 1
1 902 . 13 1 1 A 78 78 PHE N N 78 122.682 120.694 1.988 1
1 903 . 13 1 1 A 79 79 PHE H H 79 8.890 8.007 0.883 1
1 904 . 13 1 1 A 79 79 PHE HA H 79 3.800 4.026 -0.226 1
1 912 . 13 1 1 A 79 79 PHE C C 79 178.354 178.349 0.005 1
1 913 . 13 1 1 A 79 79 PHE CA C 79 60.704 61.667 -0.963 1
1 914 . 13 1 1 A 79 79 PHE CB C 79 37.184 38.250 -1.066 1
1 920 . 13 1 1 A 79 79 PHE N N 79 121.056 118.270 2.786 1
1 921 . 13 1 1 A 80 80 GLU H H 80 7.793 8.232 -0.439 1
1 922 . 13 1 1 A 80 80 GLU HA H 80 4.082 3.940 0.142 1
1 927 . 13 1 1 A 80 80 GLU C C 80 179.068 179.079 -0.011 1
1 928 . 13 1 1 A 80 80 GLU CA C 80 59.735 59.941 -0.206 1
1 929 . 13 1 1 A 80 80 GLU CB C 80 28.722 29.131 -0.409 1
1 931 . 13 1 1 A 80 80 GLU N N 80 120.312 118.535 1.777 1
1 932 . 13 1 1 A 81 81 ASN H H 81 8.624 8.373 0.251 1
1 933 . 13 1 1 A 81 81 ASN HA H 81 4.521 4.446 0.075 1
1 938 . 13 1 1 A 81 81 ASN C C 81 179.262 177.408 1.854 1
1 939 . 13 1 1 A 81 81 ASN CA C 81 55.504 55.858 -0.354 1
1 940 . 13 1 1 A 81 81 ASN CB C 81 37.517 38.112 -0.595 1
1 941 . 13 1 1 A 81 81 ASN N N 81 119.338 117.818 1.520 1
1 943 . 13 1 1 A 82 82 CYS H H 82 8.554 8.259 0.295 1
1 944 . 13 1 1 A 82 82 CYS HA H 82 3.792 4.007 -0.215 1
1 947 . 13 1 1 A 82 82 CYS C C 82 176.478 176.776 -0.298 1
1 948 . 13 1 1 A 82 82 CYS CA C 82 65.232 61.985 3.247 1
1 949 . 13 1 1 A 82 82 CYS CB C 82 26.762 26.630 0.132 1
1 950 . 13 1 1 A 82 82 CYS N N 82 120.576 117.624 2.952 1
1 951 . 13 1 1 A 83 83 ARG H H 83 8.522 7.844 0.678 1
1 952 . 13 1 1 A 83 83 ARG HA H 83 3.932 4.128 -0.196 1
1 960 . 13 1 1 A 83 83 ARG C C 83 179.138 178.757 0.381 1
1 961 . 13 1 1 A 83 83 ARG CA C 83 60.443 58.938 1.505 1
1 962 . 13 1 1 A 83 83 ARG CB C 83 29.550 29.832 -0.282 1
1 965 . 13 1 1 A 83 83 ARG N N 83 123.035 120.354 2.681 1
1 967 . 13 1 1 A 84 84 ASP H H 84 7.791 7.961 -0.170 1
1 968 . 13 1 1 A 84 84 ASP HA H 84 4.353 4.352 0.001 1
1 971 . 13 1 1 A 84 84 ASP C C 84 178.649 178.851 -0.202 1
1 972 . 13 1 1 A 84 84 ASP CA C 84 57.767 57.641 0.126 1
1 973 . 13 1 1 A 84 84 ASP CB C 84 41.305 41.837 -0.532 1
1 974 . 13 1 1 A 84 84 ASP N N 84 120.332 119.538 0.794 1
1 975 . 13 1 1 A 85 85 THR H H 85 8.370 7.997 0.373 1
1 976 . 13 1 1 A 85 85 THR HA H 85 3.730 3.892 -0.162 1
1 981 . 13 1 1 A 85 85 THR C C 85 175.198 176.604 -1.406 1
1 982 . 13 1 1 A 85 85 THR CA C 85 66.830 66.338 0.492 1
1 983 . 13 1 1 A 85 85 THR CB C 85 68.533 68.394 0.139 1
1 985 . 13 1 1 A 85 85 THR N N 85 117.360 115.546 1.814 1
1 986 . 13 1 1 A 86 86 ALA H H 86 8.845 8.133 0.712 1
1 987 . 13 1 1 A 86 86 ALA HA H 86 3.991 4.153 -0.162 1
1 991 . 13 1 1 A 86 86 ALA C C 86 179.980 179.682 0.298 1
1 992 . 13 1 1 A 86 86 ALA CA C 86 55.769 55.104 0.665 1
1 993 . 13 1 1 A 86 86 ALA CB C 86 17.881 18.262 -0.381 1
1 994 . 13 1 1 A 86 86 ALA N N 86 123.613 123.637 -0.024 1
1 995 . 13 1 1 A 87 87 LYS H H 87 7.686 8.196 -0.510 1
1 996 . 13 1 1 A 87 87 LYS HA H 87 4.099 4.055 0.044 1
1 1005 . 13 1 1 A 87 87 LYS C C 87 179.592 178.816 0.776 1
1 1006 . 13 1 1 A 87 87 LYS CA C 87 59.708 59.144 0.564 1
1 1007 . 13 1 1 A 87 87 LYS CB C 87 32.054 31.842 0.212 1
1 1011 . 13 1 1 A 87 87 LYS N N 87 119.623 116.450 3.173 1
1 1012 . 13 1 1 A 88 88 ARG H H 88 7.683 7.661 0.022 1
1 1013 . 13 1 1 A 88 88 ARG HA H 88 4.051 4.166 -0.115 1
1 1020 . 13 1 1 A 88 88 ARG C C 88 180.053 178.603 1.450 1
1 1021 . 13 1 1 A 88 88 ARG CA C 88 59.558 58.945 0.613 1
1 1022 . 13 1 1 A 88 88 ARG CB C 88 29.684 29.956 -0.272 1
1 1025 . 13 1 1 A 88 88 ARG N N 88 120.788 119.546 1.242 1
1 1026 . 13 1 1 A 89 89 ASN H H 89 8.973 8.008 0.965 1
1 1027 . 13 1 1 A 89 89 ASN HA H 89 4.354 4.605 -0.251 1
1 1032 . 13 1 1 A 89 89 ASN C C 89 178.382 178.392 -0.010 1
1 1033 . 13 1 1 A 89 89 ASN CA C 89 55.334 55.988 -0.654 1
1 1034 . 13 1 1 A 89 89 ASN CB C 89 37.864 37.956 -0.092 1
1 1035 . 13 1 1 A 89 89 ASN N N 89 121.012 117.781 3.231 1
1 1037 . 13 1 1 A 90 90 GLN H H 90 8.152 8.041 0.111 1
1 1038 . 13 1 1 A 90 90 GLN HA H 90 4.020 4.168 -0.148 1
1 1045 . 13 1 1 A 90 90 GLN C C 90 179.075 178.870 0.205 1
1 1046 . 13 1 1 A 90 90 GLN CA C 90 59.318 58.816 0.502 1
1 1047 . 13 1 1 A 90 90 GLN CB C 90 28.049 28.649 -0.600 1
1 1049 . 13 1 1 A 90 90 GLN N N 90 122.122 120.904 1.218 1
1 1051 . 13 1 1 A 91 91 GLN H H 91 7.514 8.765 -1.251 1
1 1052 . 13 1 1 A 91 91 GLN HA H 91 4.053 4.091 -0.038 1
1 1059 . 13 1 1 A 91 91 GLN C C 91 177.081 177.115 -0.034 1
1 1060 . 13 1 1 A 91 91 GLN CA C 91 58.031 58.305 -0.274 1
1 1061 . 13 1 1 A 91 91 GLN CB C 91 28.365 28.012 0.353 1
1 1063 . 13 1 1 A 91 91 GLN N N 91 118.124 117.808 0.316 1
1 1065 . 13 1 1 A 92 92 ALA H H 92 7.704 7.256 0.448 1
1 1066 . 13 1 1 A 92 92 ALA HA H 92 4.246 4.454 -0.208 1
1 1070 . 13 1 1 A 92 92 ALA C C 92 178.450 178.064 0.386 1
1 1071 . 13 1 1 A 92 92 ALA CA C 92 52.671 51.842 0.829 1
1 1072 . 13 1 1 A 92 92 ALA CB C 92 19.316 19.381 -0.065 1
1 1073 . 13 1 1 A 92 92 ALA N N 92 119.880 120.322 -0.442 1
1 1074 . 13 1 1 A 93 93 GLY H H 93 7.693 8.058 -0.365 1
1 1075 . 13 1 1 A 93 93 GLY HA2 H 93 3.941 3.894 0.047 1
1 1076 . 13 1 1 A 93 93 GLY HA3 H 93 3.744 3.903 -0.159 1
1 1077 . 13 1 1 A 93 93 GLY C C 93 174.344 175.351 -1.007 1
1 1078 . 13 1 1 A 93 93 GLY CA C 93 45.949 46.901 -0.952 1
1 1079 . 13 1 1 A 93 93 GLY N N 93 105.347 107.553 -2.206 1
1 1080 . 13 1 1 A 94 94 ASN H H 94 7.076 9.108 -2.032 1
1 1081 . 13 1 1 A 94 94 ASN HA H 94 4.115 4.741 -0.626 1
1 1085 . 13 1 1 A 94 94 ASN C C 94 175.410 175.359 0.051 1
1 1086 . 13 1 1 A 94 94 ASN CA C 94 52.651 53.045 -0.394 1
1 1087 . 13 1 1 A 94 94 ASN CB C 94 38.330 39.063 -0.733 1
1 1088 . 13 1 1 A 94 94 ASN N N 94 115.747 117.074 -1.327 1
1 1090 . 13 1 1 A 95 95 GLY H H 95 8.236 8.356 -0.120 1
1 1091 . 13 1 1 A 95 95 GLY HA2 H 95 3.633 3.442 0.191 1
1 1092 . 13 1 1 A 95 95 GLY HA3 H 95 3.633 3.700 -0.067 1
1 1093 . 13 1 1 A 95 95 GLY C C 95 174.450 173.307 1.143 1
1 1094 . 13 1 1 A 95 95 GLY CA C 95 45.522 44.934 0.588 1
1 1095 . 13 1 1 A 95 95 GLY N N 95 109.166 106.361 2.805 1
1 1096 . 13 1 1 A 96 96 TRP H H 96 7.899 7.917 -0.018 1
1 1097 . 13 1 1 A 96 96 TRP HA H 96 5.241 5.179 0.062 1
1 1106 . 13 1 1 A 96 96 TRP C C 96 175.661 175.240 0.421 1
1 1107 . 13 1 1 A 96 96 TRP CA C 96 55.090 56.175 -1.085 1
1 1108 . 13 1 1 A 96 96 TRP CB C 96 27.138 33.361 -6.223 1
1 1114 . 13 1 1 A 96 96 TRP N N 96 122.840 120.538 2.302 1
1 1116 . 13 1 1 A 97 97 ASP H H 97 7.344 9.068 -1.724 1
1 1117 . 13 1 1 A 97 97 ASP HA H 97 4.829 5.129 -0.300 1
1 1120 . 13 1 1 A 97 97 ASP C C 97 175.019 176.288 -1.269 1
1 1121 . 13 1 1 A 97 97 ASP CA C 97 52.149 53.200 -1.051 1
1 1122 . 13 1 1 A 97 97 ASP CB C 97 42.697 42.714 -0.017 1
1 1123 . 13 1 1 A 97 97 ASP N N 97 126.861 119.343 7.518 1
1 1124 . 13 1 1 A 98 98 PHE H H 98 8.566 9.244 -0.678 1
1 1125 . 13 1 1 A 98 98 PHE HA H 98 3.727 4.343 -0.616 1
1 1133 . 13 1 1 A 98 98 PHE C C 98 177.443 177.193 0.250 1
1 1134 . 13 1 1 A 98 98 PHE CA C 98 62.471 59.755 2.716 1
1 1135 . 13 1 1 A 98 98 PHE CB C 98 39.919 37.844 2.075 1
1 1141 . 13 1 1 A 98 98 PHE N N 98 117.781 117.570 0.211 1
1 1142 . 13 1 1 A 99 99 ASP H H 99 8.259 8.083 0.176 1
1 1143 . 13 1 1 A 99 99 ASP HA H 99 3.960 3.877 0.083 1
1 1146 . 13 1 1 A 99 99 ASP C C 99 178.132 178.335 -0.203 1
1 1147 . 13 1 1 A 99 99 ASP CA C 99 57.658 56.987 0.671 1
1 1148 . 13 1 1 A 99 99 ASP CB C 99 38.572 40.128 -1.556 1
1 1149 . 13 1 1 A 99 99 ASP N N 99 121.709 121.228 0.481 1
1 1150 . 13 1 1 A 100 100 MET H H 100 8.008 8.005 0.003 1
1 1151 . 13 1 1 A 100 100 MET HA H 100 3.644 4.167 -0.523 1
1 1156 . 13 1 1 A 100 100 MET C C 100 180.008 177.529 2.479 1
1 1157 . 13 1 1 A 100 100 MET CA C 100 58.598 58.294 0.304 1
1 1158 . 13 1 1 A 100 100 MET CB C 100 33.423 33.351 0.072 1
1 1160 . 13 1 1 A 100 100 MET N N 100 119.668 117.394 2.274 1
1 1161 . 13 1 1 A 101 101 LEU H H 101 7.961 8.222 -0.261 1
1 1162 . 13 1 1 A 101 101 LEU HA H 101 3.523 4.202 -0.679 1
1 1172 . 13 1 1 A 101 101 LEU C C 101 173.873 176.164 -2.291 1
1 1173 . 13 1 1 A 101 101 LEU CA C 101 58.743 54.282 4.461 1
1 1174 . 13 1 1 A 101 101 LEU CB C 101 42.632 41.200 1.432 1
1 1178 . 13 1 1 A 101 101 LEU N N 101 119.752 119.251 0.501 1
1 1179 . 13 1 1 A 102 102 THR H H 102 6.955 8.284 -1.329 1
1 1180 . 13 1 1 A 102 102 THR HA H 102 4.134 4.295 -0.161 1
1 1185 . 13 1 1 A 102 102 THR C C 102 176.513 175.223 1.290 1
1 1186 . 13 1 1 A 102 102 THR CA C 102 61.125 62.150 -1.025 1
1 1187 . 13 1 1 A 102 102 THR CB C 102 71.415 70.552 0.863 1
1 1189 . 13 1 1 A 102 102 THR N N 102 124.665 116.452 8.213 1
1 1190 . 13 1 1 A 103 103 GLY H H 103 7.816 8.137 -0.321 1
1 1191 . 13 1 1 A 103 103 GLY HA2 H 103 3.824 3.989 -0.165 1
1 1192 . 13 1 1 A 103 103 GLY HA3 H 103 3.824 4.033 -0.209 1
1 1193 . 13 1 1 A 103 103 GLY C C 103 174.126 175.096 -0.970 1
1 1194 . 13 1 1 A 103 103 GLY CA C 103 47.805 46.337 1.468 1
1 1195 . 13 1 1 A 103 103 GLY N N 103 114.191 111.310 2.881 1
1 1196 . 13 1 1 A 104 104 SER H H 104 8.860 8.065 0.795 1
1 1197 . 13 1 1 A 104 104 SER HA H 104 4.758 4.357 0.401 1
1 1200 . 13 1 1 A 104 104 SER C C 104 174.591 174.741 -0.150 1
1 1201 . 13 1 1 A 104 104 SER CA C 104 56.755 58.959 -2.204 1
1 1202 . 13 1 1 A 104 104 SER CB C 104 65.050 63.861 1.189 1
1 1203 . 13 1 1 A 104 104 SER N N 104 114.771 116.286 -1.515 1
1 1204 . 13 1 1 A 105 105 GLY H H 105 8.788 7.532 1.256 1
1 1205 . 13 1 1 A 105 105 GLY HA2 H 105 3.733 3.905 -0.172 1
1 1206 . 13 1 1 A 105 105 GLY HA3 H 105 3.733 3.926 -0.193 1
1 1207 . 13 1 1 A 105 105 GLY CA C 105 47.247 46.389 0.858 1
1 1208 . 13 1 1 A 105 105 GLY N N 105 110.394 108.615 1.779 1
1 1209 . 13 1 1 A 106 106 ASN HA H 106 4.454 4.563 -0.109 1
1 1212 . 13 1 1 A 106 106 ASN C C 106 175.180 175.752 -0.572 1
1 1213 . 13 1 1 A 106 106 ASN CA C 106 54.492 54.986 -0.494 1
1 1214 . 13 1 1 A 106 106 ASN CB C 106 37.282 39.476 -2.194 1
1 1215 . 13 1 1 A 107 107 TYR H H 107 8.241 7.594 0.647 1
1 1216 . 13 1 1 A 107 107 TYR HA H 107 4.335 4.925 -0.590 1
1 1223 . 13 1 1 A 107 107 TYR C C 107 173.954 176.337 -2.383 1
1 1224 . 13 1 1 A 107 107 TYR CA C 107 57.727 56.993 0.734 1
1 1225 . 13 1 1 A 107 107 TYR CB C 107 37.063 39.951 -2.888 1
1 1230 . 13 1 1 A 107 107 TYR N N 107 120.708 114.488 6.220 1
1 1231 . 13 1 1 A 108 108 SER H H 108 7.117 7.382 -0.265 1
1 1232 . 13 1 1 A 108 108 SER HA H 108 4.221 4.729 -0.508 1
1 1235 . 13 1 1 A 108 108 SER C C 108 174.834 174.181 0.653 1
1 1236 . 13 1 1 A 108 108 SER CA C 108 59.859 59.300 0.559 1
1 1237 . 13 1 1 A 108 108 SER CB C 108 63.846 64.519 -0.673 1
1 1238 . 13 1 1 A 108 108 SER N N 108 113.362 113.589 -0.227 1
1 1239 . 13 1 1 A 109 109 SER H H 109 8.053 8.187 -0.134 1
1 1240 . 13 1 1 A 109 109 SER HA H 109 4.560 4.402 0.158 1
1 1243 . 13 1 1 A 109 109 SER CA C 109 57.141 59.347 -2.206 1
1 1244 . 13 1 1 A 109 109 SER CB C 109 64.874 63.035 1.839 1
1 1245 . 13 1 1 A 109 109 SER N N 109 116.657 115.522 1.135 1
1 1246 . 13 1 1 A 110 110 THR HA H 110 3.541 4.151 -0.610 1
1 1251 . 13 1 1 A 110 110 THR C C 110 175.477 176.716 -1.239 1
1 1252 . 13 1 1 A 110 110 THR CA C 110 66.443 65.608 0.835 1
1 1253 . 13 1 1 A 110 110 THR CB C 110 68.091 68.357 -0.266 1
1 1255 . 13 1 1 A 111 111 ASP H H 111 8.224 8.000 0.224 1
1 1256 . 13 1 1 A 111 111 ASP HA H 111 4.237 4.413 -0.176 1
1 1259 . 13 1 1 A 111 111 ASP C C 111 177.520 178.752 -1.232 1
1 1260 . 13 1 1 A 111 111 ASP CA C 111 57.559 57.326 0.233 1
1 1261 . 13 1 1 A 111 111 ASP CB C 111 40.292 40.242 0.050 1
1 1262 . 13 1 1 A 111 111 ASP N N 111 119.490 120.690 -1.200 1
1 1263 . 13 1 1 A 112 112 ALA H H 112 7.431 8.522 -1.091 1
1 1264 . 13 1 1 A 112 112 ALA HA H 112 4.191 4.139 0.052 1
1 1268 . 13 1 1 A 112 112 ALA C C 112 180.646 179.705 0.941 1
1 1269 . 13 1 1 A 112 112 ALA CA C 112 54.534 54.537 -0.003 1
1 1270 . 13 1 1 A 112 112 ALA CB C 112 18.992 18.626 0.366 1
1 1271 . 13 1 1 A 112 112 ALA N N 112 119.710 122.690 -2.980 1
1 1272 . 13 1 1 A 113 113 GLN H H 113 7.576 7.927 -0.351 1
1 1273 . 13 1 1 A 113 113 GLN HA H 113 3.562 4.245 -0.683 1
1 1278 . 13 1 1 A 113 113 GLN C C 113 176.756 178.119 -1.363 1
1 1279 . 13 1 1 A 113 113 GLN CA C 113 57.736 58.711 -0.975 1
1 1280 . 13 1 1 A 113 113 GLN CB C 113 29.110 28.694 0.416 1
1 1281 . 13 1 1 A 113 113 GLN N N 113 117.518 118.552 -1.034 1
1 1283 . 13 1 1 A 114 114 MET H H 114 8.192 8.156 0.036 1
1 1284 . 13 1 1 A 114 114 MET HA H 114 4.231 4.300 -0.069 1
1 1289 . 13 1 1 A 114 114 MET C C 114 175.648 177.754 -2.106 1
1 1290 . 13 1 1 A 114 114 MET CA C 114 57.446 58.176 -0.730 1
1 1291 . 13 1 1 A 114 114 MET CB C 114 33.570 32.248 1.322 1
1 1293 . 13 1 1 A 114 114 MET N N 114 111.509 119.282 -7.773 1
1 1294 . 13 1 1 A 115 115 GLN H H 115 6.940 7.931 -0.991 1
1 1295 . 13 1 1 A 115 115 GLN HA H 115 4.307 4.580 -0.273 1
1 1302 . 13 1 1 A 115 115 GLN C C 115 176.270 175.842 0.428 1
1 1303 . 13 1 1 A 115 115 GLN CA C 115 54.680 55.027 -0.347 1
1 1304 . 13 1 1 A 115 115 GLN CB C 115 28.233 29.325 -1.092 1
1 1306 . 13 1 1 A 115 115 GLN N N 115 114.300 116.502 -2.202 1
1 1308 . 13 1 1 A 116 116 TYR H H 116 6.677 7.705 -1.028 1
1 1309 . 13 1 1 A 116 116 TYR HA H 116 4.193 4.782 -0.589 1
1 1312 . 13 1 1 A 116 116 TYR C C 116 175.268 175.511 -0.243 1
1 1313 . 13 1 1 A 116 116 TYR CA C 116 54.357 61.206 -6.849 1
1 1314 . 13 1 1 A 116 116 TYR CB C 116 35.498 37.732 -2.234 1
1 1315 . 13 1 1 A 116 116 TYR N N 116 117.919 120.469 -2.550 1
1 1316 . 13 1 1 A 117 117 ASP H H 117 8.081 7.287 0.794 1
1 1317 . 13 1 1 A 117 117 ASP HA H 117 4.665 4.510 0.155 1
1 1320 . 13 1 1 A 117 117 ASP CA C 117 52.422 54.736 -2.314 1
1 1321 . 13 1 1 A 117 117 ASP CB C 117 42.416 39.973 2.443 1
1 1322 . 13 1 1 A 117 117 ASP N N 117 120.887 119.467 1.420 1
1 1323 . 13 1 1 A 118 118 PRO C C 118 179.180 178.245 0.935 1
1 1324 . 13 1 1 A 118 118 PRO CA C 118 65.942 64.885 1.057 1
1 1325 . 13 1 1 A 118 118 PRO CB C 118 32.197 31.925 0.272 1
1 1326 . 13 1 1 A 119 119 GLY H H 119 9.742 8.282 1.460 1
1 1327 . 13 1 1 A 119 119 GLY C C 119 175.622 174.998 0.624 1
1 1328 . 13 1 1 A 119 119 GLY CA C 119 46.785 46.451 0.334 1
1 1329 . 13 1 1 A 119 119 GLY N N 119 106.412 106.564 -0.152 1
1 1330 . 13 1 1 A 120 120 LEU H H 120 6.666 7.564 -0.898 1
1 1331 . 13 1 1 A 120 120 LEU HA H 120 3.365 3.350 0.015 1
1 1341 . 13 1 1 A 120 120 LEU C C 120 179.262 178.355 0.907 1
1 1342 . 13 1 1 A 120 120 LEU CA C 120 56.605 56.845 -0.240 1
1 1343 . 13 1 1 A 120 120 LEU CB C 120 39.262 41.385 -2.123 1
1 1347 . 13 1 1 A 120 120 LEU N N 120 126.226 122.152 4.074 1
1 1348 . 13 1 1 A 121 121 PHE H H 121 7.356 8.366 -1.010 1
1 1349 . 13 1 1 A 121 121 PHE HA H 121 4.459 3.939 0.520 1
1 1352 . 13 1 1 A 121 121 PHE C C 121 179.716 177.970 1.746 1
1 1353 . 13 1 1 A 121 121 PHE CA C 121 62.838 62.118 0.720 1
1 1354 . 13 1 1 A 121 121 PHE CB C 121 37.603 39.405 -1.802 1
1 1355 . 13 1 1 A 121 121 PHE N N 121 117.437 119.518 -2.081 1
1 1356 . 13 1 1 A 122 122 ALA H H 122 7.926 8.014 -0.088 1
1 1357 . 13 1 1 A 122 122 ALA HA H 122 4.523 3.942 0.581 1
1 1361 . 13 1 1 A 122 122 ALA C C 122 180.435 179.400 1.035 1
1 1362 . 13 1 1 A 122 122 ALA CA C 122 55.527 55.074 0.453 1
1 1363 . 13 1 1 A 122 122 ALA CB C 122 17.814 18.209 -0.395 1
1 1364 . 13 1 1 A 122 122 ALA N N 122 121.068 121.504 -0.436 1
1 1365 . 13 1 1 A 123 123 GLN H H 123 7.507 7.340 0.167 1
1 1366 . 13 1 1 A 123 123 GLN HA H 123 4.153 3.917 0.236 1
1 1371 . 13 1 1 A 123 123 GLN C C 123 180.561 178.392 2.169 1
1 1372 . 13 1 1 A 123 123 GLN CA C 123 59.948 58.825 1.123 1
1 1373 . 13 1 1 A 123 123 GLN CB C 123 29.135 28.267 0.868 1
1 1375 . 13 1 1 A 123 123 GLN N N 123 120.324 117.935 2.389 1
1 1376 . 13 1 1 A 124 124 ILE H H 124 8.318 8.161 0.157 1
1 1377 . 13 1 1 A 124 124 ILE HA H 124 3.635 3.494 0.141 1
1 1387 . 13 1 1 A 124 124 ILE C C 124 176.481 177.724 -1.243 1
1 1388 . 13 1 1 A 124 124 ILE CA C 124 66.432 64.026 2.406 1
1 1389 . 13 1 1 A 124 124 ILE CB C 124 39.168 37.843 1.325 1
1 1393 . 13 1 1 A 124 124 ILE N N 124 123.747 121.028 2.719 1
1 1394 . 13 1 1 A 125 125 GLN H H 125 8.474 8.088 0.386 1
1 1395 . 13 1 1 A 125 125 GLN HA H 125 4.264 4.034 0.230 1
1 1402 . 13 1 1 A 125 125 GLN C C 125 178.947 177.826 1.121 1
1 1403 . 13 1 1 A 125 125 GLN CA C 125 59.651 58.249 1.402 1
1 1404 . 13 1 1 A 125 125 GLN CB C 125 28.880 28.345 0.535 1
1 1406 . 13 1 1 A 125 125 GLN N N 125 120.368 119.571 0.797 1
1 1408 . 13 1 1 A 126 126 ALA H H 126 8.002 7.638 0.364 1
1 1409 . 13 1 1 A 126 126 ALA HA H 126 4.144 4.099 0.045 1
1 1413 . 13 1 1 A 126 126 ALA C C 126 179.316 180.027 -0.711 1
1 1414 . 13 1 1 A 126 126 ALA CA C 126 55.036 54.757 0.279 1
1 1415 . 13 1 1 A 126 126 ALA CB C 126 18.087 18.018 0.069 1
1 1416 . 13 1 1 A 126 126 ALA N N 126 121.661 121.235 0.426 1
1 1417 . 13 1 1 A 127 127 ALA H H 127 7.823 7.623 0.200 1
1 1418 . 13 1 1 A 127 127 ALA HA H 127 4.162 4.122 0.040 1
1 1422 . 13 1 1 A 127 127 ALA C C 127 180.707 179.195 1.512 1
1 1423 . 13 1 1 A 127 127 ALA CA C 127 55.080 54.877 0.203 1
1 1424 . 13 1 1 A 127 127 ALA CB C 127 19.354 18.354 1.000 1
1 1425 . 13 1 1 A 127 127 ALA N N 127 119.853 119.688 0.165 1
1 1426 . 13 1 1 A 128 128 ALA H H 128 8.936 8.005 0.931 1
1 1427 . 13 1 1 A 128 128 ALA HA H 128 3.928 4.182 -0.254 1
1 1431 . 13 1 1 A 128 128 ALA C C 128 181.031 179.350 1.681 1
1 1432 . 13 1 1 A 128 128 ALA CA C 128 55.502 54.866 0.636 1
1 1433 . 13 1 1 A 128 128 ALA CB C 128 16.609 17.350 -0.741 1
1 1434 . 13 1 1 A 128 128 ALA N N 128 121.355 120.667 0.688 1
1 1435 . 13 1 1 A 129 129 THR H H 129 8.543 8.202 0.341 1
1 1436 . 13 1 1 A 129 129 THR HA H 129 4.015 3.977 0.038 1
1 1441 . 13 1 1 A 129 129 THR C C 129 177.332 176.630 0.702 1
1 1442 . 13 1 1 A 129 129 THR CA C 129 65.893 65.046 0.847 1
1 1443 . 13 1 1 A 129 129 THR CB C 129 68.566 68.425 0.141 1
1 1445 . 13 1 1 A 129 129 THR N N 129 112.709 110.663 2.046 1
1 1446 . 13 1 1 A 130 130 LYS H H 130 8.126 7.609 0.517 1
1 1447 . 13 1 1 A 130 130 LYS HA H 130 4.000 4.042 -0.042 1
1 1456 . 13 1 1 A 130 130 LYS C C 130 179.082 178.852 0.230 1
1 1457 . 13 1 1 A 130 130 LYS CA C 130 60.299 58.647 1.652 1
1 1458 . 13 1 1 A 130 130 LYS CB C 130 32.767 32.013 0.754 1
1 1462 . 13 1 1 A 130 130 LYS N N 130 123.879 121.940 1.939 1
1 1463 . 13 1 1 A 131 131 ALA H H 131 7.184 7.855 -0.671 1
1 1464 . 13 1 1 A 131 131 ALA HA H 131 4.005 4.268 -0.263 1
1 1468 . 13 1 1 A 131 131 ALA C C 131 178.482 179.634 -1.152 1
1 1469 . 13 1 1 A 131 131 ALA CA C 131 55.027 55.268 -0.241 1
1 1470 . 13 1 1 A 131 131 ALA CB C 131 18.669 19.364 -0.695 1
1 1471 . 13 1 1 A 131 131 ALA N N 131 118.590 121.461 -2.871 1
1 1472 . 13 1 1 A 132 132 TRP H H 132 7.977 8.870 -0.893 1
1 1473 . 13 1 1 A 132 132 TRP HA H 132 4.001 4.237 -0.236 1
1 1480 . 13 1 1 A 132 132 TRP C C 132 177.332 175.868 1.464 1
1 1481 . 13 1 1 A 132 132 TRP CA C 132 60.431 57.452 2.979 1
1 1482 . 13 1 1 A 132 132 TRP CB C 132 27.786 27.861 -0.075 1
1 1486 . 13 1 1 A 132 132 TRP N N 132 119.168 117.135 2.033 1
1 1488 . 13 1 1 A 133 133 ARG H H 133 8.006 8.064 -0.058 1
1 1489 . 13 1 1 A 133 133 ARG HA H 133 4.027 4.465 -0.438 1
1 1497 . 13 1 1 A 133 133 ARG C C 133 176.664 178.104 -1.440 1
1 1498 . 13 1 1 A 133 133 ARG CA C 133 59.355 57.119 2.236 1
1 1499 . 13 1 1 A 133 133 ARG CB C 133 30.451 32.495 -2.044 1
1 1502 . 13 1 1 A 133 133 ARG N N 133 113.062 120.729 -7.667 1
1 1504 . 13 1 1 A 134 134 LYS H H 134 7.322 7.860 -0.538 1
1 1505 . 13 1 1 A 134 134 LYS HA H 134 4.313 4.375 -0.062 1
1 1514 . 13 1 1 A 134 134 LYS C C 134 176.282 176.138 0.144 1
1 1515 . 13 1 1 A 134 134 LYS CA C 134 54.922 56.604 -1.682 1
1 1516 . 13 1 1 A 134 134 LYS CB C 134 32.633 32.004 0.629 1
1 1520 . 13 1 1 A 134 134 LYS N N 134 118.170 116.485 1.685 1
1 1521 . 13 1 1 A 135 135 LEU H H 135 7.440 7.325 0.115 1
1 1522 . 13 1 1 A 135 135 LEU HA H 135 4.174 4.583 -0.409 1
1 1532 . 13 1 1 A 135 135 LEU CA C 135 54.408 53.059 1.349 1
1 1533 . 13 1 1 A 135 135 LEU CB C 135 40.407 40.787 -0.380 1
1 1537 . 13 1 1 A 135 135 LEU N N 135 123.358 122.620 0.738 1
1 1538 . 13 1 1 A 136 136 PRO HA H 136 4.437 4.582 -0.145 1
1 1545 . 13 1 1 A 136 136 PRO C C 136 177.106 176.422 0.684 1
1 1546 . 13 1 1 A 136 136 PRO CA C 136 62.889 62.568 0.321 1
1 1547 . 13 1 1 A 136 136 PRO CB C 136 32.192 32.143 0.049 1
1 1550 . 13 1 1 A 137 137 VAL H H 137 8.219 8.396 -0.177 1
1 1551 . 13 1 1 A 137 137 VAL HA H 137 4.077 4.783 -0.706 1
1 1559 . 13 1 1 A 137 137 VAL C C 137 176.305 175.412 0.893 1
1 1560 . 13 1 1 A 137 137 VAL CA C 137 61.958 62.184 -0.226 1
1 1561 . 13 1 1 A 137 137 VAL CB C 137 32.755 32.794 -0.039 1
1 1564 . 13 1 1 A 137 137 VAL N N 137 120.079 122.306 -2.227 1
1 1565 . 13 1 1 A 138 138 LYS H H 138 8.444 8.969 -0.525 1
1 1566 . 13 1 1 A 138 138 LYS HA H 138 4.316 4.440 -0.124 1
1 1575 . 13 1 1 A 138 138 LYS C C 138 176.790 176.736 0.054 1
1 1576 . 13 1 1 A 138 138 LYS CA C 138 56.792 57.304 -0.512 1
1 1577 . 13 1 1 A 138 138 LYS CB C 138 33.205 34.501 -1.296 1
1 1581 . 13 1 1 A 138 138 LYS N N 138 126.449 127.636 -1.187 1
1 1582 . 13 1 1 A 139 139 GLY H H 139 8.518 7.090 1.428 1
1 1583 . 13 1 1 A 139 139 GLY HA2 H 139 4.070 4.074 -0.004 1
1 1584 . 13 1 1 A 139 139 GLY HA3 H 139 3.897 4.107 -0.210 1
1 1585 . 13 1 1 A 139 139 GLY C C 139 172.874 172.018 0.856 1
1 1586 . 13 1 1 A 139 139 GLY CA C 139 45.157 45.504 -0.347 1
1 1587 . 13 1 1 A 139 139 GLY N N 139 112.617 105.933 6.684 1
1 6 . 14 1 1 A 2 2 VAL H H 2 8.992 8.275 0.717 1
1 7 . 14 1 1 A 2 2 VAL HA H 2 5.370 4.874 0.496 1
1 15 . 14 1 1 A 2 2 VAL C C 2 174.325 174.593 -0.268 1
1 16 . 14 1 1 A 2 2 VAL CA C 2 61.267 60.465 0.802 1
1 17 . 14 1 1 A 2 2 VAL CB C 2 33.890 35.444 -1.554 1
1 20 . 14 1 1 A 2 2 VAL N N 2 126.939 119.730 7.209 1
1 21 . 14 1 1 A 3 3 THR H H 3 8.912 8.999 -0.087 1
1 22 . 14 1 1 A 3 3 THR HA H 3 4.505 5.278 -0.773 1
1 27 . 14 1 1 A 3 3 THR C C 3 172.710 172.974 -0.264 1
1 28 . 14 1 1 A 3 3 THR CA C 3 59.689 59.877 -0.188 1
1 29 . 14 1 1 A 3 3 THR CB C 3 72.398 72.075 0.323 1
1 31 . 14 1 1 A 3 3 THR N N 3 118.091 121.571 -3.480 1
1 32 . 14 1 1 A 4 4 GLU H H 4 8.631 9.133 -0.502 1
1 33 . 14 1 1 A 4 4 GLU HA H 4 5.788 5.266 0.522 1
1 38 . 14 1 1 A 4 4 GLU C C 4 175.758 174.633 1.125 1
1 39 . 14 1 1 A 4 4 GLU CA C 4 54.902 54.528 0.374 1
1 40 . 14 1 1 A 4 4 GLU CB C 4 35.097 33.815 1.282 1
1 42 . 14 1 1 A 4 4 GLU N N 4 120.966 123.179 -2.213 1
1 43 . 14 1 1 A 5 5 THR H H 5 9.188 8.429 0.759 1
1 44 . 14 1 1 A 5 5 THR HA H 5 4.739 5.058 -0.319 1
1 49 . 14 1 1 A 5 5 THR C C 5 172.757 172.675 0.082 1
1 50 . 14 1 1 A 5 5 THR CA C 5 60.382 60.296 0.086 1
1 51 . 14 1 1 A 5 5 THR CB C 5 71.558 70.801 0.757 1
1 53 . 14 1 1 A 5 5 THR N N 5 119.366 114.689 4.677 1
1 54 . 14 1 1 A 6 6 VAL H H 6 8.476 8.970 -0.494 1
1 55 . 14 1 1 A 6 6 VAL HA H 6 5.026 5.042 -0.016 1
1 63 . 14 1 1 A 6 6 VAL C C 6 176.674 173.969 2.705 1
1 64 . 14 1 1 A 6 6 VAL CA C 6 61.008 58.929 2.079 1
1 65 . 14 1 1 A 6 6 VAL CB C 6 33.861 34.966 -1.105 1
1 68 . 14 1 1 A 6 6 VAL N N 6 121.384 122.341 -0.957 1
1 69 . 14 1 1 A 7 7 ASP H H 7 8.848 8.698 0.150 1
1 70 . 14 1 1 A 7 7 ASP HA H 7 4.797 4.567 0.230 1
1 73 . 14 1 1 A 7 7 ASP CA C 7 52.834 54.598 -1.764 1
1 74 . 14 1 1 A 7 7 ASP CB C 7 42.219 42.638 -0.419 1
1 75 . 14 1 1 A 7 7 ASP N N 7 127.061 125.120 1.941 1
1 76 . 14 1 1 A 8 8 GLY C C 8 175.143 175.193 -0.050 1
1 77 . 14 1 1 A 8 8 GLY CA C 8 46.553 47.014 -0.461 1
1 78 . 14 1 1 A 9 9 GLN H H 9 8.408 7.872 0.536 1
1 79 . 14 1 1 A 9 9 GLN HA H 9 4.541 4.255 0.286 1
1 86 . 14 1 1 A 9 9 GLN C C 9 176.463 176.624 -0.161 1
1 87 . 14 1 1 A 9 9 GLN CA C 9 55.167 55.415 -0.248 1
1 88 . 14 1 1 A 9 9 GLN CB C 9 29.376 27.888 1.488 1
1 90 . 14 1 1 A 9 9 GLN N N 9 118.300 117.377 0.923 1
1 92 . 14 1 1 A 10 10 GLY H H 10 8.162 8.311 -0.149 1
1 93 . 14 1 1 A 10 10 GLY HA2 H 10 4.174 3.954 0.220 1
1 94 . 14 1 1 A 10 10 GLY HA3 H 10 3.521 3.956 -0.435 1
1 95 . 14 1 1 A 10 10 GLY C C 10 174.092 174.375 -0.283 1
1 96 . 14 1 1 A 10 10 GLY CA C 10 45.558 45.633 -0.075 1
1 97 . 14 1 1 A 10 10 GLY N N 10 108.747 110.001 -1.254 1
1 98 . 14 1 1 A 11 11 GLN H H 11 8.507 7.946 0.561 1
1 99 . 14 1 1 A 11 11 GLN HA H 11 4.202 4.722 -0.520 1
1 106 . 14 1 1 A 11 11 GLN C C 11 173.992 174.841 -0.849 1
1 107 . 14 1 1 A 11 11 GLN CA C 11 55.098 54.764 0.334 1
1 108 . 14 1 1 A 11 11 GLN CB C 11 29.097 30.637 -1.540 1
1 110 . 14 1 1 A 11 11 GLN N N 11 122.979 118.525 4.454 1
1 112 . 14 1 1 A 12 12 ALA H H 12 8.259 8.759 -0.500 1
1 113 . 14 1 1 A 12 12 ALA HA H 12 5.156 5.684 -0.528 1
1 117 . 14 1 1 A 12 12 ALA C C 12 177.284 176.129 1.155 1
1 118 . 14 1 1 A 12 12 ALA CA C 12 51.087 50.203 0.884 1
1 119 . 14 1 1 A 12 12 ALA CB C 12 20.500 22.713 -2.213 1
1 120 . 14 1 1 A 12 12 ALA N N 12 127.100 122.842 4.258 1
1 121 . 14 1 1 A 13 13 TRP H H 13 9.245 9.650 -0.405 1
1 122 . 14 1 1 A 13 13 TRP HA H 13 4.717 5.394 -0.677 1
1 131 . 14 1 1 A 13 13 TRP C C 13 175.108 175.253 -0.145 1
1 132 . 14 1 1 A 13 13 TRP CA C 13 55.966 56.053 -0.087 1
1 133 . 14 1 1 A 13 13 TRP CB C 13 31.912 33.330 -1.418 1
1 139 . 14 1 1 A 13 13 TRP N N 13 123.088 120.867 2.221 1
1 141 . 14 1 1 A 14 14 ARG H H 14 8.575 8.899 -0.324 1
1 142 . 14 1 1 A 14 14 ARG HA H 14 5.335 5.048 0.287 1
1 150 . 14 1 1 A 14 14 ARG C C 14 175.191 174.385 0.806 1
1 151 . 14 1 1 A 14 14 ARG CA C 14 53.106 54.894 -1.788 1
1 152 . 14 1 1 A 14 14 ARG CB C 14 32.749 34.070 -1.321 1
1 154 . 14 1 1 A 14 14 ARG N N 14 121.163 121.664 -0.501 1
1 156 . 14 1 1 A 15 15 HIS H H 15 8.595 9.173 -0.578 1
1 157 . 14 1 1 A 15 15 HIS HA H 15 4.790 5.393 -0.603 1
1 161 . 14 1 1 A 15 15 HIS C C 15 173.770 174.343 -0.573 1
1 162 . 14 1 1 A 15 15 HIS CA C 15 55.289 53.880 1.409 1
1 163 . 14 1 1 A 15 15 HIS CB C 15 33.208 32.666 0.542 1
1 165 . 14 1 1 A 15 15 HIS N N 15 117.643 124.504 -6.861 1
1 166 . 14 1 1 A 16 16 HIS H H 16 8.993 9.131 -0.138 1
1 167 . 14 1 1 A 16 16 HIS HA H 16 5.158 4.866 0.292 1
1 171 . 14 1 1 A 16 16 HIS C C 16 173.608 173.926 -0.318 1
1 172 . 14 1 1 A 16 16 HIS CA C 16 56.450 55.626 0.824 1
1 173 . 14 1 1 A 16 16 HIS CB C 16 34.171 31.491 2.680 1
1 175 . 14 1 1 A 16 16 HIS N N 16 123.520 124.450 -0.930 1
1 176 . 14 1 1 A 17 17 ASN H H 17 7.829 8.792 -0.963 1
1 177 . 14 1 1 A 17 17 ASN HA H 17 4.713 5.213 -0.500 1
1 182 . 14 1 1 A 17 17 ASN C C 17 173.682 175.141 -1.459 1
1 183 . 14 1 1 A 17 17 ASN CA C 17 51.822 51.424 0.398 1
1 184 . 14 1 1 A 17 17 ASN CB C 17 43.176 41.727 1.449 1
1 185 . 14 1 1 A 17 17 ASN N N 17 122.213 123.514 -1.301 1
1 187 . 14 1 1 A 18 18 GLY H H 18 8.423 8.420 0.003 1
1 188 . 14 1 1 A 18 18 GLY HA2 H 18 3.931 3.897 0.034 1
1 189 . 14 1 1 A 18 18 GLY HA3 H 18 3.707 4.042 -0.335 1
1 190 . 14 1 1 A 18 18 GLY C C 18 173.985 172.909 1.076 1
1 191 . 14 1 1 A 18 18 GLY CA C 18 43.949 44.566 -0.617 1
1 192 . 14 1 1 A 18 18 GLY N N 18 106.991 107.876 -0.885 1
1 193 . 14 1 1 A 19 19 PHE H H 19 8.338 8.670 -0.332 1
1 194 . 14 1 1 A 19 19 PHE HA H 19 4.068 4.607 -0.539 1
1 197 . 14 1 1 A 19 19 PHE C C 19 176.568 175.056 1.512 1
1 198 . 14 1 1 A 19 19 PHE CA C 19 59.338 58.531 0.807 1
1 199 . 14 1 1 A 19 19 PHE CB C 19 40.201 39.615 0.586 1
1 200 . 14 1 1 A 19 19 PHE N N 19 116.857 118.520 -1.663 1
1 201 . 14 1 1 A 20 20 ASP H H 20 8.794 8.897 -0.103 1
1 202 . 14 1 1 A 20 20 ASP HA H 20 4.485 4.673 -0.188 1
1 205 . 14 1 1 A 20 20 ASP C C 20 177.379 177.430 -0.051 1
1 206 . 14 1 1 A 20 20 ASP CA C 20 54.140 54.716 -0.576 1
1 207 . 14 1 1 A 20 20 ASP CB C 20 41.915 41.315 0.600 1
1 208 . 14 1 1 A 20 20 ASP N N 20 123.025 124.542 -1.517 1
1 209 . 14 1 1 A 21 21 PHE H H 21 8.862 9.108 -0.246 1
1 210 . 14 1 1 A 21 21 PHE HA H 21 4.087 4.064 0.023 1
1 218 . 14 1 1 A 21 21 PHE C C 21 176.952 177.236 -0.284 1
1 219 . 14 1 1 A 21 21 PHE CA C 21 61.095 62.442 -1.347 1
1 220 . 14 1 1 A 21 21 PHE CB C 21 38.678 39.391 -0.713 1
1 226 . 14 1 1 A 21 21 PHE N N 21 127.163 124.854 2.309 1
1 227 . 14 1 1 A 22 22 ALA H H 22 8.561 8.339 0.222 1
1 228 . 14 1 1 A 22 22 ALA HA H 22 3.878 3.905 -0.027 1
1 232 . 14 1 1 A 22 22 ALA C C 22 180.710 180.079 0.631 1
1 233 . 14 1 1 A 22 22 ALA CA C 22 55.211 55.120 0.091 1
1 234 . 14 1 1 A 22 22 ALA CB C 22 18.321 18.398 -0.077 1
1 235 . 14 1 1 A 22 22 ALA N N 22 120.293 121.346 -1.053 1
1 236 . 14 1 1 A 23 23 VAL H H 23 7.241 7.534 -0.293 1
1 237 . 14 1 1 A 23 23 VAL HA H 23 3.684 3.541 0.143 1
1 245 . 14 1 1 A 23 23 VAL C C 23 177.101 177.954 -0.853 1
1 246 . 14 1 1 A 23 23 VAL CA C 23 65.237 67.132 -1.895 1
1 247 . 14 1 1 A 23 23 VAL CB C 23 31.780 31.488 0.292 1
1 250 . 14 1 1 A 23 23 VAL N N 23 118.775 117.540 1.235 1
1 251 . 14 1 1 A 24 24 ILE H H 24 6.761 7.849 -1.088 1
1 252 . 14 1 1 A 24 24 ILE HA H 24 3.196 3.442 -0.246 1
1 262 . 14 1 1 A 24 24 ILE C C 24 177.287 177.739 -0.452 1
1 263 . 14 1 1 A 24 24 ILE CA C 24 63.404 65.686 -2.282 1
1 264 . 14 1 1 A 24 24 ILE CB C 24 36.294 37.884 -1.590 1
1 268 . 14 1 1 A 24 24 ILE N N 24 119.036 120.202 -1.166 1
1 269 . 14 1 1 A 25 25 LYS H H 25 8.032 8.085 -0.053 1
1 270 . 14 1 1 A 25 25 LYS HA H 25 3.809 3.563 0.246 1
1 279 . 14 1 1 A 25 25 LYS C C 25 179.450 178.849 0.601 1
1 280 . 14 1 1 A 25 25 LYS CA C 25 59.621 59.389 0.232 1
1 281 . 14 1 1 A 25 25 LYS CB C 25 32.259 31.856 0.403 1
1 285 . 14 1 1 A 25 25 LYS N N 25 118.368 120.346 -1.978 1
1 286 . 14 1 1 A 26 26 GLU H H 26 7.845 7.774 0.071 1
1 287 . 14 1 1 A 26 26 GLU HA H 26 4.021 4.131 -0.110 1
1 292 . 14 1 1 A 26 26 GLU C C 26 179.191 179.527 -0.336 1
1 293 . 14 1 1 A 26 26 GLU CA C 26 59.530 59.416 0.114 1
1 294 . 14 1 1 A 26 26 GLU CB C 26 29.449 29.078 0.371 1
1 296 . 14 1 1 A 26 26 GLU N N 26 120.522 118.732 1.790 1
1 297 . 14 1 1 A 27 27 LEU H H 27 8.165 7.675 0.490 1
1 298 . 14 1 1 A 27 27 LEU HA H 27 4.163 4.142 0.021 1
1 308 . 14 1 1 A 27 27 LEU C C 27 177.256 178.326 -1.070 1
1 309 . 14 1 1 A 27 27 LEU CA C 27 58.049 57.144 0.905 1
1 310 . 14 1 1 A 27 27 LEU CB C 27 41.365 41.269 0.096 1
1 314 . 14 1 1 A 27 27 LEU N N 27 120.879 122.612 -1.733 1
1 315 . 14 1 1 A 28 28 LYS H H 28 8.902 8.069 0.833 1
1 316 . 14 1 1 A 28 28 LYS HA H 28 4.199 4.060 0.139 1
1 317 . 14 1 1 A 28 28 LYS C C 28 179.707 179.243 0.464 1
1 318 . 14 1 1 A 28 28 LYS CA C 28 60.097 59.280 0.817 1
1 319 . 14 1 1 A 28 28 LYS CB C 28 33.420 32.084 1.336 1
1 320 . 14 1 1 A 28 28 LYS N N 28 120.050 119.392 0.658 1
1 321 . 14 1 1 A 29 29 THR H H 29 8.294 8.310 -0.016 1
1 322 . 14 1 1 A 29 29 THR HA H 29 3.892 3.951 -0.059 1
1 327 . 14 1 1 A 29 29 THR C C 29 175.711 177.349 -1.638 1
1 328 . 14 1 1 A 29 29 THR CA C 29 66.846 66.451 0.395 1
1 329 . 14 1 1 A 29 29 THR CB C 29 68.794 68.789 0.005 1
1 331 . 14 1 1 A 29 29 THR N N 29 115.933 116.758 -0.825 1
1 332 . 14 1 1 A 30 30 ALA H H 30 8.244 8.580 -0.336 1
1 333 . 14 1 1 A 30 30 ALA HA H 30 4.241 4.370 -0.129 1
1 337 . 14 1 1 A 30 30 ALA C C 30 179.128 179.796 -0.668 1
1 338 . 14 1 1 A 30 30 ALA CA C 30 55.714 55.402 0.312 1
1 339 . 14 1 1 A 30 30 ALA CB C 30 18.955 18.661 0.294 1
1 340 . 14 1 1 A 30 30 ALA N N 30 124.617 123.824 0.793 1
1 341 . 14 1 1 A 31 31 ALA H H 31 8.968 8.234 0.734 1
1 342 . 14 1 1 A 31 31 ALA HA H 31 3.890 4.044 -0.154 1
1 346 . 14 1 1 A 31 31 ALA C C 31 180.352 179.373 0.979 1
1 347 . 14 1 1 A 31 31 ALA CA C 31 55.454 55.512 -0.058 1
1 348 . 14 1 1 A 31 31 ALA CB C 31 17.124 18.257 -1.133 1
1 349 . 14 1 1 A 31 31 ALA N N 31 119.327 120.696 -1.369 1
1 350 . 14 1 1 A 32 32 SER H H 32 7.995 7.750 0.245 1
1 351 . 14 1 1 A 32 32 SER HA H 32 4.238 4.196 0.042 1
1 354 . 14 1 1 A 32 32 SER C C 32 175.612 175.824 -0.212 1
1 355 . 14 1 1 A 32 32 SER CA C 32 61.203 61.625 -0.422 1
1 356 . 14 1 1 A 32 32 SER CB C 32 63.406 63.361 0.045 1
1 357 . 14 1 1 A 32 32 SER N N 32 111.962 113.614 -1.652 1
1 358 . 14 1 1 A 33 33 GLN H H 33 8.333 7.739 0.594 1
1 359 . 14 1 1 A 33 33 GLN HA H 33 3.992 4.190 -0.198 1
1 366 . 14 1 1 A 33 33 GLN C C 33 177.486 176.161 1.325 1
1 367 . 14 1 1 A 33 33 GLN CA C 33 58.277 57.364 0.913 1
1 368 . 14 1 1 A 33 33 GLN CB C 33 29.140 29.930 -0.790 1
1 370 . 14 1 1 A 33 33 GLN N N 33 119.527 118.848 0.679 1
1 372 . 14 1 1 A 34 34 TYR H H 34 8.587 8.540 0.047 1
1 373 . 14 1 1 A 34 34 TYR HA H 34 4.792 4.961 -0.169 1
1 380 . 14 1 1 A 34 34 TYR C C 34 176.499 177.120 -0.621 1
1 381 . 14 1 1 A 34 34 TYR CA C 34 57.711 57.703 0.008 1
1 382 . 14 1 1 A 34 34 TYR CB C 34 39.561 38.789 0.772 1
1 387 . 14 1 1 A 34 34 TYR N N 34 114.610 115.625 -1.015 1
1 388 . 14 1 1 A 35 35 GLY H H 35 7.346 8.413 -1.067 1
1 389 . 14 1 1 A 35 35 GLY HA2 H 35 4.785 3.960 0.825 1
1 390 . 14 1 1 A 35 35 GLY HA3 H 35 4.007 4.039 -0.032 1
1 391 . 14 1 1 A 35 35 GLY C C 35 175.796 174.812 0.984 1
1 392 . 14 1 1 A 35 35 GLY CA C 35 44.355 47.244 -2.889 1
1 393 . 14 1 1 A 35 35 GLY N N 35 108.501 109.324 -0.823 1
1 394 . 14 1 1 A 36 36 ALA H H 36 9.363 7.650 1.713 1
1 395 . 14 1 1 A 36 36 ALA HA H 36 4.217 4.469 -0.252 1
1 399 . 14 1 1 A 36 36 ALA C C 36 178.039 177.202 0.837 1
1 400 . 14 1 1 A 36 36 ALA CA C 36 56.114 52.331 3.783 1
1 401 . 14 1 1 A 36 36 ALA CB C 36 19.179 19.311 -0.132 1
1 402 . 14 1 1 A 36 36 ALA N N 36 125.811 123.597 2.214 1
1 403 . 14 1 1 A 37 37 THR H H 37 8.070 8.481 -0.411 1
1 404 . 14 1 1 A 37 37 THR HA H 37 4.570 4.461 0.109 1
1 409 . 14 1 1 A 37 37 THR C C 37 173.685 172.911 0.774 1
1 410 . 14 1 1 A 37 37 THR CA C 37 59.822 61.468 -1.646 1
1 411 . 14 1 1 A 37 37 THR CB C 37 68.267 68.082 0.185 1
1 413 . 14 1 1 A 37 37 THR N N 37 129.410 116.204 13.206 1
1 414 . 14 1 1 A 38 38 ALA H H 38 6.853 7.927 -1.074 1
1 415 . 14 1 1 A 38 38 ALA HA H 38 4.601 4.905 -0.304 1
1 419 . 14 1 1 A 38 38 ALA CA C 38 50.758 49.000 1.758 1
1 420 . 14 1 1 A 38 38 ALA CB C 38 18.325 20.808 -2.483 1
1 421 . 14 1 1 A 38 38 ALA N N 38 124.674 129.715 -5.041 1
1 422 . 14 1 1 A 40 40 TYR HA H 40 4.032 4.041 -0.009 1
1 429 . 14 1 1 A 40 40 TYR C C 40 176.456 177.503 -1.047 1
1 430 . 14 1 1 A 40 40 TYR CA C 40 61.010 61.752 -0.742 1
1 431 . 14 1 1 A 40 40 TYR CB C 40 39.286 38.716 0.570 1
1 436 . 14 1 1 A 41 41 THR H H 41 6.874 8.266 -1.392 1
1 437 . 14 1 1 A 41 41 THR HA H 41 3.616 3.881 -0.265 1
1 442 . 14 1 1 A 41 41 THR C C 41 176.930 176.405 0.525 1
1 443 . 14 1 1 A 41 41 THR CA C 41 65.557 66.073 -0.516 1
1 444 . 14 1 1 A 41 41 THR CB C 41 68.228 69.201 -0.973 1
1 446 . 14 1 1 A 41 41 THR N N 41 115.143 113.912 1.231 1
1 447 . 14 1 1 A 42 42 LEU H H 42 8.623 7.441 1.182 1
1 448 . 14 1 1 A 42 42 LEU HA H 42 3.708 4.015 -0.307 1
1 458 . 14 1 1 A 42 42 LEU C C 42 178.206 178.851 -0.645 1
1 459 . 14 1 1 A 42 42 LEU CA C 42 57.417 57.690 -0.273 1
1 460 . 14 1 1 A 42 42 LEU CB C 42 41.342 41.214 0.128 1
1 464 . 14 1 1 A 42 42 LEU N N 42 120.418 118.031 2.387 1
1 465 . 14 1 1 A 43 43 ALA H H 43 7.735 7.762 -0.027 1
1 466 . 14 1 1 A 43 43 ALA HA H 43 4.020 4.038 -0.018 1
1 470 . 14 1 1 A 43 43 ALA C C 43 180.826 180.797 0.029 1
1 471 . 14 1 1 A 43 43 ALA CA C 43 54.925 55.065 -0.140 1
1 472 . 14 1 1 A 43 43 ALA CB C 43 17.506 18.352 -0.846 1
1 473 . 14 1 1 A 43 43 ALA N N 43 120.203 121.891 -1.688 1
1 474 . 14 1 1 A 44 44 ILE H H 44 7.149 7.378 -0.229 1
1 475 . 14 1 1 A 44 44 ILE HA H 44 3.603 3.607 -0.004 1
1 485 . 14 1 1 A 44 44 ILE C C 44 178.594 178.005 0.589 1
1 486 . 14 1 1 A 44 44 ILE CA C 44 64.782 64.212 0.570 1
1 487 . 14 1 1 A 44 44 ILE CB C 44 37.472 36.368 1.104 1
1 491 . 14 1 1 A 44 44 ILE N N 44 118.881 119.420 -0.539 1
1 492 . 14 1 1 A 45 45 VAL H H 45 7.968 7.956 0.012 1
1 493 . 14 1 1 A 45 45 VAL HA H 45 2.925 3.410 -0.485 1
1 501 . 14 1 1 A 45 45 VAL C C 45 177.023 178.093 -1.070 1
1 502 . 14 1 1 A 45 45 VAL CA C 45 67.081 66.710 0.371 1
1 503 . 14 1 1 A 45 45 VAL CB C 45 30.854 31.038 -0.184 1
1 506 . 14 1 1 A 45 45 VAL N N 45 120.764 121.014 -0.250 1
1 507 . 14 1 1 A 46 46 GLU H H 46 8.399 7.947 0.452 1
1 508 . 14 1 1 A 46 46 GLU HA H 46 3.848 3.997 -0.149 1
1 513 . 14 1 1 A 46 46 GLU C C 46 178.656 179.318 -0.662 1
1 514 . 14 1 1 A 46 46 GLU CA C 46 59.491 59.315 0.176 1
1 515 . 14 1 1 A 46 46 GLU CB C 46 28.991 28.647 0.344 1
1 517 . 14 1 1 A 46 46 GLU N N 46 116.599 120.466 -3.867 1
1 518 . 14 1 1 A 47 47 SER H H 47 7.273 7.917 -0.644 1
1 519 . 14 1 1 A 47 47 SER HA H 47 4.287 4.072 0.215 1
1 521 . 14 1 1 A 47 47 SER CA C 47 61.047 62.546 -1.499 1
1 522 . 14 1 1 A 47 47 SER CB C 47 63.016 62.881 0.135 1
1 523 . 14 1 1 A 47 47 SER N N 47 113.609 117.880 -4.271 1
1 524 . 14 1 1 A 48 48 VAL H H 48 8.006 7.614 0.392 1
1 525 . 14 1 1 A 48 48 VAL HA H 48 3.556 3.651 -0.095 1
1 533 . 14 1 1 A 48 48 VAL C C 48 177.257 177.743 -0.486 1
1 534 . 14 1 1 A 48 48 VAL CA C 48 65.025 64.478 0.547 1
1 535 . 14 1 1 A 48 48 VAL CB C 48 31.841 31.591 0.250 1
1 538 . 14 1 1 A 48 48 VAL N N 48 122.327 119.216 3.111 1
1 539 . 14 1 1 A 49 49 ALA H H 49 8.369 7.630 0.739 1
1 540 . 14 1 1 A 49 49 ALA HA H 49 4.115 3.976 0.139 1
1 544 . 14 1 1 A 49 49 ALA C C 49 177.307 177.814 -0.507 1
1 545 . 14 1 1 A 49 49 ALA CA C 49 53.253 53.769 -0.516 1
1 546 . 14 1 1 A 49 49 ALA CB C 49 20.131 18.368 1.763 1
1 547 . 14 1 1 A 49 49 ALA N N 49 118.050 124.010 -5.960 1
1 548 . 14 1 1 A 50 50 ASP H H 50 7.052 7.582 -0.530 1
1 549 . 14 1 1 A 50 50 ASP HA H 50 4.788 4.651 0.137 1
1 552 . 14 1 1 A 50 50 ASP C C 50 175.481 175.466 0.015 1
1 553 . 14 1 1 A 50 50 ASP CA C 50 53.681 53.524 0.157 1
1 554 . 14 1 1 A 50 50 ASP CB C 50 39.333 40.970 -1.637 1
1 555 . 14 1 1 A 50 50 ASP N N 50 116.997 117.221 -0.224 1
1 556 . 14 1 1 A 51 51 ASN H H 51 8.535 7.200 1.335 1
1 557 . 14 1 1 A 51 51 ASN HA H 51 4.628 4.757 -0.129 1
1 562 . 14 1 1 A 51 51 ASN C C 51 174.077 174.724 -0.647 1
1 563 . 14 1 1 A 51 51 ASN CA C 51 52.315 51.584 0.731 1
1 564 . 14 1 1 A 51 51 ASN CB C 51 41.928 42.263 -0.335 1
1 565 . 14 1 1 A 51 51 ASN N N 51 118.626 117.416 1.210 1
1 567 . 14 1 1 A 52 52 TRP H H 52 8.555 8.149 0.406 1
1 574 . 14 1 1 A 52 52 TRP C C 52 173.269 176.120 -2.851 1
1 575 . 14 1 1 A 52 52 TRP CA C 52 55.031 57.182 -2.151 1
1 576 . 14 1 1 A 52 52 TRP CB C 52 26.801 28.873 -2.072 1
1 582 . 14 1 1 A 52 52 TRP N N 52 120.693 121.289 -0.596 1
1 584 . 14 1 1 A 53 53 LEU H H 53 7.847 7.460 0.387 1
1 585 . 14 1 1 A 53 53 LEU HA H 53 4.859 4.362 0.497 1
1 595 . 14 1 1 A 53 53 LEU C C 53 177.397 177.037 0.360 1
1 596 . 14 1 1 A 53 53 LEU CA C 53 53.619 55.429 -1.810 1
1 597 . 14 1 1 A 53 53 LEU CB C 53 41.812 42.380 -0.568 1
1 601 . 14 1 1 A 53 53 LEU N N 53 124.741 119.729 5.012 1
1 602 . 14 1 1 A 54 54 THR H H 54 8.850 8.675 0.175 1
1 603 . 14 1 1 A 54 54 THR HA H 54 4.598 4.980 -0.382 1
1 608 . 14 1 1 A 54 54 THR CA C 54 60.531 60.596 -0.065 1
1 609 . 14 1 1 A 54 54 THR CB C 54 67.183 69.003 -1.820 1
1 611 . 14 1 1 A 54 54 THR N N 54 113.407 113.516 -0.109 1
1 612 . 14 1 1 A 55 55 PRO HA H 55 4.511 4.327 0.184 1
1 619 . 14 1 1 A 55 55 PRO C C 55 179.383 178.935 0.448 1
1 620 . 14 1 1 A 55 55 PRO CA C 55 67.159 65.644 1.515 1
1 621 . 14 1 1 A 55 55 PRO CB C 55 32.095 31.843 0.252 1
1 622 . 14 1 1 A 56 56 THR H H 56 8.575 7.938 0.637 1
1 623 . 14 1 1 A 56 56 THR HA H 56 4.229 4.140 0.089 1
1 628 . 14 1 1 A 56 56 THR C C 56 176.668 176.057 0.611 1
1 629 . 14 1 1 A 56 56 THR CA C 56 66.943 65.777 1.166 1
1 630 . 14 1 1 A 56 56 THR CB C 56 68.129 68.504 -0.375 1
1 632 . 14 1 1 A 56 56 THR N N 56 114.855 113.138 1.717 1
1 633 . 14 1 1 A 57 57 ASP H H 57 8.730 8.536 0.194 1
1 634 . 14 1 1 A 57 57 ASP HA H 57 4.425 4.732 -0.307 1
1 637 . 14 1 1 A 57 57 ASP C C 57 178.351 178.807 -0.456 1
1 638 . 14 1 1 A 57 57 ASP CA C 57 57.963 57.559 0.404 1
1 639 . 14 1 1 A 57 57 ASP CB C 57 40.134 41.613 -1.479 1
1 640 . 14 1 1 A 57 57 ASP N N 57 126.239 121.358 4.881 1
1 641 . 14 1 1 A 58 58 TRP H H 58 8.244 8.580 -0.336 1
1 642 . 14 1 1 A 58 58 TRP HA H 58 4.030 4.445 -0.415 1
1 650 . 14 1 1 A 58 58 TRP C C 58 177.432 179.359 -1.927 1
1 651 . 14 1 1 A 58 58 TRP CA C 58 62.731 59.807 2.924 1
1 652 . 14 1 1 A 58 58 TRP CB C 58 29.122 29.082 0.040 1
1 657 . 14 1 1 A 58 58 TRP N N 58 119.241 120.877 -1.636 1
1 659 . 14 1 1 A 59 59 ASN H H 59 8.098 9.028 -0.930 1
1 660 . 14 1 1 A 59 59 ASN HA H 59 4.424 4.566 -0.142 1
1 663 . 14 1 1 A 59 59 ASN C C 59 176.952 178.094 -1.142 1
1 664 . 14 1 1 A 59 59 ASN CA C 59 58.135 56.665 1.470 1
1 665 . 14 1 1 A 59 59 ASN CB C 59 40.168 38.307 1.861 1
1 666 . 14 1 1 A 59 59 ASN N N 59 115.747 117.609 -1.862 1
1 667 . 14 1 1 A 60 60 THR H H 60 8.712 7.954 0.758 1
1 668 . 14 1 1 A 60 60 THR HA H 60 3.717 4.067 -0.350 1
1 673 . 14 1 1 A 60 60 THR C C 60 176.044 176.680 -0.636 1
1 674 . 14 1 1 A 60 60 THR CA C 60 66.576 66.593 -0.017 1
1 675 . 14 1 1 A 60 60 THR CB C 60 69.251 68.183 1.068 1
1 677 . 14 1 1 A 60 60 THR N N 60 114.896 118.332 -3.436 1
1 678 . 14 1 1 A 61 61 LEU H H 61 8.485 8.155 0.330 1
1 679 . 14 1 1 A 61 61 LEU HA H 61 3.391 3.856 -0.465 1
1 689 . 14 1 1 A 61 61 LEU C C 61 177.433 178.523 -1.090 1
1 690 . 14 1 1 A 61 61 LEU CA C 61 58.354 58.376 -0.022 1
1 691 . 14 1 1 A 61 61 LEU CB C 61 41.761 42.141 -0.380 1
1 695 . 14 1 1 A 61 61 LEU N N 61 123.433 122.390 1.043 1
1 696 . 14 1 1 A 62 62 VAL H H 62 8.073 8.597 -0.524 1
1 697 . 14 1 1 A 62 62 VAL HA H 62 3.207 3.903 -0.696 1
1 705 . 14 1 1 A 62 62 VAL C C 62 177.585 177.540 0.045 1
1 706 . 14 1 1 A 62 62 VAL CA C 62 67.345 65.340 2.005 1
1 707 . 14 1 1 A 62 62 VAL CB C 62 30.905 30.704 0.201 1
1 710 . 14 1 1 A 62 62 VAL N N 62 116.018 118.571 -2.553 1
1 711 . 14 1 1 A 63 63 ARG H H 63 7.765 8.078 -0.313 1
1 712 . 14 1 1 A 63 63 ARG HA H 63 3.602 4.145 -0.543 1
1 719 . 14 1 1 A 63 63 ARG C C 63 177.818 177.173 0.645 1
1 720 . 14 1 1 A 63 63 ARG CA C 63 58.049 58.110 -0.061 1
1 721 . 14 1 1 A 63 63 ARG CB C 63 29.955 29.480 0.475 1
1 724 . 14 1 1 A 63 63 ARG N N 63 116.700 120.445 -3.745 1
1 725 . 14 1 1 A 64 64 ALA H H 64 7.574 7.667 -0.093 1
1 726 . 14 1 1 A 64 64 ALA HA H 64 4.158 4.314 -0.156 1
1 730 . 14 1 1 A 64 64 ALA C C 64 179.886 178.113 1.773 1
1 731 . 14 1 1 A 64 64 ALA CA C 64 54.007 52.507 1.500 1
1 732 . 14 1 1 A 64 64 ALA CB C 64 19.147 19.244 -0.097 1
1 733 . 14 1 1 A 64 64 ALA N N 64 117.555 121.504 -3.949 1
1 734 . 14 1 1 A 65 65 VAL H H 65 7.554 7.088 0.466 1
1 735 . 14 1 1 A 65 65 VAL HA H 65 4.253 4.331 -0.078 1
1 743 . 14 1 1 A 65 65 VAL C C 65 174.180 175.634 -1.454 1
1 744 . 14 1 1 A 65 65 VAL CA C 65 62.683 63.195 -0.512 1
1 745 . 14 1 1 A 65 65 VAL CB C 65 33.458 32.690 0.768 1
1 748 . 14 1 1 A 65 65 VAL N N 65 110.013 110.931 -0.918 1
1 749 . 14 1 1 A 66 66 LEU H H 66 7.792 7.084 0.708 1
1 750 . 14 1 1 A 66 66 LEU HA H 66 4.790 4.422 0.368 1
1 760 . 14 1 1 A 66 66 LEU C C 66 177.537 176.068 1.469 1
1 761 . 14 1 1 A 66 66 LEU CA C 66 52.823 54.175 -1.352 1
1 762 . 14 1 1 A 66 66 LEU CB C 66 44.071 41.782 2.289 1
1 766 . 14 1 1 A 66 66 LEU N N 66 118.967 122.170 -3.203 1
1 767 . 14 1 1 A 67 67 SER H H 67 9.208 8.462 0.746 1
1 768 . 14 1 1 A 67 67 SER HA H 67 4.414 4.686 -0.272 1
1 771 . 14 1 1 A 67 67 SER CA C 67 57.943 57.548 0.395 1
1 772 . 14 1 1 A 67 67 SER CB C 67 64.743 66.222 -1.479 1
1 773 . 14 1 1 A 67 67 SER N N 67 116.378 115.781 0.597 1
1 774 . 14 1 1 A 69 69 GLY HA2 H 69 3.916 3.700 0.216 1
1 775 . 14 1 1 A 69 69 GLY HA3 H 69 3.867 3.742 0.125 1
1 776 . 14 1 1 A 69 69 GLY C C 69 176.783 175.334 1.449 1
1 777 . 14 1 1 A 69 69 GLY CA C 69 46.977 46.988 -0.011 1
1 778 . 14 1 1 A 70 70 ASP H H 70 7.674 8.115 -0.441 1
1 779 . 14 1 1 A 70 70 ASP HA H 70 4.511 3.466 1.045 1
1 782 . 14 1 1 A 70 70 ASP C C 70 178.096 178.221 -0.125 1
1 783 . 14 1 1 A 70 70 ASP CA C 70 57.262 56.397 0.865 1
1 784 . 14 1 1 A 70 70 ASP CB C 70 40.594 39.465 1.129 1
1 785 . 14 1 1 A 70 70 ASP N N 70 123.930 122.125 1.805 1
1 786 . 14 1 1 A 71 71 HIS H H 71 8.729 8.110 0.619 1
1 787 . 14 1 1 A 71 71 HIS HA H 71 4.235 4.255 -0.020 1
1 790 . 14 1 1 A 71 71 HIS C C 71 176.769 177.703 -0.934 1
1 791 . 14 1 1 A 71 71 HIS CA C 71 60.041 58.882 1.159 1
1 792 . 14 1 1 A 71 71 HIS CB C 71 30.682 30.247 0.435 1
1 793 . 14 1 1 A 71 71 HIS N N 71 121.003 117.215 3.788 1
1 794 . 14 1 1 A 72 72 LEU H H 72 7.620 7.989 -0.369 1
1 795 . 14 1 1 A 72 72 LEU HA H 72 3.769 3.905 -0.136 1
1 805 . 14 1 1 A 72 72 LEU C C 72 180.275 179.210 1.065 1
1 806 . 14 1 1 A 72 72 LEU CA C 72 58.192 58.243 -0.051 1
1 807 . 14 1 1 A 72 72 LEU CB C 72 41.381 41.934 -0.553 1
1 811 . 14 1 1 A 72 72 LEU N N 72 118.569 119.854 -1.285 1
1 812 . 14 1 1 A 73 73 LEU H H 73 7.542 7.598 -0.056 1
1 813 . 14 1 1 A 73 73 LEU HA H 73 4.107 4.280 -0.173 1
1 823 . 14 1 1 A 73 73 LEU C C 73 179.436 179.266 0.170 1
1 824 . 14 1 1 A 73 73 LEU CA C 73 58.026 57.324 0.702 1
1 825 . 14 1 1 A 73 73 LEU CB C 73 41.638 42.016 -0.378 1
1 829 . 14 1 1 A 73 73 LEU N N 73 121.418 117.030 4.388 1
1 830 . 14 1 1 A 74 74 TRP H H 74 8.786 8.064 0.722 1
1 831 . 14 1 1 A 74 74 TRP HA H 74 3.589 5.470 -1.881 1
1 840 . 14 1 1 A 74 74 TRP C C 74 176.816 178.693 -1.877 1
1 841 . 14 1 1 A 74 74 TRP CA C 74 63.046 59.842 3.204 1
1 842 . 14 1 1 A 74 74 TRP CB C 74 28.065 28.990 -0.925 1
1 848 . 14 1 1 A 74 74 TRP N N 74 121.111 118.180 2.931 1
1 850 . 14 1 1 A 75 75 LYS H H 75 8.939 7.707 1.232 1
1 851 . 14 1 1 A 75 75 LYS HA H 75 3.055 4.171 -1.116 1
1 860 . 14 1 1 A 75 75 LYS C C 75 177.967 179.510 -1.543 1
1 861 . 14 1 1 A 75 75 LYS CA C 75 60.029 58.751 1.278 1
1 862 . 14 1 1 A 75 75 LYS CB C 75 32.533 32.901 -0.368 1
1 866 . 14 1 1 A 75 75 LYS N N 75 119.783 119.195 0.588 1
1 867 . 14 1 1 A 76 76 SER H H 76 7.832 8.153 -0.321 1
1 868 . 14 1 1 A 76 76 SER HA H 76 4.040 4.354 -0.314 1
1 871 . 14 1 1 A 76 76 SER C C 76 177.816 177.248 0.568 1
1 872 . 14 1 1 A 76 76 SER CA C 76 62.105 60.941 1.164 1
1 873 . 14 1 1 A 76 76 SER CB C 76 62.679 62.620 0.059 1
1 874 . 14 1 1 A 76 76 SER N N 76 113.395 114.444 -1.049 1
1 875 . 14 1 1 A 77 77 GLU H H 77 7.590 7.646 -0.056 1
1 876 . 14 1 1 A 77 77 GLU HA H 77 4.042 4.272 -0.230 1
1 881 . 14 1 1 A 77 77 GLU C C 77 177.809 178.582 -0.773 1
1 882 . 14 1 1 A 77 77 GLU CA C 77 58.270 58.734 -0.464 1
1 883 . 14 1 1 A 77 77 GLU CB C 77 29.208 29.508 -0.300 1
1 885 . 14 1 1 A 77 77 GLU N N 77 121.574 122.469 -0.895 1
1 886 . 14 1 1 A 78 78 PHE H H 78 9.081 7.937 1.144 1
1 887 . 14 1 1 A 78 78 PHE HA H 78 3.778 4.221 -0.443 1
1 895 . 14 1 1 A 78 78 PHE C C 78 178.114 177.323 0.791 1
1 896 . 14 1 1 A 78 78 PHE CA C 78 60.629 61.391 -0.762 1
1 897 . 14 1 1 A 78 78 PHE CB C 78 38.295 38.700 -0.405 1
1 902 . 14 1 1 A 78 78 PHE N N 78 122.682 122.316 0.366 1
1 903 . 14 1 1 A 79 79 PHE H H 79 8.890 8.049 0.841 1
1 904 . 14 1 1 A 79 79 PHE HA H 79 3.800 3.984 -0.184 1
1 912 . 14 1 1 A 79 79 PHE C C 79 178.354 178.260 0.094 1
1 913 . 14 1 1 A 79 79 PHE CA C 79 60.704 61.877 -1.173 1
1 914 . 14 1 1 A 79 79 PHE CB C 79 37.184 38.362 -1.178 1
1 920 . 14 1 1 A 79 79 PHE N N 79 121.056 118.129 2.927 1
1 921 . 14 1 1 A 80 80 GLU H H 80 7.793 8.473 -0.680 1
1 922 . 14 1 1 A 80 80 GLU HA H 80 4.082 3.955 0.127 1
1 927 . 14 1 1 A 80 80 GLU C C 80 179.068 178.777 0.291 1
1 928 . 14 1 1 A 80 80 GLU CA C 80 59.735 59.974 -0.239 1
1 929 . 14 1 1 A 80 80 GLU CB C 80 28.722 29.274 -0.552 1
1 931 . 14 1 1 A 80 80 GLU N N 80 120.312 118.911 1.401 1
1 932 . 14 1 1 A 81 81 ASN H H 81 8.624 8.959 -0.335 1
1 933 . 14 1 1 A 81 81 ASN HA H 81 4.521 4.492 0.029 1
1 938 . 14 1 1 A 81 81 ASN C C 81 179.262 177.488 1.774 1
1 939 . 14 1 1 A 81 81 ASN CA C 81 55.504 56.052 -0.548 1
1 940 . 14 1 1 A 81 81 ASN CB C 81 37.517 37.475 0.042 1
1 941 . 14 1 1 A 81 81 ASN N N 81 119.338 117.267 2.071 1
1 943 . 14 1 1 A 82 82 CYS H H 82 8.554 7.922 0.632 1
1 944 . 14 1 1 A 82 82 CYS HA H 82 3.792 3.980 -0.188 1
1 947 . 14 1 1 A 82 82 CYS C C 82 176.478 177.350 -0.872 1
1 948 . 14 1 1 A 82 82 CYS CA C 82 65.232 63.898 1.334 1
1 949 . 14 1 1 A 82 82 CYS CB C 82 26.762 27.085 -0.323 1
1 950 . 14 1 1 A 82 82 CYS N N 82 120.576 117.605 2.971 1
1 951 . 14 1 1 A 83 83 ARG H H 83 8.522 7.565 0.957 1
1 952 . 14 1 1 A 83 83 ARG HA H 83 3.932 4.178 -0.246 1
1 960 . 14 1 1 A 83 83 ARG C C 83 179.138 178.333 0.805 1
1 961 . 14 1 1 A 83 83 ARG CA C 83 60.443 58.782 1.661 1
1 962 . 14 1 1 A 83 83 ARG CB C 83 29.550 29.672 -0.122 1
1 965 . 14 1 1 A 83 83 ARG N N 83 123.035 119.720 3.315 1
1 967 . 14 1 1 A 84 84 ASP H H 84 7.791 7.854 -0.063 1
1 968 . 14 1 1 A 84 84 ASP HA H 84 4.353 4.411 -0.058 1
1 971 . 14 1 1 A 84 84 ASP C C 84 178.649 178.604 0.045 1
1 972 . 14 1 1 A 84 84 ASP CA C 84 57.767 57.172 0.595 1
1 973 . 14 1 1 A 84 84 ASP CB C 84 41.305 41.174 0.131 1
1 974 . 14 1 1 A 84 84 ASP N N 84 120.332 119.760 0.572 1
1 975 . 14 1 1 A 85 85 THR H H 85 8.370 8.420 -0.050 1
1 976 . 14 1 1 A 85 85 THR HA H 85 3.730 3.918 -0.188 1
1 981 . 14 1 1 A 85 85 THR C C 85 175.198 176.255 -1.057 1
1 982 . 14 1 1 A 85 85 THR CA C 85 66.830 65.881 0.949 1
1 983 . 14 1 1 A 85 85 THR CB C 85 68.533 68.310 0.223 1
1 985 . 14 1 1 A 85 85 THR N N 85 117.360 115.929 1.431 1
1 986 . 14 1 1 A 86 86 ALA H H 86 8.845 7.942 0.903 1
1 987 . 14 1 1 A 86 86 ALA HA H 86 3.991 3.992 -0.001 1
1 991 . 14 1 1 A 86 86 ALA C C 86 179.980 179.413 0.567 1
1 992 . 14 1 1 A 86 86 ALA CA C 86 55.769 55.401 0.368 1
1 993 . 14 1 1 A 86 86 ALA CB C 86 17.881 18.254 -0.373 1
1 994 . 14 1 1 A 86 86 ALA N N 86 123.613 123.657 -0.044 1
1 995 . 14 1 1 A 87 87 LYS H H 87 7.686 7.820 -0.134 1
1 996 . 14 1 1 A 87 87 LYS HA H 87 4.099 3.849 0.250 1
1 1005 . 14 1 1 A 87 87 LYS C C 87 179.592 179.686 -0.094 1
1 1006 . 14 1 1 A 87 87 LYS CA C 87 59.708 59.997 -0.289 1
1 1007 . 14 1 1 A 87 87 LYS CB C 87 32.054 32.718 -0.664 1
1 1011 . 14 1 1 A 87 87 LYS N N 87 119.623 118.122 1.501 1
1 1012 . 14 1 1 A 88 88 ARG H H 88 7.683 7.678 0.005 1
1 1013 . 14 1 1 A 88 88 ARG HA H 88 4.051 4.124 -0.073 1
1 1020 . 14 1 1 A 88 88 ARG C C 88 180.053 179.122 0.931 1
1 1021 . 14 1 1 A 88 88 ARG CA C 88 59.558 59.227 0.331 1
1 1022 . 14 1 1 A 88 88 ARG CB C 88 29.684 29.741 -0.057 1
1 1025 . 14 1 1 A 88 88 ARG N N 88 120.788 119.521 1.267 1
1 1026 . 14 1 1 A 89 89 ASN H H 89 8.973 8.344 0.629 1
1 1027 . 14 1 1 A 89 89 ASN HA H 89 4.354 4.605 -0.251 1
1 1032 . 14 1 1 A 89 89 ASN C C 89 178.382 178.707 -0.325 1
1 1033 . 14 1 1 A 89 89 ASN CA C 89 55.334 55.948 -0.614 1
1 1034 . 14 1 1 A 89 89 ASN CB C 89 37.864 37.838 0.026 1
1 1035 . 14 1 1 A 89 89 ASN N N 89 121.012 117.969 3.043 1
1 1037 . 14 1 1 A 90 90 GLN H H 90 8.152 7.798 0.354 1
1 1038 . 14 1 1 A 90 90 GLN HA H 90 4.020 4.091 -0.071 1
1 1045 . 14 1 1 A 90 90 GLN C C 90 179.075 178.872 0.203 1
1 1046 . 14 1 1 A 90 90 GLN CA C 90 59.318 58.946 0.372 1
1 1047 . 14 1 1 A 90 90 GLN CB C 90 28.049 28.369 -0.320 1
1 1049 . 14 1 1 A 90 90 GLN N N 90 122.122 119.390 2.732 1
1 1051 . 14 1 1 A 91 91 GLN H H 91 7.514 8.397 -0.883 1
1 1052 . 14 1 1 A 91 91 GLN HA H 91 4.053 4.067 -0.014 1
1 1059 . 14 1 1 A 91 91 GLN C C 91 177.081 177.819 -0.738 1
1 1060 . 14 1 1 A 91 91 GLN CA C 91 58.031 58.697 -0.666 1
1 1061 . 14 1 1 A 91 91 GLN CB C 91 28.365 27.923 0.442 1
1 1063 . 14 1 1 A 91 91 GLN N N 91 118.124 118.266 -0.142 1
1 1065 . 14 1 1 A 92 92 ALA H H 92 7.704 7.552 0.152 1
1 1066 . 14 1 1 A 92 92 ALA HA H 92 4.246 4.322 -0.076 1
1 1070 . 14 1 1 A 92 92 ALA C C 92 178.450 177.929 0.521 1
1 1071 . 14 1 1 A 92 92 ALA CA C 92 52.671 52.234 0.437 1
1 1072 . 14 1 1 A 92 92 ALA CB C 92 19.316 19.429 -0.113 1
1 1073 . 14 1 1 A 92 92 ALA N N 92 119.880 119.510 0.370 1
1 1074 . 14 1 1 A 93 93 GLY H H 93 7.693 7.751 -0.058 1
1 1075 . 14 1 1 A 93 93 GLY HA2 H 93 3.941 3.945 -0.004 1
1 1076 . 14 1 1 A 93 93 GLY HA3 H 93 3.744 3.951 -0.207 1
1 1077 . 14 1 1 A 93 93 GLY C C 93 174.344 174.703 -0.359 1
1 1078 . 14 1 1 A 93 93 GLY CA C 93 45.949 46.499 -0.550 1
1 1079 . 14 1 1 A 93 93 GLY N N 93 105.347 107.666 -2.319 1
1 1080 . 14 1 1 A 94 94 ASN H H 94 7.076 8.776 -1.700 1
1 1081 . 14 1 1 A 94 94 ASN HA H 94 4.115 4.839 -0.724 1
1 1085 . 14 1 1 A 94 94 ASN C C 94 175.410 175.503 -0.093 1
1 1086 . 14 1 1 A 94 94 ASN CA C 94 52.651 52.406 0.245 1
1 1087 . 14 1 1 A 94 94 ASN CB C 94 38.330 39.700 -1.370 1
1 1088 . 14 1 1 A 94 94 ASN N N 94 115.747 118.436 -2.689 1
1 1090 . 14 1 1 A 95 95 GLY H H 95 8.236 8.422 -0.186 1
1 1091 . 14 1 1 A 95 95 GLY HA2 H 95 3.633 3.453 0.180 1
1 1092 . 14 1 1 A 95 95 GLY HA3 H 95 3.633 3.643 -0.010 1
1 1093 . 14 1 1 A 95 95 GLY C C 95 174.450 173.079 1.371 1
1 1094 . 14 1 1 A 95 95 GLY CA C 95 45.522 46.954 -1.432 1
1 1095 . 14 1 1 A 95 95 GLY N N 95 109.166 109.908 -0.742 1
1 1096 . 14 1 1 A 96 96 TRP H H 96 7.899 7.804 0.095 1
1 1097 . 14 1 1 A 96 96 TRP HA H 96 5.241 5.167 0.074 1
1 1106 . 14 1 1 A 96 96 TRP C C 96 175.661 174.294 1.367 1
1 1107 . 14 1 1 A 96 96 TRP CA C 96 55.090 55.913 -0.823 1
1 1108 . 14 1 1 A 96 96 TRP CB C 96 27.138 33.737 -6.599 1
1 1114 . 14 1 1 A 96 96 TRP N N 96 122.840 120.698 2.142 1
1 1116 . 14 1 1 A 97 97 ASP H H 97 7.344 9.121 -1.777 1
1 1117 . 14 1 1 A 97 97 ASP HA H 97 4.829 5.253 -0.424 1
1 1120 . 14 1 1 A 97 97 ASP C C 97 175.019 177.771 -2.752 1
1 1121 . 14 1 1 A 97 97 ASP CA C 97 52.149 52.896 -0.747 1
1 1122 . 14 1 1 A 97 97 ASP CB C 97 42.697 43.299 -0.602 1
1 1123 . 14 1 1 A 97 97 ASP N N 97 126.861 123.348 3.513 1
1 1124 . 14 1 1 A 98 98 PHE H H 98 8.566 9.316 -0.750 1
1 1125 . 14 1 1 A 98 98 PHE HA H 98 3.727 4.319 -0.592 1
1 1133 . 14 1 1 A 98 98 PHE C C 98 177.443 176.284 1.159 1
1 1134 . 14 1 1 A 98 98 PHE CA C 98 62.471 60.236 2.235 1
1 1135 . 14 1 1 A 98 98 PHE CB C 98 39.919 38.024 1.895 1
1 1141 . 14 1 1 A 98 98 PHE N N 98 117.781 123.785 -6.004 1
1 1142 . 14 1 1 A 99 99 ASP H H 99 8.259 8.044 0.215 1
1 1143 . 14 1 1 A 99 99 ASP HA H 99 3.960 4.171 -0.211 1
1 1146 . 14 1 1 A 99 99 ASP C C 99 178.132 178.027 0.105 1
1 1147 . 14 1 1 A 99 99 ASP CA C 99 57.658 55.904 1.754 1
1 1148 . 14 1 1 A 99 99 ASP CB C 99 38.572 40.214 -1.642 1
1 1149 . 14 1 1 A 99 99 ASP N N 99 121.709 120.795 0.914 1
1 1150 . 14 1 1 A 100 100 MET H H 100 8.008 7.876 0.132 1
1 1151 . 14 1 1 A 100 100 MET HA H 100 3.644 4.321 -0.677 1
1 1156 . 14 1 1 A 100 100 MET C C 100 180.008 176.913 3.095 1
1 1157 . 14 1 1 A 100 100 MET CA C 100 58.598 57.842 0.756 1
1 1158 . 14 1 1 A 100 100 MET CB C 100 33.423 33.228 0.195 1
1 1160 . 14 1 1 A 100 100 MET N N 100 119.668 116.460 3.208 1
1 1161 . 14 1 1 A 101 101 LEU H H 101 7.961 7.339 0.622 1
1 1162 . 14 1 1 A 101 101 LEU HA H 101 3.523 4.321 -0.798 1
1 1172 . 14 1 1 A 101 101 LEU C C 101 173.873 175.803 -1.930 1
1 1173 . 14 1 1 A 101 101 LEU CA C 101 58.743 54.181 4.562 1
1 1174 . 14 1 1 A 101 101 LEU CB C 101 42.632 41.636 0.996 1
1 1178 . 14 1 1 A 101 101 LEU N N 101 119.752 114.690 5.062 1
1 1179 . 14 1 1 A 102 102 THR H H 102 6.955 7.933 -0.978 1
1 1180 . 14 1 1 A 102 102 THR HA H 102 4.134 4.040 0.094 1
1 1185 . 14 1 1 A 102 102 THR C C 102 176.513 173.029 3.484 1
1 1186 . 14 1 1 A 102 102 THR CA C 102 61.125 60.057 1.068 1
1 1187 . 14 1 1 A 102 102 THR CB C 102 71.415 69.911 1.504 1
1 1189 . 14 1 1 A 102 102 THR N N 102 124.665 116.713 7.952 1
1 1190 . 14 1 1 A 103 103 GLY H H 103 7.816 8.803 -0.987 1
1 1191 . 14 1 1 A 103 103 GLY HA2 H 103 3.824 4.034 -0.210 1
1 1192 . 14 1 1 A 103 103 GLY HA3 H 103 3.824 4.131 -0.307 1
1 1193 . 14 1 1 A 103 103 GLY C C 103 174.126 174.592 -0.466 1
1 1194 . 14 1 1 A 103 103 GLY CA C 103 47.805 46.633 1.172 1
1 1195 . 14 1 1 A 103 103 GLY N N 103 114.191 112.458 1.733 1
1 1196 . 14 1 1 A 104 104 SER H H 104 8.860 8.271 0.589 1
1 1197 . 14 1 1 A 104 104 SER HA H 104 4.758 4.200 0.558 1
1 1200 . 14 1 1 A 104 104 SER C C 104 174.591 174.698 -0.107 1
1 1201 . 14 1 1 A 104 104 SER CA C 104 56.755 61.136 -4.381 1
1 1202 . 14 1 1 A 104 104 SER CB C 104 65.050 62.899 2.151 1
1 1203 . 14 1 1 A 104 104 SER N N 104 114.771 117.989 -3.218 1
1 1204 . 14 1 1 A 105 105 GLY H H 105 8.788 7.887 0.901 1
1 1205 . 14 1 1 A 105 105 GLY HA2 H 105 3.733 3.980 -0.247 1
1 1206 . 14 1 1 A 105 105 GLY HA3 H 105 3.733 3.996 -0.263 1
1 1207 . 14 1 1 A 105 105 GLY CA C 105 47.247 45.368 1.879 1
1 1208 . 14 1 1 A 105 105 GLY N N 105 110.394 108.227 2.167 1
1 1209 . 14 1 1 A 106 106 ASN HA H 106 4.454 4.904 -0.450 1
1 1212 . 14 1 1 A 106 106 ASN C C 106 175.180 176.360 -1.180 1
1 1213 . 14 1 1 A 106 106 ASN CA C 106 54.492 54.101 0.391 1
1 1214 . 14 1 1 A 106 106 ASN CB C 106 37.282 40.945 -3.663 1
1 1215 . 14 1 1 A 107 107 TYR H H 107 8.241 8.151 0.090 1
1 1216 . 14 1 1 A 107 107 TYR HA H 107 4.335 4.794 -0.459 1
1 1223 . 14 1 1 A 107 107 TYR C C 107 173.954 176.755 -2.801 1
1 1224 . 14 1 1 A 107 107 TYR CA C 107 57.727 58.573 -0.846 1
1 1225 . 14 1 1 A 107 107 TYR CB C 107 37.063 39.385 -2.322 1
1 1230 . 14 1 1 A 107 107 TYR N N 107 120.708 116.131 4.577 1
1 1231 . 14 1 1 A 108 108 SER H H 108 7.117 7.260 -0.143 1
1 1232 . 14 1 1 A 108 108 SER HA H 108 4.221 4.076 0.145 1
1 1235 . 14 1 1 A 108 108 SER C C 108 174.834 173.826 1.008 1
1 1236 . 14 1 1 A 108 108 SER CA C 108 59.859 60.028 -0.169 1
1 1237 . 14 1 1 A 108 108 SER CB C 108 63.846 63.195 0.651 1
1 1238 . 14 1 1 A 108 108 SER N N 108 113.362 116.112 -2.750 1
1 1239 . 14 1 1 A 109 109 SER H H 109 8.053 8.198 -0.145 1
1 1240 . 14 1 1 A 109 109 SER HA H 109 4.560 4.305 0.255 1
1 1243 . 14 1 1 A 109 109 SER CA C 109 57.141 59.068 -1.927 1
1 1244 . 14 1 1 A 109 109 SER CB C 109 64.874 61.982 2.892 1
1 1245 . 14 1 1 A 109 109 SER N N 109 116.657 115.699 0.958 1
1 1246 . 14 1 1 A 110 110 THR HA H 110 3.541 3.833 -0.292 1
1 1251 . 14 1 1 A 110 110 THR C C 110 175.477 175.718 -0.241 1
1 1252 . 14 1 1 A 110 110 THR CA C 110 66.443 66.600 -0.157 1
1 1253 . 14 1 1 A 110 110 THR CB C 110 68.091 68.913 -0.822 1
1 1255 . 14 1 1 A 111 111 ASP H H 111 8.224 8.296 -0.072 1
1 1256 . 14 1 1 A 111 111 ASP HA H 111 4.237 4.324 -0.087 1
1 1259 . 14 1 1 A 111 111 ASP C C 111 177.520 178.075 -0.555 1
1 1260 . 14 1 1 A 111 111 ASP CA C 111 57.559 57.543 0.016 1
1 1261 . 14 1 1 A 111 111 ASP CB C 111 40.292 41.059 -0.767 1
1 1262 . 14 1 1 A 111 111 ASP N N 111 119.490 121.137 -1.647 1
1 1263 . 14 1 1 A 112 112 ALA H H 112 7.431 8.196 -0.765 1
1 1264 . 14 1 1 A 112 112 ALA HA H 112 4.191 4.122 0.069 1
1 1268 . 14 1 1 A 112 112 ALA C C 112 180.646 179.814 0.832 1
1 1269 . 14 1 1 A 112 112 ALA CA C 112 54.534 55.353 -0.819 1
1 1270 . 14 1 1 A 112 112 ALA CB C 112 18.992 18.375 0.617 1
1 1271 . 14 1 1 A 112 112 ALA N N 112 119.710 121.054 -1.344 1
1 1272 . 14 1 1 A 113 113 GLN H H 113 7.576 7.549 0.027 1
1 1273 . 14 1 1 A 113 113 GLN HA H 113 3.562 4.287 -0.725 1
1 1278 . 14 1 1 A 113 113 GLN C C 113 176.756 178.490 -1.734 1
1 1279 . 14 1 1 A 113 113 GLN CA C 113 57.736 57.687 0.049 1
1 1280 . 14 1 1 A 113 113 GLN CB C 113 29.110 28.709 0.401 1
1 1281 . 14 1 1 A 113 113 GLN N N 113 117.518 117.188 0.330 1
1 1283 . 14 1 1 A 114 114 MET H H 114 8.192 8.381 -0.189 1
1 1284 . 14 1 1 A 114 114 MET HA H 114 4.231 4.357 -0.126 1
1 1289 . 14 1 1 A 114 114 MET C C 114 175.648 178.349 -2.701 1
1 1290 . 14 1 1 A 114 114 MET CA C 114 57.446 57.801 -0.355 1
1 1291 . 14 1 1 A 114 114 MET CB C 114 33.570 32.249 1.321 1
1 1293 . 14 1 1 A 114 114 MET N N 114 111.509 119.137 -7.628 1
1 1294 . 14 1 1 A 115 115 GLN H H 115 6.940 7.483 -0.543 1
1 1295 . 14 1 1 A 115 115 GLN HA H 115 4.307 4.268 0.039 1
1 1302 . 14 1 1 A 115 115 GLN C C 115 176.270 175.568 0.702 1
1 1303 . 14 1 1 A 115 115 GLN CA C 115 54.680 56.624 -1.944 1
1 1304 . 14 1 1 A 115 115 GLN CB C 115 28.233 28.815 -0.582 1
1 1306 . 14 1 1 A 115 115 GLN N N 115 114.300 117.650 -3.350 1
1 1308 . 14 1 1 A 116 116 TYR H H 116 6.677 8.163 -1.486 1
1 1309 . 14 1 1 A 116 116 TYR HA H 116 4.193 4.191 0.002 1
1 1312 . 14 1 1 A 116 116 TYR C C 116 175.268 174.357 0.911 1
1 1313 . 14 1 1 A 116 116 TYR CA C 116 54.357 58.735 -4.378 1
1 1314 . 14 1 1 A 116 116 TYR CB C 116 35.498 36.410 -0.912 1
1 1315 . 14 1 1 A 116 116 TYR N N 116 117.919 118.704 -0.785 1
1 1316 . 14 1 1 A 117 117 ASP H H 117 8.081 8.642 -0.561 1
1 1317 . 14 1 1 A 117 117 ASP HA H 117 4.665 4.925 -0.260 1
1 1320 . 14 1 1 A 117 117 ASP CA C 117 52.422 50.570 1.852 1
1 1321 . 14 1 1 A 117 117 ASP CB C 117 42.416 41.784 0.632 1
1 1322 . 14 1 1 A 117 117 ASP N N 117 120.887 125.951 -5.064 1
1 1323 . 14 1 1 A 118 118 PRO C C 118 179.180 178.653 0.527 1
1 1324 . 14 1 1 A 118 118 PRO CA C 118 65.942 64.770 1.172 1
1 1325 . 14 1 1 A 118 118 PRO CB C 118 32.197 31.765 0.432 1
1 1326 . 14 1 1 A 119 119 GLY H H 119 9.742 8.249 1.493 1
1 1327 . 14 1 1 A 119 119 GLY C C 119 175.622 174.982 0.640 1
1 1328 . 14 1 1 A 119 119 GLY CA C 119 46.785 46.486 0.299 1
1 1329 . 14 1 1 A 119 119 GLY N N 119 106.412 106.581 -0.169 1
1 1330 . 14 1 1 A 120 120 LEU H H 120 6.666 7.189 -0.523 1
1 1331 . 14 1 1 A 120 120 LEU HA H 120 3.365 3.192 0.173 1
1 1341 . 14 1 1 A 120 120 LEU C C 120 179.262 178.557 0.705 1
1 1342 . 14 1 1 A 120 120 LEU CA C 120 56.605 57.506 -0.901 1
1 1343 . 14 1 1 A 120 120 LEU CB C 120 39.262 41.330 -2.068 1
1 1347 . 14 1 1 A 120 120 LEU N N 120 126.226 122.028 4.198 1
1 1348 . 14 1 1 A 121 121 PHE H H 121 7.356 8.626 -1.270 1
1 1349 . 14 1 1 A 121 121 PHE HA H 121 4.459 4.040 0.419 1
1 1352 . 14 1 1 A 121 121 PHE C C 121 179.716 176.642 3.074 1
1 1353 . 14 1 1 A 121 121 PHE CA C 121 62.838 62.141 0.697 1
1 1354 . 14 1 1 A 121 121 PHE CB C 121 37.603 39.283 -1.680 1
1 1355 . 14 1 1 A 121 121 PHE N N 121 117.437 119.381 -1.944 1
1 1356 . 14 1 1 A 122 122 ALA H H 122 7.926 7.892 0.034 1
1 1357 . 14 1 1 A 122 122 ALA HA H 122 4.523 3.656 0.867 1
1 1361 . 14 1 1 A 122 122 ALA C C 122 180.435 179.894 0.541 1
1 1362 . 14 1 1 A 122 122 ALA CA C 122 55.527 55.193 0.334 1
1 1363 . 14 1 1 A 122 122 ALA CB C 122 17.814 17.810 0.004 1
1 1364 . 14 1 1 A 122 122 ALA N N 122 121.068 120.999 0.069 1
1 1365 . 14 1 1 A 123 123 GLN H H 123 7.507 8.207 -0.700 1
1 1366 . 14 1 1 A 123 123 GLN HA H 123 4.153 3.881 0.272 1
1 1371 . 14 1 1 A 123 123 GLN C C 123 180.561 178.629 1.932 1
1 1372 . 14 1 1 A 123 123 GLN CA C 123 59.948 59.352 0.596 1
1 1373 . 14 1 1 A 123 123 GLN CB C 123 29.135 28.097 1.038 1
1 1375 . 14 1 1 A 123 123 GLN N N 123 120.324 117.083 3.241 1
1 1376 . 14 1 1 A 124 124 ILE H H 124 8.318 8.252 0.066 1
1 1377 . 14 1 1 A 124 124 ILE HA H 124 3.635 3.353 0.282 1
1 1387 . 14 1 1 A 124 124 ILE C C 124 176.481 177.686 -1.205 1
1 1388 . 14 1 1 A 124 124 ILE CA C 124 66.432 64.793 1.639 1
1 1389 . 14 1 1 A 124 124 ILE CB C 124 39.168 37.911 1.257 1
1 1393 . 14 1 1 A 124 124 ILE N N 124 123.747 121.017 2.730 1
1 1394 . 14 1 1 A 125 125 GLN H H 125 8.474 8.436 0.038 1
1 1395 . 14 1 1 A 125 125 GLN HA H 125 4.264 3.949 0.315 1
1 1402 . 14 1 1 A 125 125 GLN C C 125 178.947 177.642 1.305 1
1 1403 . 14 1 1 A 125 125 GLN CA C 125 59.651 58.369 1.282 1
1 1404 . 14 1 1 A 125 125 GLN CB C 125 28.880 27.700 1.180 1
1 1406 . 14 1 1 A 125 125 GLN N N 125 120.368 119.469 0.899 1
1 1408 . 14 1 1 A 126 126 ALA H H 126 8.002 7.614 0.388 1
1 1409 . 14 1 1 A 126 126 ALA HA H 126 4.144 4.148 -0.004 1
1 1413 . 14 1 1 A 126 126 ALA C C 126 179.316 179.686 -0.370 1
1 1414 . 14 1 1 A 126 126 ALA CA C 126 55.036 54.740 0.296 1
1 1415 . 14 1 1 A 126 126 ALA CB C 126 18.087 18.244 -0.157 1
1 1416 . 14 1 1 A 126 126 ALA N N 126 121.661 121.477 0.184 1
1 1417 . 14 1 1 A 127 127 ALA H H 127 7.823 7.521 0.302 1
1 1418 . 14 1 1 A 127 127 ALA HA H 127 4.162 4.148 0.014 1
1 1422 . 14 1 1 A 127 127 ALA C C 127 180.707 179.362 1.345 1
1 1423 . 14 1 1 A 127 127 ALA CA C 127 55.080 54.894 0.186 1
1 1424 . 14 1 1 A 127 127 ALA CB C 127 19.354 18.318 1.036 1
1 1425 . 14 1 1 A 127 127 ALA N N 127 119.853 119.815 0.038 1
1 1426 . 14 1 1 A 128 128 ALA H H 128 8.936 8.244 0.692 1
1 1427 . 14 1 1 A 128 128 ALA HA H 128 3.928 4.135 -0.207 1
1 1431 . 14 1 1 A 128 128 ALA C C 128 181.031 179.427 1.604 1
1 1432 . 14 1 1 A 128 128 ALA CA C 128 55.502 54.770 0.732 1
1 1433 . 14 1 1 A 128 128 ALA CB C 128 16.609 17.336 -0.727 1
1 1434 . 14 1 1 A 128 128 ALA N N 128 121.355 120.593 0.762 1
1 1435 . 14 1 1 A 129 129 THR H H 129 8.543 7.549 0.994 1
1 1436 . 14 1 1 A 129 129 THR HA H 129 4.015 3.949 0.066 1
1 1441 . 14 1 1 A 129 129 THR C C 129 177.332 176.066 1.266 1
1 1442 . 14 1 1 A 129 129 THR CA C 129 65.893 65.102 0.791 1
1 1443 . 14 1 1 A 129 129 THR CB C 129 68.566 68.694 -0.128 1
1 1445 . 14 1 1 A 129 129 THR N N 129 112.709 112.791 -0.082 1
1 1446 . 14 1 1 A 130 130 LYS H H 130 8.126 7.671 0.455 1
1 1447 . 14 1 1 A 130 130 LYS HA H 130 4.000 4.037 -0.037 1
1 1456 . 14 1 1 A 130 130 LYS C C 130 179.082 178.650 0.432 1
1 1457 . 14 1 1 A 130 130 LYS CA C 130 60.299 58.918 1.381 1
1 1458 . 14 1 1 A 130 130 LYS CB C 130 32.767 32.195 0.572 1
1 1462 . 14 1 1 A 130 130 LYS N N 130 123.879 120.705 3.174 1
1 1463 . 14 1 1 A 131 131 ALA H H 131 7.184 7.926 -0.742 1
1 1464 . 14 1 1 A 131 131 ALA HA H 131 4.005 4.306 -0.301 1
1 1468 . 14 1 1 A 131 131 ALA C C 131 178.482 179.629 -1.147 1
1 1469 . 14 1 1 A 131 131 ALA CA C 131 55.027 55.246 -0.219 1
1 1470 . 14 1 1 A 131 131 ALA CB C 131 18.669 19.328 -0.659 1
1 1471 . 14 1 1 A 131 131 ALA N N 131 118.590 120.770 -2.180 1
1 1472 . 14 1 1 A 132 132 TRP H H 132 7.977 8.795 -0.818 1
1 1473 . 14 1 1 A 132 132 TRP HA H 132 4.001 4.165 -0.164 1
1 1480 . 14 1 1 A 132 132 TRP C C 132 177.332 175.983 1.349 1
1 1481 . 14 1 1 A 132 132 TRP CA C 132 60.431 57.717 2.714 1
1 1482 . 14 1 1 A 132 132 TRP CB C 132 27.786 27.820 -0.034 1
1 1486 . 14 1 1 A 132 132 TRP N N 132 119.168 117.222 1.946 1
1 1488 . 14 1 1 A 133 133 ARG H H 133 8.006 8.059 -0.053 1
1 1489 . 14 1 1 A 133 133 ARG HA H 133 4.027 4.485 -0.458 1
1 1497 . 14 1 1 A 133 133 ARG C C 133 176.664 178.096 -1.432 1
1 1498 . 14 1 1 A 133 133 ARG CA C 133 59.355 57.294 2.061 1
1 1499 . 14 1 1 A 133 133 ARG CB C 133 30.451 32.430 -1.979 1
1 1502 . 14 1 1 A 133 133 ARG N N 133 113.062 120.723 -7.661 1
1 1504 . 14 1 1 A 134 134 LYS H H 134 7.322 7.928 -0.606 1
1 1505 . 14 1 1 A 134 134 LYS HA H 134 4.313 4.312 0.001 1
1 1514 . 14 1 1 A 134 134 LYS C C 134 176.282 176.196 0.086 1
1 1515 . 14 1 1 A 134 134 LYS CA C 134 54.922 56.911 -1.989 1
1 1516 . 14 1 1 A 134 134 LYS CB C 134 32.633 32.208 0.425 1
1 1520 . 14 1 1 A 134 134 LYS N N 134 118.170 116.361 1.809 1
1 1521 . 14 1 1 A 135 135 LEU H H 135 7.440 7.858 -0.418 1
1 1522 . 14 1 1 A 135 135 LEU HA H 135 4.174 4.490 -0.316 1
1 1532 . 14 1 1 A 135 135 LEU CA C 135 54.408 52.444 1.964 1
1 1533 . 14 1 1 A 135 135 LEU CB C 135 40.407 41.877 -1.470 1
1 1537 . 14 1 1 A 135 135 LEU N N 135 123.358 123.106 0.252 1
1 1538 . 14 1 1 A 136 136 PRO HA H 136 4.437 4.939 -0.502 1
1 1545 . 14 1 1 A 136 136 PRO C C 136 177.106 176.822 0.284 1
1 1546 . 14 1 1 A 136 136 PRO CA C 136 62.889 62.559 0.330 1
1 1547 . 14 1 1 A 136 136 PRO CB C 136 32.192 31.608 0.584 1
1 1550 . 14 1 1 A 137 137 VAL H H 137 8.219 8.354 -0.135 1
1 1551 . 14 1 1 A 137 137 VAL HA H 137 4.077 4.167 -0.090 1
1 1559 . 14 1 1 A 137 137 VAL C C 137 176.305 174.947 1.358 1
1 1560 . 14 1 1 A 137 137 VAL CA C 137 61.958 63.079 -1.121 1
1 1561 . 14 1 1 A 137 137 VAL CB C 137 32.755 30.772 1.983 1
1 1564 . 14 1 1 A 137 137 VAL N N 137 120.079 116.772 3.307 1
1 1565 . 14 1 1 A 138 138 LYS H H 138 8.444 8.790 -0.346 1
1 1566 . 14 1 1 A 138 138 LYS HA H 138 4.316 4.411 -0.095 1
1 1575 . 14 1 1 A 138 138 LYS C C 138 176.790 176.095 0.695 1
1 1576 . 14 1 1 A 138 138 LYS CA C 138 56.792 55.366 1.426 1
1 1577 . 14 1 1 A 138 138 LYS CB C 138 33.205 31.137 2.068 1
1 1581 . 14 1 1 A 138 138 LYS N N 138 126.449 126.582 -0.133 1
1 1582 . 14 1 1 A 139 139 GLY H H 139 8.518 8.533 -0.015 1
1 1583 . 14 1 1 A 139 139 GLY HA2 H 139 4.070 3.848 0.222 1
1 1584 . 14 1 1 A 139 139 GLY HA3 H 139 3.897 3.848 0.049 1
1 1585 . 14 1 1 A 139 139 GLY C C 139 172.874 172.891 -0.017 1
1 1586 . 14 1 1 A 139 139 GLY CA C 139 45.157 47.388 -2.231 1
1 1587 . 14 1 1 A 139 139 GLY N N 139 112.617 111.587 1.030 1
1 6 . 15 1 1 A 2 2 VAL H H 2 8.992 7.697 1.295 1
1 7 . 15 1 1 A 2 2 VAL HA H 2 5.370 4.908 0.462 1
1 15 . 15 1 1 A 2 2 VAL C C 2 174.325 173.871 0.454 1
1 16 . 15 1 1 A 2 2 VAL CA C 2 61.267 60.637 0.630 1
1 17 . 15 1 1 A 2 2 VAL CB C 2 33.890 35.494 -1.604 1
1 20 . 15 1 1 A 2 2 VAL N N 2 126.939 116.763 10.176 1
1 21 . 15 1 1 A 3 3 THR H H 3 8.912 8.932 -0.020 1
1 22 . 15 1 1 A 3 3 THR HA H 3 4.505 5.437 -0.932 1
1 27 . 15 1 1 A 3 3 THR C C 3 172.710 173.194 -0.484 1
1 28 . 15 1 1 A 3 3 THR CA C 3 59.689 59.891 -0.202 1
1 29 . 15 1 1 A 3 3 THR CB C 3 72.398 71.628 0.770 1
1 31 . 15 1 1 A 3 3 THR N N 3 118.091 123.213 -5.122 1
1 32 . 15 1 1 A 4 4 GLU H H 4 8.631 9.143 -0.512 1
1 33 . 15 1 1 A 4 4 GLU HA H 4 5.788 5.070 0.718 1
1 38 . 15 1 1 A 4 4 GLU C C 4 175.758 174.334 1.424 1
1 39 . 15 1 1 A 4 4 GLU CA C 4 54.902 54.059 0.843 1
1 40 . 15 1 1 A 4 4 GLU CB C 4 35.097 33.795 1.302 1
1 42 . 15 1 1 A 4 4 GLU N N 4 120.966 125.954 -4.988 1
1 43 . 15 1 1 A 5 5 THR H H 5 9.188 8.665 0.523 1
1 44 . 15 1 1 A 5 5 THR HA H 5 4.739 4.857 -0.118 1
1 49 . 15 1 1 A 5 5 THR C C 5 172.757 172.260 0.497 1
1 50 . 15 1 1 A 5 5 THR CA C 5 60.382 60.395 -0.013 1
1 51 . 15 1 1 A 5 5 THR CB C 5 71.558 70.843 0.715 1
1 53 . 15 1 1 A 5 5 THR N N 5 119.366 114.586 4.780 1
1 54 . 15 1 1 A 6 6 VAL H H 6 8.476 8.718 -0.242 1
1 55 . 15 1 1 A 6 6 VAL HA H 6 5.026 5.410 -0.384 1
1 63 . 15 1 1 A 6 6 VAL C C 6 176.674 174.910 1.764 1
1 64 . 15 1 1 A 6 6 VAL CA C 6 61.008 61.340 -0.332 1
1 65 . 15 1 1 A 6 6 VAL CB C 6 33.861 33.025 0.836 1
1 68 . 15 1 1 A 6 6 VAL N N 6 121.384 124.556 -3.172 1
1 69 . 15 1 1 A 7 7 ASP H H 7 8.848 8.742 0.106 1
1 70 . 15 1 1 A 7 7 ASP HA H 7 4.797 4.805 -0.008 1
1 73 . 15 1 1 A 7 7 ASP CA C 7 52.834 54.079 -1.245 1
1 74 . 15 1 1 A 7 7 ASP CB C 7 42.219 42.463 -0.244 1
1 75 . 15 1 1 A 7 7 ASP N N 7 127.061 128.126 -1.065 1
1 76 . 15 1 1 A 8 8 GLY C C 8 175.143 174.655 0.488 1
1 77 . 15 1 1 A 8 8 GLY CA C 8 46.553 46.896 -0.343 1
1 78 . 15 1 1 A 9 9 GLN H H 9 8.408 8.489 -0.081 1
1 79 . 15 1 1 A 9 9 GLN HA H 9 4.541 4.511 0.030 1
1 86 . 15 1 1 A 9 9 GLN C C 9 176.463 176.204 0.259 1
1 87 . 15 1 1 A 9 9 GLN CA C 9 55.167 54.722 0.445 1
1 88 . 15 1 1 A 9 9 GLN CB C 9 29.376 30.868 -1.492 1
1 90 . 15 1 1 A 9 9 GLN N N 9 118.300 118.276 0.024 1
1 92 . 15 1 1 A 10 10 GLY H H 10 8.162 8.175 -0.013 1
1 93 . 15 1 1 A 10 10 GLY HA2 H 10 4.174 3.932 0.242 1
1 94 . 15 1 1 A 10 10 GLY HA3 H 10 3.521 3.946 -0.425 1
1 95 . 15 1 1 A 10 10 GLY C C 10 174.092 173.853 0.239 1
1 96 . 15 1 1 A 10 10 GLY CA C 10 45.558 46.476 -0.918 1
1 97 . 15 1 1 A 10 10 GLY N N 10 108.747 110.234 -1.487 1
1 98 . 15 1 1 A 11 11 GLN H H 11 8.507 7.658 0.849 1
1 99 . 15 1 1 A 11 11 GLN HA H 11 4.202 4.849 -0.647 1
1 106 . 15 1 1 A 11 11 GLN C C 11 173.992 174.464 -0.472 1
1 107 . 15 1 1 A 11 11 GLN CA C 11 55.098 53.758 1.340 1
1 108 . 15 1 1 A 11 11 GLN CB C 11 29.097 31.995 -2.898 1
1 110 . 15 1 1 A 11 11 GLN N N 11 122.979 115.612 7.367 1
1 112 . 15 1 1 A 12 12 ALA H H 12 8.259 8.803 -0.544 1
1 113 . 15 1 1 A 12 12 ALA HA H 12 5.156 5.758 -0.602 1
1 117 . 15 1 1 A 12 12 ALA C C 12 177.284 176.370 0.914 1
1 118 . 15 1 1 A 12 12 ALA CA C 12 51.087 50.698 0.389 1
1 119 . 15 1 1 A 12 12 ALA CB C 12 20.500 21.407 -0.907 1
1 120 . 15 1 1 A 12 12 ALA N N 12 127.100 122.167 4.933 1
1 121 . 15 1 1 A 13 13 TRP H H 13 9.245 8.964 0.281 1
1 122 . 15 1 1 A 13 13 TRP HA H 13 4.717 5.344 -0.627 1
1 131 . 15 1 1 A 13 13 TRP C C 13 175.108 174.334 0.774 1
1 132 . 15 1 1 A 13 13 TRP CA C 13 55.966 55.591 0.375 1
1 133 . 15 1 1 A 13 13 TRP CB C 13 31.912 32.050 -0.138 1
1 139 . 15 1 1 A 13 13 TRP N N 13 123.088 119.687 3.401 1
1 141 . 15 1 1 A 14 14 ARG H H 14 8.575 8.693 -0.118 1
1 142 . 15 1 1 A 14 14 ARG HA H 14 5.335 4.352 0.983 1
1 150 . 15 1 1 A 14 14 ARG C C 14 175.191 174.112 1.079 1
1 151 . 15 1 1 A 14 14 ARG CA C 14 53.106 55.134 -2.028 1
1 152 . 15 1 1 A 14 14 ARG CB C 14 32.749 31.595 1.154 1
1 154 . 15 1 1 A 14 14 ARG N N 14 121.163 119.782 1.381 1
1 156 . 15 1 1 A 15 15 HIS H H 15 8.595 8.100 0.495 1
1 157 . 15 1 1 A 15 15 HIS HA H 15 4.790 5.216 -0.426 1
1 161 . 15 1 1 A 15 15 HIS C C 15 173.770 174.039 -0.269 1
1 162 . 15 1 1 A 15 15 HIS CA C 15 55.289 54.682 0.607 1
1 163 . 15 1 1 A 15 15 HIS CB C 15 33.208 33.346 -0.138 1
1 165 . 15 1 1 A 15 15 HIS N N 15 117.643 119.326 -1.683 1
1 166 . 15 1 1 A 16 16 HIS H H 16 8.993 8.989 0.004 1
1 167 . 15 1 1 A 16 16 HIS HA H 16 5.158 5.058 0.100 1
1 171 . 15 1 1 A 16 16 HIS C C 16 173.608 173.929 -0.321 1
1 172 . 15 1 1 A 16 16 HIS CA C 16 56.450 54.745 1.705 1
1 173 . 15 1 1 A 16 16 HIS CB C 16 34.171 32.729 1.442 1
1 175 . 15 1 1 A 16 16 HIS N N 16 123.520 122.978 0.542 1
1 176 . 15 1 1 A 17 17 ASN H H 17 7.829 9.359 -1.530 1
1 177 . 15 1 1 A 17 17 ASN HA H 17 4.713 5.129 -0.416 1
1 182 . 15 1 1 A 17 17 ASN C C 17 173.682 175.235 -1.553 1
1 183 . 15 1 1 A 17 17 ASN CA C 17 51.822 51.646 0.176 1
1 184 . 15 1 1 A 17 17 ASN CB C 17 43.176 41.965 1.211 1
1 185 . 15 1 1 A 17 17 ASN N N 17 122.213 123.759 -1.546 1
1 187 . 15 1 1 A 18 18 GLY H H 18 8.423 8.353 0.070 1
1 188 . 15 1 1 A 18 18 GLY HA2 H 18 3.931 3.541 0.390 1
1 189 . 15 1 1 A 18 18 GLY HA3 H 18 3.707 3.838 -0.131 1
1 190 . 15 1 1 A 18 18 GLY C C 18 173.985 173.121 0.864 1
1 191 . 15 1 1 A 18 18 GLY CA C 18 43.949 44.692 -0.743 1
1 192 . 15 1 1 A 18 18 GLY N N 18 106.991 107.623 -0.632 1
1 193 . 15 1 1 A 19 19 PHE H H 19 8.338 7.608 0.730 1
1 194 . 15 1 1 A 19 19 PHE HA H 19 4.068 4.489 -0.421 1
1 197 . 15 1 1 A 19 19 PHE C C 19 176.568 175.159 1.409 1
1 198 . 15 1 1 A 19 19 PHE CA C 19 59.338 59.461 -0.123 1
1 199 . 15 1 1 A 19 19 PHE CB C 19 40.201 39.593 0.608 1
1 200 . 15 1 1 A 19 19 PHE N N 19 116.857 118.806 -1.949 1
1 201 . 15 1 1 A 20 20 ASP H H 20 8.794 8.871 -0.077 1
1 202 . 15 1 1 A 20 20 ASP HA H 20 4.485 4.721 -0.236 1
1 205 . 15 1 1 A 20 20 ASP C C 20 177.379 177.067 0.312 1
1 206 . 15 1 1 A 20 20 ASP CA C 20 54.140 54.929 -0.789 1
1 207 . 15 1 1 A 20 20 ASP CB C 20 41.915 40.700 1.215 1
1 208 . 15 1 1 A 20 20 ASP N N 20 123.025 124.481 -1.456 1
1 209 . 15 1 1 A 21 21 PHE H H 21 8.862 9.080 -0.218 1
1 210 . 15 1 1 A 21 21 PHE HA H 21 4.087 4.116 -0.029 1
1 218 . 15 1 1 A 21 21 PHE C C 21 176.952 177.199 -0.247 1
1 219 . 15 1 1 A 21 21 PHE CA C 21 61.095 62.342 -1.247 1
1 220 . 15 1 1 A 21 21 PHE CB C 21 38.678 39.395 -0.717 1
1 226 . 15 1 1 A 21 21 PHE N N 21 127.163 125.716 1.447 1
1 227 . 15 1 1 A 22 22 ALA H H 22 8.561 8.395 0.166 1
1 228 . 15 1 1 A 22 22 ALA HA H 22 3.878 3.959 -0.081 1
1 232 . 15 1 1 A 22 22 ALA C C 22 180.710 179.926 0.784 1
1 233 . 15 1 1 A 22 22 ALA CA C 22 55.211 55.166 0.045 1
1 234 . 15 1 1 A 22 22 ALA CB C 22 18.321 18.475 -0.154 1
1 235 . 15 1 1 A 22 22 ALA N N 22 120.293 121.231 -0.938 1
1 236 . 15 1 1 A 23 23 VAL H H 23 7.241 7.647 -0.406 1
1 237 . 15 1 1 A 23 23 VAL HA H 23 3.684 3.550 0.134 1
1 245 . 15 1 1 A 23 23 VAL C C 23 177.101 178.084 -0.983 1
1 246 . 15 1 1 A 23 23 VAL CA C 23 65.237 67.070 -1.833 1
1 247 . 15 1 1 A 23 23 VAL CB C 23 31.780 31.486 0.294 1
1 250 . 15 1 1 A 23 23 VAL N N 23 118.775 117.323 1.452 1
1 251 . 15 1 1 A 24 24 ILE H H 24 6.761 8.269 -1.508 1
1 252 . 15 1 1 A 24 24 ILE HA H 24 3.196 3.491 -0.295 1
1 262 . 15 1 1 A 24 24 ILE C C 24 177.287 178.067 -0.780 1
1 263 . 15 1 1 A 24 24 ILE CA C 24 63.404 65.611 -2.207 1
1 264 . 15 1 1 A 24 24 ILE CB C 24 36.294 37.765 -1.471 1
1 268 . 15 1 1 A 24 24 ILE N N 24 119.036 120.132 -1.096 1
1 269 . 15 1 1 A 25 25 LYS H H 25 8.032 8.135 -0.103 1
1 270 . 15 1 1 A 25 25 LYS HA H 25 3.809 3.670 0.139 1
1 279 . 15 1 1 A 25 25 LYS C C 25 179.450 178.877 0.573 1
1 280 . 15 1 1 A 25 25 LYS CA C 25 59.621 59.474 0.147 1
1 281 . 15 1 1 A 25 25 LYS CB C 25 32.259 31.883 0.376 1
1 285 . 15 1 1 A 25 25 LYS N N 25 118.368 120.772 -2.404 1
1 286 . 15 1 1 A 26 26 GLU H H 26 7.845 7.767 0.078 1
1 287 . 15 1 1 A 26 26 GLU HA H 26 4.021 4.037 -0.016 1
1 292 . 15 1 1 A 26 26 GLU C C 26 179.191 179.122 0.069 1
1 293 . 15 1 1 A 26 26 GLU CA C 26 59.530 59.133 0.397 1
1 294 . 15 1 1 A 26 26 GLU CB C 26 29.449 29.354 0.095 1
1 296 . 15 1 1 A 26 26 GLU N N 26 120.522 119.241 1.281 1
1 297 . 15 1 1 A 27 27 LEU H H 27 8.165 7.867 0.298 1
1 298 . 15 1 1 A 27 27 LEU HA H 27 4.163 4.135 0.028 1
1 308 . 15 1 1 A 27 27 LEU C C 27 177.256 178.280 -1.024 1
1 309 . 15 1 1 A 27 27 LEU CA C 27 58.049 57.570 0.479 1
1 310 . 15 1 1 A 27 27 LEU CB C 27 41.365 41.583 -0.218 1
1 314 . 15 1 1 A 27 27 LEU N N 27 120.879 121.516 -0.637 1
1 315 . 15 1 1 A 28 28 LYS H H 28 8.902 8.343 0.559 1
1 316 . 15 1 1 A 28 28 LYS HA H 28 4.199 4.054 0.145 1
1 317 . 15 1 1 A 28 28 LYS C C 28 179.707 179.283 0.424 1
1 318 . 15 1 1 A 28 28 LYS CA C 28 60.097 59.159 0.938 1
1 319 . 15 1 1 A 28 28 LYS CB C 28 33.420 31.975 1.445 1
1 320 . 15 1 1 A 28 28 LYS N N 28 120.050 119.818 0.232 1
1 321 . 15 1 1 A 29 29 THR H H 29 8.294 8.113 0.181 1
1 322 . 15 1 1 A 29 29 THR HA H 29 3.892 3.924 -0.032 1
1 327 . 15 1 1 A 29 29 THR C C 29 175.711 176.155 -0.444 1
1 328 . 15 1 1 A 29 29 THR CA C 29 66.846 66.494 0.352 1
1 329 . 15 1 1 A 29 29 THR CB C 29 68.794 68.605 0.189 1
1 331 . 15 1 1 A 29 29 THR N N 29 115.933 116.281 -0.348 1
1 332 . 15 1 1 A 30 30 ALA H H 30 8.244 8.380 -0.136 1
1 333 . 15 1 1 A 30 30 ALA HA H 30 4.241 4.286 -0.045 1
1 337 . 15 1 1 A 30 30 ALA C C 30 179.128 179.956 -0.828 1
1 338 . 15 1 1 A 30 30 ALA CA C 30 55.714 55.419 0.295 1
1 339 . 15 1 1 A 30 30 ALA CB C 30 18.955 18.292 0.663 1
1 340 . 15 1 1 A 30 30 ALA N N 30 124.617 122.943 1.674 1
1 341 . 15 1 1 A 31 31 ALA H H 31 8.968 8.638 0.330 1
1 342 . 15 1 1 A 31 31 ALA HA H 31 3.890 4.188 -0.298 1
1 346 . 15 1 1 A 31 31 ALA C C 31 180.352 179.514 0.838 1
1 347 . 15 1 1 A 31 31 ALA CA C 31 55.454 55.245 0.209 1
1 348 . 15 1 1 A 31 31 ALA CB C 31 17.124 18.201 -1.077 1
1 349 . 15 1 1 A 31 31 ALA N N 31 119.327 120.734 -1.407 1
1 350 . 15 1 1 A 32 32 SER H H 32 7.995 8.223 -0.228 1
1 351 . 15 1 1 A 32 32 SER HA H 32 4.238 4.218 0.020 1
1 354 . 15 1 1 A 32 32 SER C C 32 175.612 177.384 -1.772 1
1 355 . 15 1 1 A 32 32 SER CA C 32 61.203 61.394 -0.191 1
1 356 . 15 1 1 A 32 32 SER CB C 32 63.406 63.094 0.312 1
1 357 . 15 1 1 A 32 32 SER N N 32 111.962 112.553 -0.591 1
1 358 . 15 1 1 A 33 33 GLN H H 33 8.333 7.951 0.382 1
1 359 . 15 1 1 A 33 33 GLN HA H 33 3.992 4.073 -0.081 1
1 366 . 15 1 1 A 33 33 GLN C C 33 177.486 177.295 0.191 1
1 367 . 15 1 1 A 33 33 GLN CA C 33 58.277 58.551 -0.274 1
1 368 . 15 1 1 A 33 33 GLN CB C 33 29.140 29.153 -0.013 1
1 370 . 15 1 1 A 33 33 GLN N N 33 119.527 121.350 -1.823 1
1 372 . 15 1 1 A 34 34 TYR H H 34 8.587 8.177 0.410 1
1 373 . 15 1 1 A 34 34 TYR HA H 34 4.792 4.682 0.110 1
1 380 . 15 1 1 A 34 34 TYR C C 34 176.499 176.453 0.046 1
1 381 . 15 1 1 A 34 34 TYR CA C 34 57.711 58.271 -0.560 1
1 382 . 15 1 1 A 34 34 TYR CB C 34 39.561 39.310 0.251 1
1 387 . 15 1 1 A 34 34 TYR N N 34 114.610 114.517 0.093 1
1 388 . 15 1 1 A 35 35 GLY H H 35 7.346 8.057 -0.711 1
1 389 . 15 1 1 A 35 35 GLY HA2 H 35 4.785 4.068 0.717 1
1 390 . 15 1 1 A 35 35 GLY HA3 H 35 4.007 4.083 -0.076 1
1 391 . 15 1 1 A 35 35 GLY C C 35 175.796 173.146 2.650 1
1 392 . 15 1 1 A 35 35 GLY CA C 35 44.355 44.768 -0.413 1
1 393 . 15 1 1 A 35 35 GLY N N 35 108.501 107.890 0.611 1
1 394 . 15 1 1 A 36 36 ALA H H 36 9.363 8.169 1.194 1
1 395 . 15 1 1 A 36 36 ALA HA H 36 4.217 4.768 -0.551 1
1 399 . 15 1 1 A 36 36 ALA C C 36 178.039 177.201 0.838 1
1 400 . 15 1 1 A 36 36 ALA CA C 36 56.114 51.417 4.697 1
1 401 . 15 1 1 A 36 36 ALA CB C 36 19.179 19.345 -0.166 1
1 402 . 15 1 1 A 36 36 ALA N N 36 125.811 123.461 2.350 1
1 403 . 15 1 1 A 37 37 THR H H 37 8.070 8.974 -0.904 1
1 404 . 15 1 1 A 37 37 THR HA H 37 4.570 4.613 -0.043 1
1 409 . 15 1 1 A 37 37 THR C C 37 173.685 174.121 -0.436 1
1 410 . 15 1 1 A 37 37 THR CA C 37 59.822 63.360 -3.538 1
1 411 . 15 1 1 A 37 37 THR CB C 37 68.267 71.371 -3.104 1
1 413 . 15 1 1 A 37 37 THR N N 37 129.410 118.485 10.925 1
1 414 . 15 1 1 A 38 38 ALA H H 38 6.853 7.792 -0.939 1
1 415 . 15 1 1 A 38 38 ALA HA H 38 4.601 4.505 0.096 1
1 419 . 15 1 1 A 38 38 ALA CA C 38 50.758 50.829 -0.071 1
1 420 . 15 1 1 A 38 38 ALA CB C 38 18.325 18.809 -0.484 1
1 421 . 15 1 1 A 38 38 ALA N N 38 124.674 124.504 0.170 1
1 422 . 15 1 1 A 40 40 TYR HA H 40 4.032 4.019 0.013 1
1 429 . 15 1 1 A 40 40 TYR C C 40 176.456 177.318 -0.862 1
1 430 . 15 1 1 A 40 40 TYR CA C 40 61.010 61.769 -0.759 1
1 431 . 15 1 1 A 40 40 TYR CB C 40 39.286 38.725 0.561 1
1 436 . 15 1 1 A 41 41 THR H H 41 6.874 8.303 -1.429 1
1 437 . 15 1 1 A 41 41 THR HA H 41 3.616 3.804 -0.188 1
1 442 . 15 1 1 A 41 41 THR C C 41 176.930 176.548 0.382 1
1 443 . 15 1 1 A 41 41 THR CA C 41 65.557 65.479 0.078 1
1 444 . 15 1 1 A 41 41 THR CB C 41 68.228 69.271 -1.043 1
1 446 . 15 1 1 A 41 41 THR N N 41 115.143 113.914 1.229 1
1 447 . 15 1 1 A 42 42 LEU H H 42 8.623 7.439 1.184 1
1 448 . 15 1 1 A 42 42 LEU HA H 42 3.708 4.076 -0.368 1
1 458 . 15 1 1 A 42 42 LEU C C 42 178.206 178.937 -0.731 1
1 459 . 15 1 1 A 42 42 LEU CA C 42 57.417 57.626 -0.209 1
1 460 . 15 1 1 A 42 42 LEU CB C 42 41.342 41.243 0.099 1
1 464 . 15 1 1 A 42 42 LEU N N 42 120.418 118.534 1.884 1
1 465 . 15 1 1 A 43 43 ALA H H 43 7.735 7.659 0.076 1
1 466 . 15 1 1 A 43 43 ALA HA H 43 4.020 3.983 0.037 1
1 470 . 15 1 1 A 43 43 ALA C C 43 180.826 180.543 0.283 1
1 471 . 15 1 1 A 43 43 ALA CA C 43 54.925 54.962 -0.037 1
1 472 . 15 1 1 A 43 43 ALA CB C 43 17.506 18.190 -0.684 1
1 473 . 15 1 1 A 43 43 ALA N N 43 120.203 122.019 -1.816 1
1 474 . 15 1 1 A 44 44 ILE H H 44 7.149 7.318 -0.169 1
1 475 . 15 1 1 A 44 44 ILE HA H 44 3.603 3.596 0.007 1
1 485 . 15 1 1 A 44 44 ILE C C 44 178.594 178.423 0.171 1
1 486 . 15 1 1 A 44 44 ILE CA C 44 64.782 63.972 0.810 1
1 487 . 15 1 1 A 44 44 ILE CB C 44 37.472 36.656 0.816 1
1 491 . 15 1 1 A 44 44 ILE N N 44 118.881 119.202 -0.321 1
1 492 . 15 1 1 A 45 45 VAL H H 45 7.968 8.058 -0.090 1
1 493 . 15 1 1 A 45 45 VAL HA H 45 2.925 3.405 -0.480 1
1 501 . 15 1 1 A 45 45 VAL C C 45 177.023 177.128 -0.105 1
1 502 . 15 1 1 A 45 45 VAL CA C 45 67.081 66.682 0.399 1
1 503 . 15 1 1 A 45 45 VAL CB C 45 30.854 31.033 -0.179 1
1 506 . 15 1 1 A 45 45 VAL N N 45 120.764 120.380 0.384 1
1 507 . 15 1 1 A 46 46 GLU H H 46 8.399 8.184 0.215 1
1 508 . 15 1 1 A 46 46 GLU HA H 46 3.848 3.862 -0.014 1
1 513 . 15 1 1 A 46 46 GLU C C 46 178.656 178.767 -0.111 1
1 514 . 15 1 1 A 46 46 GLU CA C 46 59.491 59.400 0.091 1
1 515 . 15 1 1 A 46 46 GLU CB C 46 28.991 29.230 -0.239 1
1 517 . 15 1 1 A 46 46 GLU N N 46 116.599 119.649 -3.050 1
1 518 . 15 1 1 A 47 47 SER H H 47 7.273 7.374 -0.101 1
1 519 . 15 1 1 A 47 47 SER HA H 47 4.287 4.127 0.160 1
1 521 . 15 1 1 A 47 47 SER CA C 47 61.047 61.190 -0.143 1
1 522 . 15 1 1 A 47 47 SER CB C 47 63.016 62.895 0.121 1
1 523 . 15 1 1 A 47 47 SER N N 47 113.609 115.623 -2.014 1
1 524 . 15 1 1 A 48 48 VAL H H 48 8.006 8.033 -0.027 1
1 525 . 15 1 1 A 48 48 VAL HA H 48 3.556 3.519 0.037 1
1 533 . 15 1 1 A 48 48 VAL C C 48 177.257 177.761 -0.504 1
1 534 . 15 1 1 A 48 48 VAL CA C 48 65.025 66.612 -1.587 1
1 535 . 15 1 1 A 48 48 VAL CB C 48 31.841 31.292 0.549 1
1 538 . 15 1 1 A 48 48 VAL N N 48 122.327 121.445 0.882 1
1 539 . 15 1 1 A 49 49 ALA H H 49 8.369 7.918 0.451 1
1 540 . 15 1 1 A 49 49 ALA HA H 49 4.115 4.281 -0.166 1
1 544 . 15 1 1 A 49 49 ALA C C 49 177.307 178.311 -1.004 1
1 545 . 15 1 1 A 49 49 ALA CA C 49 53.253 53.367 -0.114 1
1 546 . 15 1 1 A 49 49 ALA CB C 49 20.131 18.256 1.875 1
1 547 . 15 1 1 A 49 49 ALA N N 49 118.050 120.964 -2.914 1
1 548 . 15 1 1 A 50 50 ASP H H 50 7.052 7.982 -0.930 1
1 549 . 15 1 1 A 50 50 ASP HA H 50 4.788 4.342 0.446 1
1 552 . 15 1 1 A 50 50 ASP C C 50 175.481 176.491 -1.010 1
1 553 . 15 1 1 A 50 50 ASP CA C 50 53.681 56.552 -2.871 1
1 554 . 15 1 1 A 50 50 ASP CB C 50 39.333 40.984 -1.651 1
1 555 . 15 1 1 A 50 50 ASP N N 50 116.997 118.122 -1.125 1
1 556 . 15 1 1 A 51 51 ASN H H 51 8.535 7.572 0.963 1
1 557 . 15 1 1 A 51 51 ASN HA H 51 4.628 4.473 0.155 1
1 562 . 15 1 1 A 51 51 ASN C C 51 174.077 175.030 -0.953 1
1 563 . 15 1 1 A 51 51 ASN CA C 51 52.315 52.460 -0.145 1
1 564 . 15 1 1 A 51 51 ASN CB C 51 41.928 39.576 2.352 1
1 565 . 15 1 1 A 51 51 ASN N N 51 118.626 116.761 1.865 1
1 567 . 15 1 1 A 52 52 TRP H H 52 8.555 8.092 0.463 1
1 574 . 15 1 1 A 52 52 TRP C C 52 173.269 176.021 -2.752 1
1 575 . 15 1 1 A 52 52 TRP CA C 52 55.031 56.821 -1.790 1
1 576 . 15 1 1 A 52 52 TRP CB C 52 26.801 28.858 -2.057 1
1 582 . 15 1 1 A 52 52 TRP N N 52 120.693 121.583 -0.890 1
1 584 . 15 1 1 A 53 53 LEU H H 53 7.847 7.553 0.294 1
1 585 . 15 1 1 A 53 53 LEU HA H 53 4.859 4.391 0.468 1
1 595 . 15 1 1 A 53 53 LEU C C 53 177.397 176.802 0.595 1
1 596 . 15 1 1 A 53 53 LEU CA C 53 53.619 55.458 -1.839 1
1 597 . 15 1 1 A 53 53 LEU CB C 53 41.812 42.595 -0.783 1
1 601 . 15 1 1 A 53 53 LEU N N 53 124.741 119.879 4.862 1
1 602 . 15 1 1 A 54 54 THR H H 54 8.850 8.605 0.245 1
1 603 . 15 1 1 A 54 54 THR HA H 54 4.598 4.677 -0.079 1
1 608 . 15 1 1 A 54 54 THR CA C 54 60.531 60.128 0.403 1
1 609 . 15 1 1 A 54 54 THR CB C 54 67.183 68.871 -1.688 1
1 611 . 15 1 1 A 54 54 THR N N 54 113.407 113.366 0.041 1
1 612 . 15 1 1 A 55 55 PRO HA H 55 4.511 4.046 0.465 1
1 619 . 15 1 1 A 55 55 PRO C C 55 179.383 177.605 1.778 1
1 620 . 15 1 1 A 55 55 PRO CA C 55 67.159 65.468 1.691 1
1 621 . 15 1 1 A 55 55 PRO CB C 55 32.095 31.450 0.645 1
1 622 . 15 1 1 A 56 56 THR H H 56 8.575 7.717 0.858 1
1 623 . 15 1 1 A 56 56 THR HA H 56 4.229 4.181 0.048 1
1 628 . 15 1 1 A 56 56 THR C C 56 176.668 177.044 -0.376 1
1 629 . 15 1 1 A 56 56 THR CA C 56 66.943 65.283 1.660 1
1 630 . 15 1 1 A 56 56 THR CB C 56 68.129 68.799 -0.670 1
1 632 . 15 1 1 A 56 56 THR N N 56 114.855 111.558 3.297 1
1 633 . 15 1 1 A 57 57 ASP H H 57 8.730 8.237 0.493 1
1 634 . 15 1 1 A 57 57 ASP HA H 57 4.425 4.632 -0.207 1
1 637 . 15 1 1 A 57 57 ASP C C 57 178.351 179.329 -0.978 1
1 638 . 15 1 1 A 57 57 ASP CA C 57 57.963 57.757 0.206 1
1 639 . 15 1 1 A 57 57 ASP CB C 57 40.134 41.036 -0.902 1
1 640 . 15 1 1 A 57 57 ASP N N 57 126.239 122.106 4.133 1
1 641 . 15 1 1 A 58 58 TRP H H 58 8.244 8.537 -0.293 1
1 642 . 15 1 1 A 58 58 TRP HA H 58 4.030 4.556 -0.526 1
1 650 . 15 1 1 A 58 58 TRP C C 58 177.432 178.888 -1.456 1
1 651 . 15 1 1 A 58 58 TRP CA C 58 62.731 59.957 2.774 1
1 652 . 15 1 1 A 58 58 TRP CB C 58 29.122 29.431 -0.309 1
1 657 . 15 1 1 A 58 58 TRP N N 58 119.241 120.632 -1.391 1
1 659 . 15 1 1 A 59 59 ASN H H 59 8.098 8.871 -0.773 1
1 660 . 15 1 1 A 59 59 ASN HA H 59 4.424 4.481 -0.057 1
1 663 . 15 1 1 A 59 59 ASN C C 59 176.952 178.205 -1.253 1
1 664 . 15 1 1 A 59 59 ASN CA C 59 58.135 56.539 1.596 1
1 665 . 15 1 1 A 59 59 ASN CB C 59 40.168 39.221 0.947 1
1 666 . 15 1 1 A 59 59 ASN N N 59 115.747 117.631 -1.884 1
1 667 . 15 1 1 A 60 60 THR H H 60 8.712 8.095 0.617 1
1 668 . 15 1 1 A 60 60 THR HA H 60 3.717 3.957 -0.240 1
1 673 . 15 1 1 A 60 60 THR C C 60 176.044 176.658 -0.614 1
1 674 . 15 1 1 A 60 60 THR CA C 60 66.576 66.616 -0.040 1
1 675 . 15 1 1 A 60 60 THR CB C 60 69.251 67.604 1.647 1
1 677 . 15 1 1 A 60 60 THR N N 60 114.896 116.126 -1.230 1
1 678 . 15 1 1 A 61 61 LEU H H 61 8.485 8.245 0.240 1
1 679 . 15 1 1 A 61 61 LEU HA H 61 3.391 4.027 -0.636 1
1 689 . 15 1 1 A 61 61 LEU C C 61 177.433 178.483 -1.050 1
1 690 . 15 1 1 A 61 61 LEU CA C 61 58.354 58.516 -0.162 1
1 691 . 15 1 1 A 61 61 LEU CB C 61 41.761 42.214 -0.453 1
1 695 . 15 1 1 A 61 61 LEU N N 61 123.433 122.351 1.082 1
1 696 . 15 1 1 A 62 62 VAL H H 62 8.073 8.221 -0.148 1
1 697 . 15 1 1 A 62 62 VAL HA H 62 3.207 3.749 -0.542 1
1 705 . 15 1 1 A 62 62 VAL C C 62 177.585 177.876 -0.291 1
1 706 . 15 1 1 A 62 62 VAL CA C 62 67.345 65.178 2.167 1
1 707 . 15 1 1 A 62 62 VAL CB C 62 30.905 30.517 0.388 1
1 710 . 15 1 1 A 62 62 VAL N N 62 116.018 118.212 -2.194 1
1 711 . 15 1 1 A 63 63 ARG H H 63 7.765 7.705 0.060 1
1 712 . 15 1 1 A 63 63 ARG HA H 63 3.602 3.846 -0.244 1
1 719 . 15 1 1 A 63 63 ARG C C 63 177.818 178.759 -0.941 1
1 720 . 15 1 1 A 63 63 ARG CA C 63 58.049 59.869 -1.820 1
1 721 . 15 1 1 A 63 63 ARG CB C 63 29.955 29.926 0.029 1
1 724 . 15 1 1 A 63 63 ARG N N 63 116.700 121.656 -4.956 1
1 725 . 15 1 1 A 64 64 ALA H H 64 7.574 7.713 -0.139 1
1 726 . 15 1 1 A 64 64 ALA HA H 64 4.158 4.340 -0.182 1
1 730 . 15 1 1 A 64 64 ALA C C 64 179.886 179.308 0.578 1
1 731 . 15 1 1 A 64 64 ALA CA C 64 54.007 54.124 -0.117 1
1 732 . 15 1 1 A 64 64 ALA CB C 64 19.147 19.488 -0.341 1
1 733 . 15 1 1 A 64 64 ALA N N 64 117.555 120.871 -3.316 1
1 734 . 15 1 1 A 65 65 VAL H H 65 7.554 8.119 -0.565 1
1 735 . 15 1 1 A 65 65 VAL HA H 65 4.253 3.618 0.635 1
1 743 . 15 1 1 A 65 65 VAL C C 65 174.180 175.833 -1.653 1
1 744 . 15 1 1 A 65 65 VAL CA C 65 62.683 66.714 -4.031 1
1 745 . 15 1 1 A 65 65 VAL CB C 65 33.458 32.112 1.346 1
1 748 . 15 1 1 A 65 65 VAL N N 65 110.013 118.671 -8.658 1
1 749 . 15 1 1 A 66 66 LEU H H 66 7.792 7.375 0.417 1
1 750 . 15 1 1 A 66 66 LEU HA H 66 4.790 4.817 -0.027 1
1 760 . 15 1 1 A 66 66 LEU C C 66 177.537 175.421 2.116 1
1 761 . 15 1 1 A 66 66 LEU CA C 66 52.823 52.776 0.047 1
1 762 . 15 1 1 A 66 66 LEU CB C 66 44.071 45.598 -1.527 1
1 766 . 15 1 1 A 66 66 LEU N N 66 118.967 118.158 0.809 1
1 767 . 15 1 1 A 67 67 SER H H 67 9.208 8.281 0.927 1
1 768 . 15 1 1 A 67 67 SER HA H 67 4.414 4.777 -0.363 1
1 771 . 15 1 1 A 67 67 SER CA C 67 57.943 57.608 0.335 1
1 772 . 15 1 1 A 67 67 SER CB C 67 64.743 65.791 -1.048 1
1 773 . 15 1 1 A 67 67 SER N N 67 116.378 115.981 0.397 1
1 774 . 15 1 1 A 69 69 GLY HA2 H 69 3.916 3.770 0.146 1
1 775 . 15 1 1 A 69 69 GLY HA3 H 69 3.867 3.815 0.052 1
1 776 . 15 1 1 A 69 69 GLY C C 69 176.783 175.344 1.439 1
1 777 . 15 1 1 A 69 69 GLY CA C 69 46.977 47.046 -0.069 1
1 778 . 15 1 1 A 70 70 ASP H H 70 7.674 8.149 -0.475 1
1 779 . 15 1 1 A 70 70 ASP HA H 70 4.511 3.739 0.772 1
1 782 . 15 1 1 A 70 70 ASP C C 70 178.096 178.215 -0.119 1
1 783 . 15 1 1 A 70 70 ASP CA C 70 57.262 56.276 0.986 1
1 784 . 15 1 1 A 70 70 ASP CB C 70 40.594 39.869 0.725 1
1 785 . 15 1 1 A 70 70 ASP N N 70 123.930 122.179 1.751 1
1 786 . 15 1 1 A 71 71 HIS H H 71 8.729 7.899 0.830 1
1 787 . 15 1 1 A 71 71 HIS HA H 71 4.235 4.158 0.077 1
1 790 . 15 1 1 A 71 71 HIS C C 71 176.769 176.637 0.132 1
1 791 . 15 1 1 A 71 71 HIS CA C 71 60.041 59.944 0.097 1
1 792 . 15 1 1 A 71 71 HIS CB C 71 30.682 29.964 0.718 1
1 793 . 15 1 1 A 71 71 HIS N N 71 121.003 119.528 1.475 1
1 794 . 15 1 1 A 72 72 LEU H H 72 7.620 7.749 -0.129 1
1 795 . 15 1 1 A 72 72 LEU HA H 72 3.769 3.926 -0.157 1
1 805 . 15 1 1 A 72 72 LEU C C 72 180.275 179.406 0.869 1
1 806 . 15 1 1 A 72 72 LEU CA C 72 58.192 58.064 0.128 1
1 807 . 15 1 1 A 72 72 LEU CB C 72 41.381 41.304 0.077 1
1 811 . 15 1 1 A 72 72 LEU N N 72 118.569 117.912 0.657 1
1 812 . 15 1 1 A 73 73 LEU H H 73 7.542 8.073 -0.531 1
1 813 . 15 1 1 A 73 73 LEU HA H 73 4.107 4.142 -0.035 1
1 823 . 15 1 1 A 73 73 LEU C C 73 179.436 179.188 0.248 1
1 824 . 15 1 1 A 73 73 LEU CA C 73 58.026 57.401 0.625 1
1 825 . 15 1 1 A 73 73 LEU CB C 73 41.638 42.013 -0.375 1
1 829 . 15 1 1 A 73 73 LEU N N 73 121.418 120.945 0.473 1
1 830 . 15 1 1 A 74 74 TRP H H 74 8.786 8.401 0.385 1
1 831 . 15 1 1 A 74 74 TRP HA H 74 3.589 5.428 -1.839 1
1 840 . 15 1 1 A 74 74 TRP C C 74 176.816 178.751 -1.935 1
1 841 . 15 1 1 A 74 74 TRP CA C 74 63.046 59.952 3.094 1
1 842 . 15 1 1 A 74 74 TRP CB C 74 28.065 29.224 -1.159 1
1 848 . 15 1 1 A 74 74 TRP N N 74 121.111 118.124 2.987 1
1 850 . 15 1 1 A 75 75 LYS H H 75 8.939 7.921 1.018 1
1 851 . 15 1 1 A 75 75 LYS HA H 75 3.055 4.215 -1.160 1
1 860 . 15 1 1 A 75 75 LYS C C 75 177.967 179.387 -1.420 1
1 861 . 15 1 1 A 75 75 LYS CA C 75 60.029 58.700 1.329 1
1 862 . 15 1 1 A 75 75 LYS CB C 75 32.533 32.887 -0.354 1
1 866 . 15 1 1 A 75 75 LYS N N 75 119.783 118.677 1.106 1
1 867 . 15 1 1 A 76 76 SER H H 76 7.832 7.968 -0.136 1
1 868 . 15 1 1 A 76 76 SER HA H 76 4.040 4.318 -0.278 1
1 871 . 15 1 1 A 76 76 SER C C 76 177.816 175.912 1.904 1
1 872 . 15 1 1 A 76 76 SER CA C 76 62.105 62.040 0.065 1
1 873 . 15 1 1 A 76 76 SER CB C 76 62.679 63.001 -0.322 1
1 874 . 15 1 1 A 76 76 SER N N 76 113.395 116.907 -3.512 1
1 875 . 15 1 1 A 77 77 GLU H H 77 7.590 7.738 -0.148 1
1 876 . 15 1 1 A 77 77 GLU HA H 77 4.042 4.160 -0.118 1
1 881 . 15 1 1 A 77 77 GLU C C 77 177.809 178.788 -0.979 1
1 882 . 15 1 1 A 77 77 GLU CA C 77 58.270 59.185 -0.915 1
1 883 . 15 1 1 A 77 77 GLU CB C 77 29.208 29.222 -0.014 1
1 885 . 15 1 1 A 77 77 GLU N N 77 121.574 122.096 -0.522 1
1 886 . 15 1 1 A 78 78 PHE H H 78 9.081 7.872 1.209 1
1 887 . 15 1 1 A 78 78 PHE HA H 78 3.778 4.246 -0.468 1
1 895 . 15 1 1 A 78 78 PHE C C 78 178.114 177.436 0.678 1
1 896 . 15 1 1 A 78 78 PHE CA C 78 60.629 61.265 -0.636 1
1 897 . 15 1 1 A 78 78 PHE CB C 78 38.295 38.520 -0.225 1
1 902 . 15 1 1 A 78 78 PHE N N 78 122.682 120.961 1.721 1
1 903 . 15 1 1 A 79 79 PHE H H 79 8.890 8.106 0.784 1
1 904 . 15 1 1 A 79 79 PHE HA H 79 3.800 4.052 -0.252 1
1 912 . 15 1 1 A 79 79 PHE C C 79 178.354 178.078 0.276 1
1 913 . 15 1 1 A 79 79 PHE CA C 79 60.704 62.402 -1.698 1
1 914 . 15 1 1 A 79 79 PHE CB C 79 37.184 38.379 -1.195 1
1 920 . 15 1 1 A 79 79 PHE N N 79 121.056 117.708 3.348 1
1 921 . 15 1 1 A 80 80 GLU H H 80 7.793 8.060 -0.267 1
1 922 . 15 1 1 A 80 80 GLU HA H 80 4.082 4.024 0.058 1
1 927 . 15 1 1 A 80 80 GLU C C 80 179.068 179.151 -0.083 1
1 928 . 15 1 1 A 80 80 GLU CA C 80 59.735 59.399 0.336 1
1 929 . 15 1 1 A 80 80 GLU CB C 80 28.722 29.311 -0.589 1
1 931 . 15 1 1 A 80 80 GLU N N 80 120.312 119.986 0.326 1
1 932 . 15 1 1 A 81 81 ASN H H 81 8.624 8.885 -0.261 1
1 933 . 15 1 1 A 81 81 ASN HA H 81 4.521 4.416 0.105 1
1 938 . 15 1 1 A 81 81 ASN C C 81 179.262 177.479 1.783 1
1 939 . 15 1 1 A 81 81 ASN CA C 81 55.504 55.803 -0.299 1
1 940 . 15 1 1 A 81 81 ASN CB C 81 37.517 37.333 0.184 1
1 941 . 15 1 1 A 81 81 ASN N N 81 119.338 117.203 2.135 1
1 943 . 15 1 1 A 82 82 CYS H H 82 8.554 8.104 0.450 1
1 944 . 15 1 1 A 82 82 CYS HA H 82 3.792 3.950 -0.158 1
1 947 . 15 1 1 A 82 82 CYS C C 82 176.478 177.016 -0.538 1
1 948 . 15 1 1 A 82 82 CYS CA C 82 65.232 63.609 1.623 1
1 949 . 15 1 1 A 82 82 CYS CB C 82 26.762 26.696 0.066 1
1 950 . 15 1 1 A 82 82 CYS N N 82 120.576 117.623 2.953 1
1 951 . 15 1 1 A 83 83 ARG H H 83 8.522 7.524 0.998 1
1 952 . 15 1 1 A 83 83 ARG HA H 83 3.932 4.253 -0.321 1
1 960 . 15 1 1 A 83 83 ARG C C 83 179.138 178.632 0.506 1
1 961 . 15 1 1 A 83 83 ARG CA C 83 60.443 58.597 1.846 1
1 962 . 15 1 1 A 83 83 ARG CB C 83 29.550 29.853 -0.303 1
1 965 . 15 1 1 A 83 83 ARG N N 83 123.035 119.907 3.128 1
1 967 . 15 1 1 A 84 84 ASP H H 84 7.791 8.394 -0.603 1
1 968 . 15 1 1 A 84 84 ASP HA H 84 4.353 4.401 -0.048 1
1 971 . 15 1 1 A 84 84 ASP C C 84 178.649 178.716 -0.067 1
1 972 . 15 1 1 A 84 84 ASP CA C 84 57.767 57.623 0.144 1
1 973 . 15 1 1 A 84 84 ASP CB C 84 41.305 41.588 -0.283 1
1 974 . 15 1 1 A 84 84 ASP N N 84 120.332 119.649 0.683 1
1 975 . 15 1 1 A 85 85 THR H H 85 8.370 8.186 0.184 1
1 976 . 15 1 1 A 85 85 THR HA H 85 3.730 3.880 -0.150 1
1 981 . 15 1 1 A 85 85 THR C C 85 175.198 176.446 -1.248 1
1 982 . 15 1 1 A 85 85 THR CA C 85 66.830 66.021 0.809 1
1 983 . 15 1 1 A 85 85 THR CB C 85 68.533 68.517 0.016 1
1 985 . 15 1 1 A 85 85 THR N N 85 117.360 115.505 1.855 1
1 986 . 15 1 1 A 86 86 ALA H H 86 8.845 8.193 0.652 1
1 987 . 15 1 1 A 86 86 ALA HA H 86 3.991 4.088 -0.097 1
1 991 . 15 1 1 A 86 86 ALA C C 86 179.980 179.426 0.554 1
1 992 . 15 1 1 A 86 86 ALA CA C 86 55.769 55.778 -0.009 1
1 993 . 15 1 1 A 86 86 ALA CB C 86 17.881 18.548 -0.667 1
1 994 . 15 1 1 A 86 86 ALA N N 86 123.613 123.425 0.188 1
1 995 . 15 1 1 A 87 87 LYS H H 87 7.686 8.384 -0.698 1
1 996 . 15 1 1 A 87 87 LYS HA H 87 4.099 4.040 0.059 1
1 1005 . 15 1 1 A 87 87 LYS C C 87 179.592 178.703 0.889 1
1 1006 . 15 1 1 A 87 87 LYS CA C 87 59.708 59.335 0.373 1
1 1007 . 15 1 1 A 87 87 LYS CB C 87 32.054 32.190 -0.136 1
1 1011 . 15 1 1 A 87 87 LYS N N 87 119.623 116.812 2.811 1
1 1012 . 15 1 1 A 88 88 ARG H H 88 7.683 7.608 0.075 1
1 1013 . 15 1 1 A 88 88 ARG HA H 88 4.051 4.160 -0.109 1
1 1020 . 15 1 1 A 88 88 ARG C C 88 180.053 179.021 1.032 1
1 1021 . 15 1 1 A 88 88 ARG CA C 88 59.558 59.218 0.340 1
1 1022 . 15 1 1 A 88 88 ARG CB C 88 29.684 30.007 -0.323 1
1 1025 . 15 1 1 A 88 88 ARG N N 88 120.788 119.278 1.510 1
1 1026 . 15 1 1 A 89 89 ASN H H 89 8.973 8.045 0.928 1
1 1027 . 15 1 1 A 89 89 ASN HA H 89 4.354 4.620 -0.266 1
1 1032 . 15 1 1 A 89 89 ASN C C 89 178.382 178.595 -0.213 1
1 1033 . 15 1 1 A 89 89 ASN CA C 89 55.334 55.795 -0.461 1
1 1034 . 15 1 1 A 89 89 ASN CB C 89 37.864 38.230 -0.366 1
1 1035 . 15 1 1 A 89 89 ASN N N 89 121.012 117.604 3.408 1
1 1037 . 15 1 1 A 90 90 GLN H H 90 8.152 8.295 -0.143 1
1 1038 . 15 1 1 A 90 90 GLN HA H 90 4.020 4.058 -0.038 1
1 1045 . 15 1 1 A 90 90 GLN C C 90 179.075 178.891 0.184 1
1 1046 . 15 1 1 A 90 90 GLN CA C 90 59.318 59.068 0.250 1
1 1047 . 15 1 1 A 90 90 GLN CB C 90 28.049 28.159 -0.110 1
1 1049 . 15 1 1 A 90 90 GLN N N 90 122.122 120.569 1.553 1
1 1051 . 15 1 1 A 91 91 GLN H H 91 7.514 8.165 -0.651 1
1 1052 . 15 1 1 A 91 91 GLN HA H 91 4.053 4.030 0.023 1
1 1059 . 15 1 1 A 91 91 GLN C C 91 177.081 177.814 -0.733 1
1 1060 . 15 1 1 A 91 91 GLN CA C 91 58.031 58.880 -0.849 1
1 1061 . 15 1 1 A 91 91 GLN CB C 91 28.365 28.314 0.051 1
1 1063 . 15 1 1 A 91 91 GLN N N 91 118.124 119.242 -1.118 1
1 1065 . 15 1 1 A 92 92 ALA H H 92 7.704 7.528 0.176 1
1 1066 . 15 1 1 A 92 92 ALA HA H 92 4.246 4.425 -0.179 1
1 1070 . 15 1 1 A 92 92 ALA C C 92 178.450 177.705 0.745 1
1 1071 . 15 1 1 A 92 92 ALA CA C 92 52.671 51.802 0.869 1
1 1072 . 15 1 1 A 92 92 ALA CB C 92 19.316 19.464 -0.148 1
1 1073 . 15 1 1 A 92 92 ALA N N 92 119.880 118.712 1.168 1
1 1074 . 15 1 1 A 93 93 GLY H H 93 7.693 7.860 -0.167 1
1 1075 . 15 1 1 A 93 93 GLY HA2 H 93 3.941 3.873 0.068 1
1 1076 . 15 1 1 A 93 93 GLY HA3 H 93 3.744 3.877 -0.133 1
1 1077 . 15 1 1 A 93 93 GLY C C 93 174.344 174.947 -0.603 1
1 1078 . 15 1 1 A 93 93 GLY CA C 93 45.949 46.759 -0.810 1
1 1079 . 15 1 1 A 93 93 GLY N N 93 105.347 107.087 -1.740 1
1 1080 . 15 1 1 A 94 94 ASN H H 94 7.076 8.712 -1.636 1
1 1081 . 15 1 1 A 94 94 ASN HA H 94 4.115 4.472 -0.357 1
1 1085 . 15 1 1 A 94 94 ASN C C 94 175.410 175.719 -0.309 1
1 1086 . 15 1 1 A 94 94 ASN CA C 94 52.651 53.454 -0.803 1
1 1087 . 15 1 1 A 94 94 ASN CB C 94 38.330 38.854 -0.524 1
1 1088 . 15 1 1 A 94 94 ASN N N 94 115.747 117.312 -1.565 1
1 1090 . 15 1 1 A 95 95 GLY H H 95 8.236 8.110 0.126 1
1 1091 . 15 1 1 A 95 95 GLY HA2 H 95 3.633 3.658 -0.025 1
1 1092 . 15 1 1 A 95 95 GLY HA3 H 95 3.633 3.815 -0.182 1
1 1093 . 15 1 1 A 95 95 GLY C C 95 174.450 173.506 0.944 1
1 1094 . 15 1 1 A 95 95 GLY CA C 95 45.522 45.787 -0.265 1
1 1095 . 15 1 1 A 95 95 GLY N N 95 109.166 106.590 2.576 1
1 1096 . 15 1 1 A 96 96 TRP H H 96 7.899 7.871 0.028 1
1 1097 . 15 1 1 A 96 96 TRP HA H 96 5.241 4.949 0.292 1
1 1106 . 15 1 1 A 96 96 TRP C C 96 175.661 176.058 -0.397 1
1 1107 . 15 1 1 A 96 96 TRP CA C 96 55.090 56.388 -1.298 1
1 1108 . 15 1 1 A 96 96 TRP CB C 96 27.138 32.509 -5.371 1
1 1114 . 15 1 1 A 96 96 TRP N N 96 122.840 120.186 2.654 1
1 1116 . 15 1 1 A 97 97 ASP H H 97 7.344 8.999 -1.655 1
1 1117 . 15 1 1 A 97 97 ASP HA H 97 4.829 4.319 0.510 1
1 1120 . 15 1 1 A 97 97 ASP C C 97 175.019 176.460 -1.441 1
1 1121 . 15 1 1 A 97 97 ASP CA C 97 52.149 56.797 -4.648 1
1 1122 . 15 1 1 A 97 97 ASP CB C 97 42.697 38.624 4.073 1
1 1123 . 15 1 1 A 97 97 ASP N N 97 126.861 117.445 9.416 1
1 1124 . 15 1 1 A 98 98 PHE H H 98 8.566 8.746 -0.180 1
1 1125 . 15 1 1 A 98 98 PHE HA H 98 3.727 4.154 -0.427 1
1 1133 . 15 1 1 A 98 98 PHE C C 98 177.443 177.049 0.394 1
1 1134 . 15 1 1 A 98 98 PHE CA C 98 62.471 61.315 1.156 1
1 1135 . 15 1 1 A 98 98 PHE CB C 98 39.919 39.394 0.525 1
1 1141 . 15 1 1 A 98 98 PHE N N 98 117.781 121.127 -3.346 1
1 1142 . 15 1 1 A 99 99 ASP H H 99 8.259 8.229 0.030 1
1 1143 . 15 1 1 A 99 99 ASP HA H 99 3.960 4.170 -0.210 1
1 1146 . 15 1 1 A 99 99 ASP C C 99 178.132 178.349 -0.217 1
1 1147 . 15 1 1 A 99 99 ASP CA C 99 57.658 56.473 1.185 1
1 1148 . 15 1 1 A 99 99 ASP CB C 99 38.572 41.104 -2.532 1
1 1149 . 15 1 1 A 99 99 ASP N N 99 121.709 119.248 2.461 1
1 1150 . 15 1 1 A 100 100 MET H H 100 8.008 8.235 -0.227 1
1 1151 . 15 1 1 A 100 100 MET HA H 100 3.644 4.115 -0.471 1
1 1156 . 15 1 1 A 100 100 MET C C 100 180.008 176.746 3.262 1
1 1157 . 15 1 1 A 100 100 MET CA C 100 58.598 58.677 -0.079 1
1 1158 . 15 1 1 A 100 100 MET CB C 100 33.423 32.477 0.946 1
1 1160 . 15 1 1 A 100 100 MET N N 100 119.668 117.630 2.038 1
1 1161 . 15 1 1 A 101 101 LEU H H 101 7.961 7.714 0.247 1
1 1162 . 15 1 1 A 101 101 LEU HA H 101 3.523 4.558 -1.035 1
1 1172 . 15 1 1 A 101 101 LEU C C 101 173.873 175.365 -1.492 1
1 1173 . 15 1 1 A 101 101 LEU CA C 101 58.743 53.786 4.957 1
1 1174 . 15 1 1 A 101 101 LEU CB C 101 42.632 41.849 0.783 1
1 1178 . 15 1 1 A 101 101 LEU N N 101 119.752 120.023 -0.271 1
1 1179 . 15 1 1 A 102 102 THR H H 102 6.955 8.370 -1.415 1
1 1180 . 15 1 1 A 102 102 THR HA H 102 4.134 4.443 -0.309 1
1 1185 . 15 1 1 A 102 102 THR C C 102 176.513 174.217 2.296 1
1 1186 . 15 1 1 A 102 102 THR CA C 102 61.125 60.265 0.860 1
1 1187 . 15 1 1 A 102 102 THR CB C 102 71.415 70.015 1.400 1
1 1189 . 15 1 1 A 102 102 THR N N 102 124.665 118.944 5.721 1
1 1190 . 15 1 1 A 103 103 GLY H H 103 7.816 9.032 -1.216 1
1 1191 . 15 1 1 A 103 103 GLY HA2 H 103 3.824 4.078 -0.254 1
1 1192 . 15 1 1 A 103 103 GLY HA3 H 103 3.824 4.087 -0.263 1
1 1193 . 15 1 1 A 103 103 GLY C C 103 174.126 174.499 -0.373 1
1 1194 . 15 1 1 A 103 103 GLY CA C 103 47.805 47.877 -0.072 1
1 1195 . 15 1 1 A 103 103 GLY N N 103 114.191 112.621 1.570 1
1 1196 . 15 1 1 A 104 104 SER H H 104 8.860 7.760 1.100 1
1 1197 . 15 1 1 A 104 104 SER HA H 104 4.758 5.374 -0.616 1
1 1200 . 15 1 1 A 104 104 SER C C 104 174.591 174.123 0.468 1
1 1201 . 15 1 1 A 104 104 SER CA C 104 56.755 57.969 -1.214 1
1 1202 . 15 1 1 A 104 104 SER CB C 104 65.050 65.360 -0.310 1
1 1203 . 15 1 1 A 104 104 SER N N 104 114.771 111.372 3.399 1
1 1204 . 15 1 1 A 105 105 GLY H H 105 8.788 8.470 0.318 1
1 1205 . 15 1 1 A 105 105 GLY HA2 H 105 3.733 3.474 0.259 1
1 1206 . 15 1 1 A 105 105 GLY HA3 H 105 3.733 3.653 0.080 1
1 1207 . 15 1 1 A 105 105 GLY CA C 105 47.247 46.638 0.609 1
1 1208 . 15 1 1 A 105 105 GLY N N 105 110.394 113.477 -3.083 1
1 1209 . 15 1 1 A 106 106 ASN HA H 106 4.454 4.950 -0.496 1
1 1212 . 15 1 1 A 106 106 ASN C C 106 175.180 176.404 -1.224 1
1 1213 . 15 1 1 A 106 106 ASN CA C 106 54.492 54.185 0.307 1
1 1214 . 15 1 1 A 106 106 ASN CB C 106 37.282 41.220 -3.938 1
1 1215 . 15 1 1 A 107 107 TYR H H 107 8.241 8.194 0.047 1
1 1216 . 15 1 1 A 107 107 TYR HA H 107 4.335 4.748 -0.413 1
1 1223 . 15 1 1 A 107 107 TYR C C 107 173.954 176.432 -2.478 1
1 1224 . 15 1 1 A 107 107 TYR CA C 107 57.727 58.119 -0.392 1
1 1225 . 15 1 1 A 107 107 TYR CB C 107 37.063 39.724 -2.661 1
1 1230 . 15 1 1 A 107 107 TYR N N 107 120.708 115.143 5.565 1
1 1231 . 15 1 1 A 108 108 SER H H 108 7.117 7.698 -0.581 1
1 1232 . 15 1 1 A 108 108 SER HA H 108 4.221 4.159 0.062 1
1 1235 . 15 1 1 A 108 108 SER C C 108 174.834 173.830 1.004 1
1 1236 . 15 1 1 A 108 108 SER CA C 108 59.859 60.108 -0.249 1
1 1237 . 15 1 1 A 108 108 SER CB C 108 63.846 62.484 1.362 1
1 1238 . 15 1 1 A 108 108 SER N N 108 113.362 115.522 -2.160 1
1 1239 . 15 1 1 A 109 109 SER H H 109 8.053 8.277 -0.224 1
1 1240 . 15 1 1 A 109 109 SER HA H 109 4.560 4.250 0.310 1
1 1243 . 15 1 1 A 109 109 SER CA C 109 57.141 60.772 -3.631 1
1 1244 . 15 1 1 A 109 109 SER CB C 109 64.874 61.905 2.969 1
1 1245 . 15 1 1 A 109 109 SER N N 109 116.657 117.449 -0.792 1
1 1246 . 15 1 1 A 110 110 THR HA H 110 3.541 3.822 -0.281 1
1 1251 . 15 1 1 A 110 110 THR C C 110 175.477 176.041 -0.564 1
1 1252 . 15 1 1 A 110 110 THR CA C 110 66.443 66.987 -0.544 1
1 1253 . 15 1 1 A 110 110 THR CB C 110 68.091 68.719 -0.628 1
1 1255 . 15 1 1 A 111 111 ASP H H 111 8.224 8.403 -0.179 1
1 1256 . 15 1 1 A 111 111 ASP HA H 111 4.237 4.265 -0.028 1
1 1259 . 15 1 1 A 111 111 ASP C C 111 177.520 178.278 -0.758 1
1 1260 . 15 1 1 A 111 111 ASP CA C 111 57.559 57.103 0.456 1
1 1261 . 15 1 1 A 111 111 ASP CB C 111 40.292 41.163 -0.871 1
1 1262 . 15 1 1 A 111 111 ASP N N 111 119.490 121.228 -1.738 1
1 1263 . 15 1 1 A 112 112 ALA H H 112 7.431 7.985 -0.554 1
1 1264 . 15 1 1 A 112 112 ALA HA H 112 4.191 4.112 0.079 1
1 1268 . 15 1 1 A 112 112 ALA C C 112 180.646 179.835 0.811 1
1 1269 . 15 1 1 A 112 112 ALA CA C 112 54.534 55.136 -0.602 1
1 1270 . 15 1 1 A 112 112 ALA CB C 112 18.992 18.244 0.748 1
1 1271 . 15 1 1 A 112 112 ALA N N 112 119.710 121.117 -1.407 1
1 1272 . 15 1 1 A 113 113 GLN H H 113 7.576 7.009 0.567 1
1 1273 . 15 1 1 A 113 113 GLN HA H 113 3.562 4.147 -0.585 1
1 1278 . 15 1 1 A 113 113 GLN C C 113 176.756 178.033 -1.277 1
1 1279 . 15 1 1 A 113 113 GLN CA C 113 57.736 58.553 -0.817 1
1 1280 . 15 1 1 A 113 113 GLN CB C 113 29.110 27.762 1.348 1
1 1281 . 15 1 1 A 113 113 GLN N N 113 117.518 117.693 -0.175 1
1 1283 . 15 1 1 A 114 114 MET H H 114 8.192 8.086 0.106 1
1 1284 . 15 1 1 A 114 114 MET HA H 114 4.231 4.053 0.178 1
1 1289 . 15 1 1 A 114 114 MET C C 114 175.648 178.110 -2.462 1
1 1290 . 15 1 1 A 114 114 MET CA C 114 57.446 58.280 -0.834 1
1 1291 . 15 1 1 A 114 114 MET CB C 114 33.570 31.951 1.619 1
1 1293 . 15 1 1 A 114 114 MET N N 114 111.509 119.685 -8.176 1
1 1294 . 15 1 1 A 115 115 GLN H H 115 6.940 7.418 -0.478 1
1 1295 . 15 1 1 A 115 115 GLN HA H 115 4.307 4.163 0.144 1
1 1302 . 15 1 1 A 115 115 GLN C C 115 176.270 175.720 0.550 1
1 1303 . 15 1 1 A 115 115 GLN CA C 115 54.680 58.902 -4.222 1
1 1304 . 15 1 1 A 115 115 GLN CB C 115 28.233 28.635 -0.402 1
1 1306 . 15 1 1 A 115 115 GLN N N 115 114.300 116.622 -2.322 1
1 1308 . 15 1 1 A 116 116 TYR H H 116 6.677 7.952 -1.275 1
1 1309 . 15 1 1 A 116 116 TYR HA H 116 4.193 4.130 0.063 1
1 1312 . 15 1 1 A 116 116 TYR C C 116 175.268 175.131 0.137 1
1 1313 . 15 1 1 A 116 116 TYR CA C 116 54.357 58.735 -4.378 1
1 1314 . 15 1 1 A 116 116 TYR CB C 116 35.498 36.464 -0.966 1
1 1315 . 15 1 1 A 116 116 TYR N N 116 117.919 119.057 -1.138 1
1 1316 . 15 1 1 A 117 117 ASP H H 117 8.081 8.009 0.072 1
1 1317 . 15 1 1 A 117 117 ASP HA H 117 4.665 4.773 -0.108 1
1 1320 . 15 1 1 A 117 117 ASP CA C 117 52.422 50.736 1.686 1
1 1321 . 15 1 1 A 117 117 ASP CB C 117 42.416 42.418 -0.002 1
1 1322 . 15 1 1 A 117 117 ASP N N 117 120.887 127.619 -6.732 1
1 1323 . 15 1 1 A 118 118 PRO C C 118 179.180 178.331 0.849 1
1 1324 . 15 1 1 A 118 118 PRO CA C 118 65.942 64.278 1.664 1
1 1325 . 15 1 1 A 118 118 PRO CB C 118 32.197 31.788 0.409 1
1 1326 . 15 1 1 A 119 119 GLY H H 119 9.742 8.420 1.322 1
1 1327 . 15 1 1 A 119 119 GLY C C 119 175.622 175.480 0.142 1
1 1328 . 15 1 1 A 119 119 GLY CA C 119 46.785 46.634 0.151 1
1 1329 . 15 1 1 A 119 119 GLY N N 119 106.412 106.330 0.082 1
1 1330 . 15 1 1 A 120 120 LEU H H 120 6.666 8.282 -1.616 1
1 1331 . 15 1 1 A 120 120 LEU HA H 120 3.365 3.540 -0.175 1
1 1341 . 15 1 1 A 120 120 LEU C C 120 179.262 178.608 0.654 1
1 1342 . 15 1 1 A 120 120 LEU CA C 120 56.605 57.838 -1.233 1
1 1343 . 15 1 1 A 120 120 LEU CB C 120 39.262 41.337 -2.075 1
1 1347 . 15 1 1 A 120 120 LEU N N 120 126.226 122.257 3.969 1
1 1348 . 15 1 1 A 121 121 PHE H H 121 7.356 8.707 -1.351 1
1 1349 . 15 1 1 A 121 121 PHE HA H 121 4.459 4.000 0.459 1
1 1352 . 15 1 1 A 121 121 PHE C C 121 179.716 177.609 2.107 1
1 1353 . 15 1 1 A 121 121 PHE CA C 121 62.838 62.163 0.675 1
1 1354 . 15 1 1 A 121 121 PHE CB C 121 37.603 39.575 -1.972 1
1 1355 . 15 1 1 A 121 121 PHE N N 121 117.437 119.652 -2.215 1
1 1356 . 15 1 1 A 122 122 ALA H H 122 7.926 7.963 -0.037 1
1 1357 . 15 1 1 A 122 122 ALA HA H 122 4.523 3.776 0.747 1
1 1361 . 15 1 1 A 122 122 ALA C C 122 180.435 179.621 0.814 1
1 1362 . 15 1 1 A 122 122 ALA CA C 122 55.527 55.423 0.104 1
1 1363 . 15 1 1 A 122 122 ALA CB C 122 17.814 18.030 -0.216 1
1 1364 . 15 1 1 A 122 122 ALA N N 122 121.068 120.991 0.077 1
1 1365 . 15 1 1 A 123 123 GLN H H 123 7.507 7.757 -0.250 1
1 1366 . 15 1 1 A 123 123 GLN HA H 123 4.153 4.012 0.141 1
1 1371 . 15 1 1 A 123 123 GLN C C 123 180.561 178.267 2.294 1
1 1372 . 15 1 1 A 123 123 GLN CA C 123 59.948 58.739 1.209 1
1 1373 . 15 1 1 A 123 123 GLN CB C 123 29.135 28.597 0.538 1
1 1375 . 15 1 1 A 123 123 GLN N N 123 120.324 117.306 3.018 1
1 1376 . 15 1 1 A 124 124 ILE H H 124 8.318 8.416 -0.098 1
1 1377 . 15 1 1 A 124 124 ILE HA H 124 3.635 3.773 -0.138 1
1 1387 . 15 1 1 A 124 124 ILE C C 124 176.481 178.234 -1.753 1
1 1388 . 15 1 1 A 124 124 ILE CA C 124 66.432 64.969 1.463 1
1 1389 . 15 1 1 A 124 124 ILE CB C 124 39.168 38.102 1.066 1
1 1393 . 15 1 1 A 124 124 ILE N N 124 123.747 120.868 2.879 1
1 1394 . 15 1 1 A 125 125 GLN H H 125 8.474 7.684 0.790 1
1 1395 . 15 1 1 A 125 125 GLN HA H 125 4.264 3.929 0.335 1
1 1402 . 15 1 1 A 125 125 GLN C C 125 178.947 178.469 0.478 1
1 1403 . 15 1 1 A 125 125 GLN CA C 125 59.651 58.574 1.077 1
1 1404 . 15 1 1 A 125 125 GLN CB C 125 28.880 28.119 0.761 1
1 1406 . 15 1 1 A 125 125 GLN N N 125 120.368 118.742 1.626 1
1 1408 . 15 1 1 A 126 126 ALA H H 126 8.002 7.771 0.231 1
1 1409 . 15 1 1 A 126 126 ALA HA H 126 4.144 3.968 0.176 1
1 1413 . 15 1 1 A 126 126 ALA C C 126 179.316 179.806 -0.490 1
1 1414 . 15 1 1 A 126 126 ALA CA C 126 55.036 54.969 0.067 1
1 1415 . 15 1 1 A 126 126 ALA CB C 126 18.087 18.035 0.052 1
1 1416 . 15 1 1 A 126 126 ALA N N 126 121.661 122.380 -0.719 1
1 1417 . 15 1 1 A 127 127 ALA H H 127 7.823 8.082 -0.259 1
1 1418 . 15 1 1 A 127 127 ALA HA H 127 4.162 4.082 0.080 1
1 1422 . 15 1 1 A 127 127 ALA C C 127 180.707 179.554 1.153 1
1 1423 . 15 1 1 A 127 127 ALA CA C 127 55.080 54.911 0.169 1
1 1424 . 15 1 1 A 127 127 ALA CB C 127 19.354 18.300 1.054 1
1 1425 . 15 1 1 A 127 127 ALA N N 127 119.853 119.843 0.010 1
1 1426 . 15 1 1 A 128 128 ALA H H 128 8.936 7.629 1.307 1
1 1427 . 15 1 1 A 128 128 ALA HA H 128 3.928 3.779 0.149 1
1 1431 . 15 1 1 A 128 128 ALA C C 128 181.031 179.344 1.687 1
1 1432 . 15 1 1 A 128 128 ALA CA C 128 55.502 54.696 0.806 1
1 1433 . 15 1 1 A 128 128 ALA CB C 128 16.609 17.847 -1.238 1
1 1434 . 15 1 1 A 128 128 ALA N N 128 121.355 120.261 1.094 1
1 1435 . 15 1 1 A 129 129 THR H H 129 8.543 8.020 0.523 1
1 1436 . 15 1 1 A 129 129 THR HA H 129 4.015 3.691 0.324 1
1 1441 . 15 1 1 A 129 129 THR C C 129 177.332 176.422 0.910 1
1 1442 . 15 1 1 A 129 129 THR CA C 129 65.893 65.474 0.419 1
1 1443 . 15 1 1 A 129 129 THR CB C 129 68.566 68.119 0.447 1
1 1445 . 15 1 1 A 129 129 THR N N 129 112.709 111.206 1.503 1
1 1446 . 15 1 1 A 130 130 LYS H H 130 8.126 7.333 0.793 1
1 1447 . 15 1 1 A 130 130 LYS HA H 130 4.000 4.023 -0.023 1
1 1456 . 15 1 1 A 130 130 LYS C C 130 179.082 178.449 0.633 1
1 1457 . 15 1 1 A 130 130 LYS CA C 130 60.299 58.468 1.831 1
1 1458 . 15 1 1 A 130 130 LYS CB C 130 32.767 31.961 0.806 1
1 1462 . 15 1 1 A 130 130 LYS N N 130 123.879 122.005 1.874 1
1 1463 . 15 1 1 A 131 131 ALA H H 131 7.184 7.779 -0.595 1
1 1464 . 15 1 1 A 131 131 ALA HA H 131 4.005 4.249 -0.244 1
1 1468 . 15 1 1 A 131 131 ALA C C 131 178.482 179.525 -1.043 1
1 1469 . 15 1 1 A 131 131 ALA CA C 131 55.027 55.204 -0.177 1
1 1470 . 15 1 1 A 131 131 ALA CB C 131 18.669 19.514 -0.845 1
1 1471 . 15 1 1 A 131 131 ALA N N 131 118.590 121.247 -2.657 1
1 1472 . 15 1 1 A 132 132 TRP H H 132 7.977 8.584 -0.607 1
1 1473 . 15 1 1 A 132 132 TRP HA H 132 4.001 4.089 -0.088 1
1 1480 . 15 1 1 A 132 132 TRP C C 132 177.332 175.773 1.559 1
1 1481 . 15 1 1 A 132 132 TRP CA C 132 60.431 57.304 3.127 1
1 1482 . 15 1 1 A 132 132 TRP CB C 132 27.786 27.524 0.262 1
1 1486 . 15 1 1 A 132 132 TRP N N 132 119.168 117.097 2.071 1
1 1488 . 15 1 1 A 133 133 ARG H H 133 8.006 8.162 -0.156 1
1 1489 . 15 1 1 A 133 133 ARG HA H 133 4.027 4.475 -0.448 1
1 1497 . 15 1 1 A 133 133 ARG C C 133 176.664 177.837 -1.173 1
1 1498 . 15 1 1 A 133 133 ARG CA C 133 59.355 57.318 2.037 1
1 1499 . 15 1 1 A 133 133 ARG CB C 133 30.451 32.372 -1.921 1
1 1502 . 15 1 1 A 133 133 ARG N N 133 113.062 120.666 -7.604 1
1 1504 . 15 1 1 A 134 134 LYS H H 134 7.322 7.695 -0.373 1
1 1505 . 15 1 1 A 134 134 LYS HA H 134 4.313 4.406 -0.093 1
1 1514 . 15 1 1 A 134 134 LYS C C 134 176.282 175.916 0.366 1
1 1515 . 15 1 1 A 134 134 LYS CA C 134 54.922 56.672 -1.750 1
1 1516 . 15 1 1 A 134 134 LYS CB C 134 32.633 31.415 1.218 1
1 1520 . 15 1 1 A 134 134 LYS N N 134 118.170 119.110 -0.940 1
1 1521 . 15 1 1 A 135 135 LEU H H 135 7.440 8.001 -0.561 1
1 1522 . 15 1 1 A 135 135 LEU HA H 135 4.174 4.550 -0.376 1
1 1532 . 15 1 1 A 135 135 LEU CA C 135 54.408 52.696 1.712 1
1 1533 . 15 1 1 A 135 135 LEU CB C 135 40.407 41.394 -0.987 1
1 1537 . 15 1 1 A 135 135 LEU N N 135 123.358 121.385 1.973 1
1 1538 . 15 1 1 A 136 136 PRO HA H 136 4.437 4.458 -0.021 1
1 1545 . 15 1 1 A 136 136 PRO C C 136 177.106 176.525 0.581 1
1 1546 . 15 1 1 A 136 136 PRO CA C 136 62.889 65.817 -2.928 1
1 1547 . 15 1 1 A 136 136 PRO CB C 136 32.192 31.530 0.662 1
1 1550 . 15 1 1 A 137 137 VAL H H 137 8.219 7.836 0.383 1
1 1551 . 15 1 1 A 137 137 VAL HA H 137 4.077 4.442 -0.365 1
1 1559 . 15 1 1 A 137 137 VAL C C 137 176.305 175.194 1.111 1
1 1560 . 15 1 1 A 137 137 VAL CA C 137 61.958 60.978 0.980 1
1 1561 . 15 1 1 A 137 137 VAL CB C 137 32.755 34.591 -1.836 1
1 1564 . 15 1 1 A 137 137 VAL N N 137 120.079 116.150 3.929 1
1 1565 . 15 1 1 A 138 138 LYS H H 138 8.444 9.070 -0.626 1
1 1566 . 15 1 1 A 138 138 LYS HA H 138 4.316 4.315 0.001 1
1 1575 . 15 1 1 A 138 138 LYS C C 138 176.790 177.505 -0.715 1
1 1576 . 15 1 1 A 138 138 LYS CA C 138 56.792 56.960 -0.168 1
1 1577 . 15 1 1 A 138 138 LYS CB C 138 33.205 34.050 -0.845 1
1 1581 . 15 1 1 A 138 138 LYS N N 138 126.449 129.349 -2.900 1
1 1582 . 15 1 1 A 139 139 GLY H H 139 8.518 7.636 0.882 1
1 1583 . 15 1 1 A 139 139 GLY HA2 H 139 4.070 3.971 0.099 1
1 1584 . 15 1 1 A 139 139 GLY HA3 H 139 3.897 3.987 -0.090 1
1 1585 . 15 1 1 A 139 139 GLY C C 139 172.874 174.418 -1.544 1
1 1586 . 15 1 1 A 139 139 GLY CA C 139 45.157 46.125 -0.968 1
1 1587 . 15 1 1 A 139 139 GLY N N 139 112.617 106.994 5.623 1
1 6 . 16 1 1 A 2 2 VAL H H 2 8.992 8.935 0.057 1
1 7 . 16 1 1 A 2 2 VAL HA H 2 5.370 4.817 0.553 1
1 15 . 16 1 1 A 2 2 VAL C C 2 174.325 174.555 -0.230 1
1 16 . 16 1 1 A 2 2 VAL CA C 2 61.267 60.511 0.756 1
1 17 . 16 1 1 A 2 2 VAL CB C 2 33.890 35.343 -1.453 1
1 20 . 16 1 1 A 2 2 VAL N N 2 126.939 119.416 7.523 1
1 21 . 16 1 1 A 3 3 THR H H 3 8.912 8.965 -0.053 1
1 22 . 16 1 1 A 3 3 THR HA H 3 4.505 5.430 -0.925 1
1 27 . 16 1 1 A 3 3 THR C C 3 172.710 172.841 -0.131 1
1 28 . 16 1 1 A 3 3 THR CA C 3 59.689 59.663 0.026 1
1 29 . 16 1 1 A 3 3 THR CB C 3 72.398 72.165 0.233 1
1 31 . 16 1 1 A 3 3 THR N N 3 118.091 122.279 -4.188 1
1 32 . 16 1 1 A 4 4 GLU H H 4 8.631 8.960 -0.329 1
1 33 . 16 1 1 A 4 4 GLU HA H 4 5.788 4.940 0.848 1
1 38 . 16 1 1 A 4 4 GLU C C 4 175.758 174.040 1.718 1
1 39 . 16 1 1 A 4 4 GLU CA C 4 54.902 54.062 0.840 1
1 40 . 16 1 1 A 4 4 GLU CB C 4 35.097 32.884 2.213 1
1 42 . 16 1 1 A 4 4 GLU N N 4 120.966 125.073 -4.107 1
1 43 . 16 1 1 A 5 5 THR H H 5 9.188 8.437 0.751 1
1 44 . 16 1 1 A 5 5 THR HA H 5 4.739 4.768 -0.029 1
1 49 . 16 1 1 A 5 5 THR C C 5 172.757 172.555 0.202 1
1 50 . 16 1 1 A 5 5 THR CA C 5 60.382 60.351 0.031 1
1 51 . 16 1 1 A 5 5 THR CB C 5 71.558 70.436 1.122 1
1 53 . 16 1 1 A 5 5 THR N N 5 119.366 114.824 4.542 1
1 54 . 16 1 1 A 6 6 VAL H H 6 8.476 8.705 -0.229 1
1 55 . 16 1 1 A 6 6 VAL HA H 6 5.026 5.328 -0.302 1
1 63 . 16 1 1 A 6 6 VAL C C 6 176.674 174.132 2.542 1
1 64 . 16 1 1 A 6 6 VAL CA C 6 61.008 59.271 1.737 1
1 65 . 16 1 1 A 6 6 VAL CB C 6 33.861 35.845 -1.984 1
1 68 . 16 1 1 A 6 6 VAL N N 6 121.384 118.804 2.580 1
1 69 . 16 1 1 A 7 7 ASP H H 7 8.848 8.683 0.165 1
1 70 . 16 1 1 A 7 7 ASP HA H 7 4.797 5.072 -0.275 1
1 73 . 16 1 1 A 7 7 ASP CA C 7 52.834 52.352 0.482 1
1 74 . 16 1 1 A 7 7 ASP CB C 7 42.219 43.291 -1.072 1
1 75 . 16 1 1 A 7 7 ASP N N 7 127.061 122.836 4.225 1
1 76 . 16 1 1 A 8 8 GLY C C 8 175.143 175.361 -0.218 1
1 77 . 16 1 1 A 8 8 GLY CA C 8 46.553 46.613 -0.060 1
1 78 . 16 1 1 A 9 9 GLN H H 9 8.408 7.596 0.812 1
1 79 . 16 1 1 A 9 9 GLN HA H 9 4.541 4.286 0.255 1
1 86 . 16 1 1 A 9 9 GLN C C 9 176.463 176.476 -0.013 1
1 87 . 16 1 1 A 9 9 GLN CA C 9 55.167 55.824 -0.657 1
1 88 . 16 1 1 A 9 9 GLN CB C 9 29.376 28.912 0.464 1
1 90 . 16 1 1 A 9 9 GLN N N 9 118.300 118.002 0.298 1
1 92 . 16 1 1 A 10 10 GLY H H 10 8.162 8.994 -0.832 1
1 93 . 16 1 1 A 10 10 GLY HA2 H 10 4.174 3.862 0.312 1
1 94 . 16 1 1 A 10 10 GLY HA3 H 10 3.521 3.872 -0.351 1
1 95 . 16 1 1 A 10 10 GLY C C 10 174.092 173.672 0.420 1
1 96 . 16 1 1 A 10 10 GLY CA C 10 45.558 45.956 -0.398 1
1 97 . 16 1 1 A 10 10 GLY N N 10 108.747 109.382 -0.635 1
1 98 . 16 1 1 A 11 11 GLN H H 11 8.507 7.465 1.042 1
1 99 . 16 1 1 A 11 11 GLN HA H 11 4.202 4.950 -0.748 1
1 106 . 16 1 1 A 11 11 GLN C C 11 173.992 173.772 0.220 1
1 107 . 16 1 1 A 11 11 GLN CA C 11 55.098 53.712 1.386 1
1 108 . 16 1 1 A 11 11 GLN CB C 11 29.097 32.089 -2.992 1
1 110 . 16 1 1 A 11 11 GLN N N 11 122.979 115.248 7.731 1
1 112 . 16 1 1 A 12 12 ALA H H 12 8.259 8.372 -0.113 1
1 113 . 16 1 1 A 12 12 ALA HA H 12 5.156 5.988 -0.832 1
1 117 . 16 1 1 A 12 12 ALA C C 12 177.284 175.881 1.403 1
1 118 . 16 1 1 A 12 12 ALA CA C 12 51.087 50.093 0.994 1
1 119 . 16 1 1 A 12 12 ALA CB C 12 20.500 22.391 -1.891 1
1 120 . 16 1 1 A 12 12 ALA N N 12 127.100 121.958 5.142 1
1 121 . 16 1 1 A 13 13 TRP H H 13 9.245 9.004 0.241 1
1 122 . 16 1 1 A 13 13 TRP HA H 13 4.717 5.371 -0.654 1
1 131 . 16 1 1 A 13 13 TRP C C 13 175.108 174.288 0.820 1
1 132 . 16 1 1 A 13 13 TRP CA C 13 55.966 55.473 0.493 1
1 133 . 16 1 1 A 13 13 TRP CB C 13 31.912 32.265 -0.353 1
1 139 . 16 1 1 A 13 13 TRP N N 13 123.088 118.553 4.535 1
1 141 . 16 1 1 A 14 14 ARG H H 14 8.575 8.749 -0.174 1
1 142 . 16 1 1 A 14 14 ARG HA H 14 5.335 4.603 0.732 1
1 150 . 16 1 1 A 14 14 ARG C C 14 175.191 174.203 0.988 1
1 151 . 16 1 1 A 14 14 ARG CA C 14 53.106 55.245 -2.139 1
1 152 . 16 1 1 A 14 14 ARG CB C 14 32.749 31.615 1.134 1
1 154 . 16 1 1 A 14 14 ARG N N 14 121.163 120.104 1.059 1
1 156 . 16 1 1 A 15 15 HIS H H 15 8.595 8.091 0.504 1
1 157 . 16 1 1 A 15 15 HIS HA H 15 4.790 5.128 -0.338 1
1 161 . 16 1 1 A 15 15 HIS C C 15 173.770 174.554 -0.784 1
1 162 . 16 1 1 A 15 15 HIS CA C 15 55.289 54.615 0.674 1
1 163 . 16 1 1 A 15 15 HIS CB C 15 33.208 33.220 -0.012 1
1 165 . 16 1 1 A 15 15 HIS N N 15 117.643 119.396 -1.753 1
1 166 . 16 1 1 A 16 16 HIS H H 16 8.993 9.239 -0.246 1
1 167 . 16 1 1 A 16 16 HIS HA H 16 5.158 4.722 0.436 1
1 171 . 16 1 1 A 16 16 HIS C C 16 173.608 175.614 -2.006 1
1 172 . 16 1 1 A 16 16 HIS CA C 16 56.450 56.514 -0.064 1
1 173 . 16 1 1 A 16 16 HIS CB C 16 34.171 30.689 3.482 1
1 175 . 16 1 1 A 16 16 HIS N N 16 123.520 120.639 2.881 1
1 176 . 16 1 1 A 17 17 ASN H H 17 7.829 9.223 -1.394 1
1 177 . 16 1 1 A 17 17 ASN HA H 17 4.713 5.355 -0.642 1
1 182 . 16 1 1 A 17 17 ASN C C 17 173.682 175.625 -1.943 1
1 183 . 16 1 1 A 17 17 ASN CA C 17 51.822 51.827 -0.005 1
1 184 . 16 1 1 A 17 17 ASN CB C 17 43.176 41.785 1.391 1
1 185 . 16 1 1 A 17 17 ASN N N 17 122.213 120.709 1.504 1
1 187 . 16 1 1 A 18 18 GLY H H 18 8.423 8.408 0.015 1
1 188 . 16 1 1 A 18 18 GLY HA2 H 18 3.931 3.671 0.260 1
1 189 . 16 1 1 A 18 18 GLY HA3 H 18 3.707 3.936 -0.229 1
1 190 . 16 1 1 A 18 18 GLY C C 18 173.985 172.780 1.205 1
1 191 . 16 1 1 A 18 18 GLY CA C 18 43.949 44.342 -0.393 1
1 192 . 16 1 1 A 18 18 GLY N N 18 106.991 107.808 -0.817 1
1 193 . 16 1 1 A 19 19 PHE H H 19 8.338 8.228 0.110 1
1 194 . 16 1 1 A 19 19 PHE HA H 19 4.068 4.872 -0.804 1
1 197 . 16 1 1 A 19 19 PHE C C 19 176.568 175.172 1.396 1
1 198 . 16 1 1 A 19 19 PHE CA C 19 59.338 58.153 1.185 1
1 199 . 16 1 1 A 19 19 PHE CB C 19 40.201 39.647 0.554 1
1 200 . 16 1 1 A 19 19 PHE N N 19 116.857 118.502 -1.645 1
1 201 . 16 1 1 A 20 20 ASP H H 20 8.794 8.605 0.189 1
1 202 . 16 1 1 A 20 20 ASP HA H 20 4.485 4.822 -0.337 1
1 205 . 16 1 1 A 20 20 ASP C C 20 177.379 177.276 0.103 1
1 206 . 16 1 1 A 20 20 ASP CA C 20 54.140 54.385 -0.245 1
1 207 . 16 1 1 A 20 20 ASP CB C 20 41.915 42.157 -0.242 1
1 208 . 16 1 1 A 20 20 ASP N N 20 123.025 124.651 -1.626 1
1 209 . 16 1 1 A 21 21 PHE H H 21 8.862 9.185 -0.323 1
1 210 . 16 1 1 A 21 21 PHE HA H 21 4.087 4.128 -0.041 1
1 218 . 16 1 1 A 21 21 PHE C C 21 176.952 177.152 -0.200 1
1 219 . 16 1 1 A 21 21 PHE CA C 21 61.095 62.277 -1.182 1
1 220 . 16 1 1 A 21 21 PHE CB C 21 38.678 39.190 -0.512 1
1 226 . 16 1 1 A 21 21 PHE N N 21 127.163 127.472 -0.309 1
1 227 . 16 1 1 A 22 22 ALA H H 22 8.561 8.040 0.521 1
1 228 . 16 1 1 A 22 22 ALA HA H 22 3.878 3.912 -0.034 1
1 232 . 16 1 1 A 22 22 ALA C C 22 180.710 180.293 0.417 1
1 233 . 16 1 1 A 22 22 ALA CA C 22 55.211 55.101 0.110 1
1 234 . 16 1 1 A 22 22 ALA CB C 22 18.321 18.158 0.163 1
1 235 . 16 1 1 A 22 22 ALA N N 22 120.293 121.294 -1.001 1
1 236 . 16 1 1 A 23 23 VAL H H 23 7.241 7.679 -0.438 1
1 237 . 16 1 1 A 23 23 VAL HA H 23 3.684 3.493 0.191 1
1 245 . 16 1 1 A 23 23 VAL C C 23 177.101 178.085 -0.984 1
1 246 . 16 1 1 A 23 23 VAL CA C 23 65.237 66.966 -1.729 1
1 247 . 16 1 1 A 23 23 VAL CB C 23 31.780 31.554 0.226 1
1 250 . 16 1 1 A 23 23 VAL N N 23 118.775 118.078 0.697 1
1 251 . 16 1 1 A 24 24 ILE H H 24 6.761 7.990 -1.229 1
1 252 . 16 1 1 A 24 24 ILE HA H 24 3.196 3.574 -0.378 1
1 262 . 16 1 1 A 24 24 ILE C C 24 177.287 178.502 -1.215 1
1 263 . 16 1 1 A 24 24 ILE CA C 24 63.404 65.585 -2.181 1
1 264 . 16 1 1 A 24 24 ILE CB C 24 36.294 37.596 -1.302 1
1 268 . 16 1 1 A 24 24 ILE N N 24 119.036 119.453 -0.417 1
1 269 . 16 1 1 A 25 25 LYS H H 25 8.032 8.030 0.002 1
1 270 . 16 1 1 A 25 25 LYS HA H 25 3.809 3.623 0.186 1
1 279 . 16 1 1 A 25 25 LYS C C 25 179.450 178.015 1.435 1
1 280 . 16 1 1 A 25 25 LYS CA C 25 59.621 59.023 0.598 1
1 281 . 16 1 1 A 25 25 LYS CB C 25 32.259 31.721 0.538 1
1 285 . 16 1 1 A 25 25 LYS N N 25 118.368 120.486 -2.118 1
1 286 . 16 1 1 A 26 26 GLU H H 26 7.845 7.991 -0.146 1
1 287 . 16 1 1 A 26 26 GLU HA H 26 4.021 4.105 -0.084 1
1 292 . 16 1 1 A 26 26 GLU C C 26 179.191 178.860 0.331 1
1 293 . 16 1 1 A 26 26 GLU CA C 26 59.530 59.021 0.509 1
1 294 . 16 1 1 A 26 26 GLU CB C 26 29.449 29.487 -0.038 1
1 296 . 16 1 1 A 26 26 GLU N N 26 120.522 119.318 1.204 1
1 297 . 16 1 1 A 27 27 LEU H H 27 8.165 8.114 0.051 1
1 298 . 16 1 1 A 27 27 LEU HA H 27 4.163 4.115 0.048 1
1 308 . 16 1 1 A 27 27 LEU C C 27 177.256 178.351 -1.095 1
1 309 . 16 1 1 A 27 27 LEU CA C 27 58.049 57.664 0.385 1
1 310 . 16 1 1 A 27 27 LEU CB C 27 41.365 41.593 -0.228 1
1 314 . 16 1 1 A 27 27 LEU N N 27 120.879 121.162 -0.283 1
1 315 . 16 1 1 A 28 28 LYS H H 28 8.902 8.086 0.816 1
1 316 . 16 1 1 A 28 28 LYS HA H 28 4.199 4.669 -0.470 1
1 317 . 16 1 1 A 28 28 LYS C C 28 179.707 179.354 0.353 1
1 318 . 16 1 1 A 28 28 LYS CA C 28 60.097 59.027 1.070 1
1 319 . 16 1 1 A 28 28 LYS CB C 28 33.420 31.749 1.671 1
1 320 . 16 1 1 A 28 28 LYS N N 28 120.050 119.640 0.410 1
1 321 . 16 1 1 A 29 29 THR H H 29 8.294 8.275 0.019 1
1 322 . 16 1 1 A 29 29 THR HA H 29 3.892 3.997 -0.105 1
1 327 . 16 1 1 A 29 29 THR C C 29 175.711 176.600 -0.889 1
1 328 . 16 1 1 A 29 29 THR CA C 29 66.846 66.453 0.393 1
1 329 . 16 1 1 A 29 29 THR CB C 29 68.794 68.966 -0.172 1
1 331 . 16 1 1 A 29 29 THR N N 29 115.933 116.783 -0.850 1
1 332 . 16 1 1 A 30 30 ALA H H 30 8.244 8.595 -0.351 1
1 333 . 16 1 1 A 30 30 ALA HA H 30 4.241 4.277 -0.036 1
1 337 . 16 1 1 A 30 30 ALA C C 30 179.128 179.244 -0.116 1
1 338 . 16 1 1 A 30 30 ALA CA C 30 55.714 55.720 -0.006 1
1 339 . 16 1 1 A 30 30 ALA CB C 30 18.955 18.132 0.823 1
1 340 . 16 1 1 A 30 30 ALA N N 30 124.617 123.243 1.374 1
1 341 . 16 1 1 A 31 31 ALA H H 31 8.968 8.475 0.493 1
1 342 . 16 1 1 A 31 31 ALA HA H 31 3.890 4.031 -0.141 1
1 346 . 16 1 1 A 31 31 ALA C C 31 180.352 179.818 0.534 1
1 347 . 16 1 1 A 31 31 ALA CA C 31 55.454 55.488 -0.034 1
1 348 . 16 1 1 A 31 31 ALA CB C 31 17.124 18.311 -1.187 1
1 349 . 16 1 1 A 31 31 ALA N N 31 119.327 120.264 -0.937 1
1 350 . 16 1 1 A 32 32 SER H H 32 7.995 7.752 0.243 1
1 351 . 16 1 1 A 32 32 SER HA H 32 4.238 4.262 -0.024 1
1 354 . 16 1 1 A 32 32 SER C C 32 175.612 176.423 -0.811 1
1 355 . 16 1 1 A 32 32 SER CA C 32 61.203 61.368 -0.165 1
1 356 . 16 1 1 A 32 32 SER CB C 32 63.406 63.132 0.274 1
1 357 . 16 1 1 A 32 32 SER N N 32 111.962 113.095 -1.133 1
1 358 . 16 1 1 A 33 33 GLN H H 33 8.333 7.977 0.356 1
1 359 . 16 1 1 A 33 33 GLN HA H 33 3.992 4.321 -0.329 1
1 366 . 16 1 1 A 33 33 GLN C C 33 177.486 177.206 0.280 1
1 367 . 16 1 1 A 33 33 GLN CA C 33 58.277 57.871 0.406 1
1 368 . 16 1 1 A 33 33 GLN CB C 33 29.140 29.986 -0.846 1
1 370 . 16 1 1 A 33 33 GLN N N 33 119.527 119.497 0.030 1
1 372 . 16 1 1 A 34 34 TYR H H 34 8.587 8.316 0.271 1
1 373 . 16 1 1 A 34 34 TYR HA H 34 4.792 4.615 0.177 1
1 380 . 16 1 1 A 34 34 TYR C C 34 176.499 176.645 -0.146 1
1 381 . 16 1 1 A 34 34 TYR CA C 34 57.711 58.895 -1.184 1
1 382 . 16 1 1 A 34 34 TYR CB C 34 39.561 39.209 0.352 1
1 387 . 16 1 1 A 34 34 TYR N N 34 114.610 114.688 -0.078 1
1 388 . 16 1 1 A 35 35 GLY H H 35 7.346 8.625 -1.279 1
1 389 . 16 1 1 A 35 35 GLY HA2 H 35 4.785 4.091 0.694 1
1 390 . 16 1 1 A 35 35 GLY HA3 H 35 4.007 4.097 -0.090 1
1 391 . 16 1 1 A 35 35 GLY C C 35 175.796 172.964 2.832 1
1 392 . 16 1 1 A 35 35 GLY CA C 35 44.355 44.868 -0.513 1
1 393 . 16 1 1 A 35 35 GLY N N 35 108.501 106.746 1.755 1
1 394 . 16 1 1 A 36 36 ALA H H 36 9.363 8.268 1.095 1
1 395 . 16 1 1 A 36 36 ALA HA H 36 4.217 4.811 -0.594 1
1 399 . 16 1 1 A 36 36 ALA C C 36 178.039 177.615 0.424 1
1 400 . 16 1 1 A 36 36 ALA CA C 36 56.114 51.559 4.555 1
1 401 . 16 1 1 A 36 36 ALA CB C 36 19.179 20.172 -0.993 1
1 402 . 16 1 1 A 36 36 ALA N N 36 125.811 122.864 2.947 1
1 403 . 16 1 1 A 37 37 THR H H 37 8.070 8.811 -0.741 1
1 404 . 16 1 1 A 37 37 THR HA H 37 4.570 4.463 0.107 1
1 409 . 16 1 1 A 37 37 THR C C 37 173.685 174.575 -0.890 1
1 410 . 16 1 1 A 37 37 THR CA C 37 59.822 62.843 -3.021 1
1 411 . 16 1 1 A 37 37 THR CB C 37 68.267 71.566 -3.299 1
1 413 . 16 1 1 A 37 37 THR N N 37 129.410 117.685 11.725 1
1 414 . 16 1 1 A 38 38 ALA H H 38 6.853 7.947 -1.094 1
1 415 . 16 1 1 A 38 38 ALA HA H 38 4.601 4.564 0.037 1
1 419 . 16 1 1 A 38 38 ALA CA C 38 50.758 50.725 0.033 1
1 420 . 16 1 1 A 38 38 ALA CB C 38 18.325 19.227 -0.902 1
1 421 . 16 1 1 A 38 38 ALA N N 38 124.674 124.915 -0.241 1
1 422 . 16 1 1 A 40 40 TYR HA H 40 4.032 3.994 0.038 1
1 429 . 16 1 1 A 40 40 TYR C C 40 176.456 177.289 -0.833 1
1 430 . 16 1 1 A 40 40 TYR CA C 40 61.010 61.861 -0.851 1
1 431 . 16 1 1 A 40 40 TYR CB C 40 39.286 38.606 0.680 1
1 436 . 16 1 1 A 41 41 THR H H 41 6.874 8.242 -1.368 1
1 437 . 16 1 1 A 41 41 THR HA H 41 3.616 3.716 -0.100 1
1 442 . 16 1 1 A 41 41 THR C C 41 176.930 176.500 0.430 1
1 443 . 16 1 1 A 41 41 THR CA C 41 65.557 65.594 -0.037 1
1 444 . 16 1 1 A 41 41 THR CB C 41 68.228 69.213 -0.985 1
1 446 . 16 1 1 A 41 41 THR N N 41 115.143 113.921 1.222 1
1 447 . 16 1 1 A 42 42 LEU H H 42 8.623 7.469 1.154 1
1 448 . 16 1 1 A 42 42 LEU HA H 42 3.708 4.104 -0.396 1
1 458 . 16 1 1 A 42 42 LEU C C 42 178.206 178.995 -0.789 1
1 459 . 16 1 1 A 42 42 LEU CA C 42 57.417 57.719 -0.302 1
1 460 . 16 1 1 A 42 42 LEU CB C 42 41.342 41.265 0.077 1
1 464 . 16 1 1 A 42 42 LEU N N 42 120.418 118.460 1.958 1
1 465 . 16 1 1 A 43 43 ALA H H 43 7.735 7.876 -0.141 1
1 466 . 16 1 1 A 43 43 ALA HA H 43 4.020 3.994 0.026 1
1 470 . 16 1 1 A 43 43 ALA C C 43 180.826 180.443 0.383 1
1 471 . 16 1 1 A 43 43 ALA CA C 43 54.925 54.984 -0.059 1
1 472 . 16 1 1 A 43 43 ALA CB C 43 17.506 18.204 -0.698 1
1 473 . 16 1 1 A 43 43 ALA N N 43 120.203 121.858 -1.655 1
1 474 . 16 1 1 A 44 44 ILE H H 44 7.149 7.369 -0.220 1
1 475 . 16 1 1 A 44 44 ILE HA H 44 3.603 3.641 -0.038 1
1 485 . 16 1 1 A 44 44 ILE C C 44 178.594 178.095 0.499 1
1 486 . 16 1 1 A 44 44 ILE CA C 44 64.782 64.643 0.139 1
1 487 . 16 1 1 A 44 44 ILE CB C 44 37.472 37.606 -0.134 1
1 491 . 16 1 1 A 44 44 ILE N N 44 118.881 119.531 -0.650 1
1 492 . 16 1 1 A 45 45 VAL H H 45 7.968 7.747 0.221 1
1 493 . 16 1 1 A 45 45 VAL HA H 45 2.925 3.361 -0.436 1
1 501 . 16 1 1 A 45 45 VAL C C 45 177.023 177.620 -0.597 1
1 502 . 16 1 1 A 45 45 VAL CA C 45 67.081 66.882 0.199 1
1 503 . 16 1 1 A 45 45 VAL CB C 45 30.854 31.316 -0.462 1
1 506 . 16 1 1 A 45 45 VAL N N 45 120.764 119.647 1.117 1
1 507 . 16 1 1 A 46 46 GLU H H 46 8.399 8.699 -0.300 1
1 508 . 16 1 1 A 46 46 GLU HA H 46 3.848 3.836 0.012 1
1 513 . 16 1 1 A 46 46 GLU C C 46 178.656 178.994 -0.338 1
1 514 . 16 1 1 A 46 46 GLU CA C 46 59.491 59.569 -0.078 1
1 515 . 16 1 1 A 46 46 GLU CB C 46 28.991 29.257 -0.266 1
1 517 . 16 1 1 A 46 46 GLU N N 46 116.599 119.502 -2.903 1
1 518 . 16 1 1 A 47 47 SER H H 47 7.273 8.262 -0.989 1
1 519 . 16 1 1 A 47 47 SER HA H 47 4.287 4.173 0.114 1
1 521 . 16 1 1 A 47 47 SER CA C 47 61.047 61.094 -0.047 1
1 522 . 16 1 1 A 47 47 SER CB C 47 63.016 62.699 0.317 1
1 523 . 16 1 1 A 47 47 SER N N 47 113.609 114.680 -1.071 1
1 524 . 16 1 1 A 48 48 VAL H H 48 8.006 7.785 0.221 1
1 525 . 16 1 1 A 48 48 VAL HA H 48 3.556 3.656 -0.100 1
1 533 . 16 1 1 A 48 48 VAL C C 48 177.257 178.268 -1.011 1
1 534 . 16 1 1 A 48 48 VAL CA C 48 65.025 66.143 -1.118 1
1 535 . 16 1 1 A 48 48 VAL CB C 48 31.841 31.241 0.600 1
1 538 . 16 1 1 A 48 48 VAL N N 48 122.327 122.302 0.025 1
1 539 . 16 1 1 A 49 49 ALA H H 49 8.369 7.865 0.504 1
1 540 . 16 1 1 A 49 49 ALA HA H 49 4.115 4.202 -0.087 1
1 544 . 16 1 1 A 49 49 ALA C C 49 177.307 178.191 -0.884 1
1 545 . 16 1 1 A 49 49 ALA CA C 49 53.253 54.128 -0.875 1
1 546 . 16 1 1 A 49 49 ALA CB C 49 20.131 18.251 1.880 1
1 547 . 16 1 1 A 49 49 ALA N N 49 118.050 121.569 -3.519 1
1 548 . 16 1 1 A 50 50 ASP H H 50 7.052 7.908 -0.856 1
1 549 . 16 1 1 A 50 50 ASP HA H 50 4.788 4.627 0.161 1
1 552 . 16 1 1 A 50 50 ASP C C 50 175.481 175.965 -0.484 1
1 553 . 16 1 1 A 50 50 ASP CA C 50 53.681 54.110 -0.429 1
1 554 . 16 1 1 A 50 50 ASP CB C 50 39.333 40.985 -1.652 1
1 555 . 16 1 1 A 50 50 ASP N N 50 116.997 117.361 -0.364 1
1 556 . 16 1 1 A 51 51 ASN H H 51 8.535 7.425 1.110 1
1 557 . 16 1 1 A 51 51 ASN HA H 51 4.628 4.807 -0.179 1
1 562 . 16 1 1 A 51 51 ASN C C 51 174.077 174.708 -0.631 1
1 563 . 16 1 1 A 51 51 ASN CA C 51 52.315 51.893 0.422 1
1 564 . 16 1 1 A 51 51 ASN CB C 51 41.928 41.297 0.631 1
1 565 . 16 1 1 A 51 51 ASN N N 51 118.626 117.401 1.225 1
1 567 . 16 1 1 A 52 52 TRP H H 52 8.555 8.609 -0.054 1
1 574 . 16 1 1 A 52 52 TRP C C 52 173.269 176.490 -3.221 1
1 575 . 16 1 1 A 52 52 TRP CA C 52 55.031 56.790 -1.759 1
1 576 . 16 1 1 A 52 52 TRP CB C 52 26.801 30.384 -3.583 1
1 582 . 16 1 1 A 52 52 TRP N N 52 120.693 121.009 -0.316 1
1 584 . 16 1 1 A 53 53 LEU H H 53 7.847 8.996 -1.149 1
1 585 . 16 1 1 A 53 53 LEU HA H 53 4.859 5.136 -0.277 1
1 595 . 16 1 1 A 53 53 LEU C C 53 177.397 175.413 1.984 1
1 596 . 16 1 1 A 53 53 LEU CA C 53 53.619 53.179 0.440 1
1 597 . 16 1 1 A 53 53 LEU CB C 53 41.812 46.045 -4.233 1
1 601 . 16 1 1 A 53 53 LEU N N 53 124.741 120.716 4.025 1
1 602 . 16 1 1 A 54 54 THR H H 54 8.850 8.788 0.062 1
1 603 . 16 1 1 A 54 54 THR HA H 54 4.598 4.740 -0.142 1
1 608 . 16 1 1 A 54 54 THR CA C 54 60.531 58.987 1.544 1
1 609 . 16 1 1 A 54 54 THR CB C 54 67.183 70.274 -3.091 1
1 611 . 16 1 1 A 54 54 THR N N 54 113.407 110.748 2.659 1
1 612 . 16 1 1 A 55 55 PRO HA H 55 4.511 4.444 0.067 1
1 619 . 16 1 1 A 55 55 PRO C C 55 179.383 178.857 0.526 1
1 620 . 16 1 1 A 55 55 PRO CA C 55 67.159 64.663 2.496 1
1 621 . 16 1 1 A 55 55 PRO CB C 55 32.095 31.944 0.151 1
1 622 . 16 1 1 A 56 56 THR H H 56 8.575 7.798 0.777 1
1 623 . 16 1 1 A 56 56 THR HA H 56 4.229 4.056 0.173 1
1 628 . 16 1 1 A 56 56 THR C C 56 176.668 175.883 0.785 1
1 629 . 16 1 1 A 56 56 THR CA C 56 66.943 65.922 1.021 1
1 630 . 16 1 1 A 56 56 THR CB C 56 68.129 68.172 -0.043 1
1 632 . 16 1 1 A 56 56 THR N N 56 114.855 112.255 2.600 1
1 633 . 16 1 1 A 57 57 ASP H H 57 8.730 8.226 0.504 1
1 634 . 16 1 1 A 57 57 ASP HA H 57 4.425 4.568 -0.143 1
1 637 . 16 1 1 A 57 57 ASP C C 57 178.351 179.144 -0.793 1
1 638 . 16 1 1 A 57 57 ASP CA C 57 57.963 57.725 0.238 1
1 639 . 16 1 1 A 57 57 ASP CB C 57 40.134 40.781 -0.647 1
1 640 . 16 1 1 A 57 57 ASP N N 57 126.239 120.220 6.019 1
1 641 . 16 1 1 A 58 58 TRP H H 58 8.244 8.349 -0.105 1
1 642 . 16 1 1 A 58 58 TRP HA H 58 4.030 4.486 -0.456 1
1 650 . 16 1 1 A 58 58 TRP C C 58 177.432 178.867 -1.435 1
1 651 . 16 1 1 A 58 58 TRP CA C 58 62.731 59.909 2.822 1
1 652 . 16 1 1 A 58 58 TRP CB C 58 29.122 29.206 -0.084 1
1 657 . 16 1 1 A 58 58 TRP N N 58 119.241 120.471 -1.230 1
1 659 . 16 1 1 A 59 59 ASN H H 59 8.098 8.768 -0.670 1
1 660 . 16 1 1 A 59 59 ASN HA H 59 4.424 4.507 -0.083 1
1 663 . 16 1 1 A 59 59 ASN C C 59 176.952 178.033 -1.081 1
1 664 . 16 1 1 A 59 59 ASN CA C 59 58.135 56.420 1.715 1
1 665 . 16 1 1 A 59 59 ASN CB C 59 40.168 39.206 0.962 1
1 666 . 16 1 1 A 59 59 ASN N N 59 115.747 117.583 -1.836 1
1 667 . 16 1 1 A 60 60 THR H H 60 8.712 7.837 0.875 1
1 668 . 16 1 1 A 60 60 THR HA H 60 3.717 3.892 -0.175 1
1 673 . 16 1 1 A 60 60 THR C C 60 176.044 176.640 -0.596 1
1 674 . 16 1 1 A 60 60 THR CA C 60 66.576 67.574 -0.998 1
1 675 . 16 1 1 A 60 60 THR CB C 60 69.251 67.781 1.470 1
1 677 . 16 1 1 A 60 60 THR N N 60 114.896 116.290 -1.394 1
1 678 . 16 1 1 A 61 61 LEU H H 61 8.485 8.344 0.141 1
1 679 . 16 1 1 A 61 61 LEU HA H 61 3.391 4.052 -0.661 1
1 689 . 16 1 1 A 61 61 LEU C C 61 177.433 178.840 -1.407 1
1 690 . 16 1 1 A 61 61 LEU CA C 61 58.354 58.672 -0.318 1
1 691 . 16 1 1 A 61 61 LEU CB C 61 41.761 42.313 -0.552 1
1 695 . 16 1 1 A 61 61 LEU N N 61 123.433 121.901 1.532 1
1 696 . 16 1 1 A 62 62 VAL H H 62 8.073 8.309 -0.236 1
1 697 . 16 1 1 A 62 62 VAL HA H 62 3.207 3.879 -0.672 1
1 705 . 16 1 1 A 62 62 VAL C C 62 177.585 177.679 -0.094 1
1 706 . 16 1 1 A 62 62 VAL CA C 62 67.345 65.463 1.882 1
1 707 . 16 1 1 A 62 62 VAL CB C 62 30.905 30.933 -0.028 1
1 710 . 16 1 1 A 62 62 VAL N N 62 116.018 118.636 -2.618 1
1 711 . 16 1 1 A 63 63 ARG H H 63 7.765 8.104 -0.339 1
1 712 . 16 1 1 A 63 63 ARG HA H 63 3.602 4.071 -0.469 1
1 719 . 16 1 1 A 63 63 ARG C C 63 177.818 178.276 -0.458 1
1 720 . 16 1 1 A 63 63 ARG CA C 63 58.049 58.003 0.046 1
1 721 . 16 1 1 A 63 63 ARG CB C 63 29.955 29.212 0.743 1
1 724 . 16 1 1 A 63 63 ARG N N 63 116.700 120.642 -3.942 1
1 725 . 16 1 1 A 64 64 ALA H H 64 7.574 7.430 0.144 1
1 726 . 16 1 1 A 64 64 ALA HA H 64 4.158 4.374 -0.216 1
1 730 . 16 1 1 A 64 64 ALA C C 64 179.886 179.340 0.546 1
1 731 . 16 1 1 A 64 64 ALA CA C 64 54.007 54.086 -0.079 1
1 732 . 16 1 1 A 64 64 ALA CB C 64 19.147 19.759 -0.612 1
1 733 . 16 1 1 A 64 64 ALA N N 64 117.555 122.109 -4.554 1
1 734 . 16 1 1 A 65 65 VAL H H 65 7.554 8.126 -0.572 1
1 735 . 16 1 1 A 65 65 VAL HA H 65 4.253 3.890 0.363 1
1 743 . 16 1 1 A 65 65 VAL C C 65 174.180 176.244 -2.064 1
1 744 . 16 1 1 A 65 65 VAL CA C 65 62.683 65.522 -2.839 1
1 745 . 16 1 1 A 65 65 VAL CB C 65 33.458 31.213 2.245 1
1 748 . 16 1 1 A 65 65 VAL N N 65 110.013 115.574 -5.561 1
1 749 . 16 1 1 A 66 66 LEU H H 66 7.792 7.238 0.554 1
1 750 . 16 1 1 A 66 66 LEU HA H 66 4.790 4.818 -0.028 1
1 760 . 16 1 1 A 66 66 LEU C C 66 177.537 175.600 1.937 1
1 761 . 16 1 1 A 66 66 LEU CA C 66 52.823 52.794 0.029 1
1 762 . 16 1 1 A 66 66 LEU CB C 66 44.071 45.801 -1.730 1
1 766 . 16 1 1 A 66 66 LEU N N 66 118.967 121.014 -2.047 1
1 767 . 16 1 1 A 67 67 SER H H 67 9.208 8.400 0.808 1
1 768 . 16 1 1 A 67 67 SER HA H 67 4.414 4.923 -0.509 1
1 771 . 16 1 1 A 67 67 SER CA C 67 57.943 57.737 0.206 1
1 772 . 16 1 1 A 67 67 SER CB C 67 64.743 66.041 -1.298 1
1 773 . 16 1 1 A 67 67 SER N N 67 116.378 116.597 -0.219 1
1 774 . 16 1 1 A 69 69 GLY HA2 H 69 3.916 3.742 0.174 1
1 775 . 16 1 1 A 69 69 GLY HA3 H 69 3.867 3.762 0.105 1
1 776 . 16 1 1 A 69 69 GLY C C 69 176.783 175.540 1.243 1
1 777 . 16 1 1 A 69 69 GLY CA C 69 46.977 46.533 0.444 1
1 778 . 16 1 1 A 70 70 ASP H H 70 7.674 8.148 -0.474 1
1 779 . 16 1 1 A 70 70 ASP HA H 70 4.511 3.728 0.783 1
1 782 . 16 1 1 A 70 70 ASP C C 70 178.096 178.214 -0.118 1
1 783 . 16 1 1 A 70 70 ASP CA C 70 57.262 56.509 0.753 1
1 784 . 16 1 1 A 70 70 ASP CB C 70 40.594 39.664 0.930 1
1 785 . 16 1 1 A 70 70 ASP N N 70 123.930 121.706 2.224 1
1 786 . 16 1 1 A 71 71 HIS H H 71 8.729 7.905 0.824 1
1 787 . 16 1 1 A 71 71 HIS HA H 71 4.235 4.217 0.018 1
1 790 . 16 1 1 A 71 71 HIS C C 71 176.769 176.974 -0.205 1
1 791 . 16 1 1 A 71 71 HIS CA C 71 60.041 59.764 0.277 1
1 792 . 16 1 1 A 71 71 HIS CB C 71 30.682 30.109 0.573 1
1 793 . 16 1 1 A 71 71 HIS N N 71 121.003 119.530 1.473 1
1 794 . 16 1 1 A 72 72 LEU H H 72 7.620 7.961 -0.341 1
1 795 . 16 1 1 A 72 72 LEU HA H 72 3.769 3.976 -0.207 1
1 805 . 16 1 1 A 72 72 LEU C C 72 180.275 179.058 1.217 1
1 806 . 16 1 1 A 72 72 LEU CA C 72 58.192 57.993 0.199 1
1 807 . 16 1 1 A 72 72 LEU CB C 72 41.381 41.304 0.077 1
1 811 . 16 1 1 A 72 72 LEU N N 72 118.569 118.748 -0.179 1
1 812 . 16 1 1 A 73 73 LEU H H 73 7.542 7.444 0.098 1
1 813 . 16 1 1 A 73 73 LEU HA H 73 4.107 4.228 -0.121 1
1 823 . 16 1 1 A 73 73 LEU C C 73 179.436 179.102 0.334 1
1 824 . 16 1 1 A 73 73 LEU CA C 73 58.026 57.234 0.792 1
1 825 . 16 1 1 A 73 73 LEU CB C 73 41.638 42.083 -0.445 1
1 829 . 16 1 1 A 73 73 LEU N N 73 121.418 120.120 1.298 1
1 830 . 16 1 1 A 74 74 TRP H H 74 8.786 7.977 0.809 1
1 831 . 16 1 1 A 74 74 TRP HA H 74 3.589 5.250 -1.661 1
1 840 . 16 1 1 A 74 74 TRP C C 74 176.816 178.603 -1.787 1
1 841 . 16 1 1 A 74 74 TRP CA C 74 63.046 59.929 3.117 1
1 842 . 16 1 1 A 74 74 TRP CB C 74 28.065 29.191 -1.126 1
1 848 . 16 1 1 A 74 74 TRP N N 74 121.111 118.284 2.827 1
1 850 . 16 1 1 A 75 75 LYS H H 75 8.939 7.509 1.430 1
1 851 . 16 1 1 A 75 75 LYS HA H 75 3.055 4.108 -1.053 1
1 860 . 16 1 1 A 75 75 LYS C C 75 177.967 179.140 -1.173 1
1 861 . 16 1 1 A 75 75 LYS CA C 75 60.029 58.611 1.418 1
1 862 . 16 1 1 A 75 75 LYS CB C 75 32.533 32.636 -0.103 1
1 866 . 16 1 1 A 75 75 LYS N N 75 119.783 118.620 1.163 1
1 867 . 16 1 1 A 76 76 SER H H 76 7.832 7.848 -0.016 1
1 868 . 16 1 1 A 76 76 SER HA H 76 4.040 4.352 -0.312 1
1 871 . 16 1 1 A 76 76 SER C C 76 177.816 177.358 0.458 1
1 872 . 16 1 1 A 76 76 SER CA C 76 62.105 61.586 0.519 1
1 873 . 16 1 1 A 76 76 SER CB C 76 62.679 62.991 -0.312 1
1 874 . 16 1 1 A 76 76 SER N N 76 113.395 114.839 -1.444 1
1 875 . 16 1 1 A 77 77 GLU H H 77 7.590 7.684 -0.094 1
1 876 . 16 1 1 A 77 77 GLU HA H 77 4.042 4.250 -0.208 1
1 881 . 16 1 1 A 77 77 GLU C C 77 177.809 178.509 -0.700 1
1 882 . 16 1 1 A 77 77 GLU CA C 77 58.270 58.729 -0.459 1
1 883 . 16 1 1 A 77 77 GLU CB C 77 29.208 29.361 -0.153 1
1 885 . 16 1 1 A 77 77 GLU N N 77 121.574 121.953 -0.379 1
1 886 . 16 1 1 A 78 78 PHE H H 78 9.081 7.748 1.333 1
1 887 . 16 1 1 A 78 78 PHE HA H 78 3.778 4.199 -0.421 1
1 895 . 16 1 1 A 78 78 PHE C C 78 178.114 177.239 0.875 1
1 896 . 16 1 1 A 78 78 PHE CA C 78 60.629 61.234 -0.605 1
1 897 . 16 1 1 A 78 78 PHE CB C 78 38.295 38.449 -0.154 1
1 902 . 16 1 1 A 78 78 PHE N N 78 122.682 121.991 0.691 1
1 903 . 16 1 1 A 79 79 PHE H H 79 8.890 8.091 0.799 1
1 904 . 16 1 1 A 79 79 PHE HA H 79 3.800 4.077 -0.277 1
1 912 . 16 1 1 A 79 79 PHE C C 79 178.354 178.292 0.062 1
1 913 . 16 1 1 A 79 79 PHE CA C 79 60.704 61.886 -1.182 1
1 914 . 16 1 1 A 79 79 PHE CB C 79 37.184 38.518 -1.334 1
1 920 . 16 1 1 A 79 79 PHE N N 79 121.056 117.783 3.273 1
1 921 . 16 1 1 A 80 80 GLU H H 80 7.793 8.251 -0.458 1
1 922 . 16 1 1 A 80 80 GLU HA H 80 4.082 4.010 0.072 1
1 927 . 16 1 1 A 80 80 GLU C C 80 179.068 178.934 0.134 1
1 928 . 16 1 1 A 80 80 GLU CA C 80 59.735 59.384 0.351 1
1 929 . 16 1 1 A 80 80 GLU CB C 80 28.722 29.167 -0.445 1
1 931 . 16 1 1 A 80 80 GLU N N 80 120.312 119.024 1.288 1
1 932 . 16 1 1 A 81 81 ASN H H 81 8.624 8.886 -0.262 1
1 933 . 16 1 1 A 81 81 ASN HA H 81 4.521 4.416 0.105 1
1 938 . 16 1 1 A 81 81 ASN C C 81 179.262 177.658 1.604 1
1 939 . 16 1 1 A 81 81 ASN CA C 81 55.504 55.978 -0.474 1
1 940 . 16 1 1 A 81 81 ASN CB C 81 37.517 37.355 0.162 1
1 941 . 16 1 1 A 81 81 ASN N N 81 119.338 117.258 2.080 1
1 943 . 16 1 1 A 82 82 CYS H H 82 8.554 7.990 0.564 1
1 944 . 16 1 1 A 82 82 CYS HA H 82 3.792 4.030 -0.238 1
1 947 . 16 1 1 A 82 82 CYS C C 82 176.478 176.686 -0.208 1
1 948 . 16 1 1 A 82 82 CYS CA C 82 65.232 61.874 3.358 1
1 949 . 16 1 1 A 82 82 CYS CB C 82 26.762 26.726 0.036 1
1 950 . 16 1 1 A 82 82 CYS N N 82 120.576 117.617 2.959 1
1 951 . 16 1 1 A 83 83 ARG H H 83 8.522 8.066 0.456 1
1 952 . 16 1 1 A 83 83 ARG HA H 83 3.932 4.136 -0.204 1
1 960 . 16 1 1 A 83 83 ARG C C 83 179.138 178.721 0.417 1
1 961 . 16 1 1 A 83 83 ARG CA C 83 60.443 58.987 1.456 1
1 962 . 16 1 1 A 83 83 ARG CB C 83 29.550 29.975 -0.425 1
1 965 . 16 1 1 A 83 83 ARG N N 83 123.035 120.468 2.567 1
1 967 . 16 1 1 A 84 84 ASP H H 84 7.791 8.061 -0.270 1
1 968 . 16 1 1 A 84 84 ASP HA H 84 4.353 4.415 -0.062 1
1 971 . 16 1 1 A 84 84 ASP C C 84 178.649 178.611 0.038 1
1 972 . 16 1 1 A 84 84 ASP CA C 84 57.767 57.622 0.145 1
1 973 . 16 1 1 A 84 84 ASP CB C 84 41.305 41.598 -0.293 1
1 974 . 16 1 1 A 84 84 ASP N N 84 120.332 119.512 0.820 1
1 975 . 16 1 1 A 85 85 THR H H 85 8.370 8.070 0.300 1
1 976 . 16 1 1 A 85 85 THR HA H 85 3.730 3.935 -0.205 1
1 981 . 16 1 1 A 85 85 THR C C 85 175.198 176.443 -1.245 1
1 982 . 16 1 1 A 85 85 THR CA C 85 66.830 65.970 0.860 1
1 983 . 16 1 1 A 85 85 THR CB C 85 68.533 68.219 0.314 1
1 985 . 16 1 1 A 85 85 THR N N 85 117.360 115.538 1.822 1
1 986 . 16 1 1 A 86 86 ALA H H 86 8.845 8.411 0.434 1
1 987 . 16 1 1 A 86 86 ALA HA H 86 3.991 4.191 -0.200 1
1 991 . 16 1 1 A 86 86 ALA C C 86 179.980 179.743 0.237 1
1 992 . 16 1 1 A 86 86 ALA CA C 86 55.769 55.689 0.080 1
1 993 . 16 1 1 A 86 86 ALA CB C 86 17.881 18.375 -0.494 1
1 994 . 16 1 1 A 86 86 ALA N N 86 123.613 123.362 0.251 1
1 995 . 16 1 1 A 87 87 LYS H H 87 7.686 8.096 -0.410 1
1 996 . 16 1 1 A 87 87 LYS HA H 87 4.099 4.020 0.079 1
1 1005 . 16 1 1 A 87 87 LYS C C 87 179.592 178.640 0.952 1
1 1006 . 16 1 1 A 87 87 LYS CA C 87 59.708 59.246 0.462 1
1 1007 . 16 1 1 A 87 87 LYS CB C 87 32.054 31.933 0.121 1
1 1011 . 16 1 1 A 87 87 LYS N N 87 119.623 117.060 2.563 1
1 1012 . 16 1 1 A 88 88 ARG H H 88 7.683 7.850 -0.167 1
1 1013 . 16 1 1 A 88 88 ARG HA H 88 4.051 4.149 -0.098 1
1 1020 . 16 1 1 A 88 88 ARG C C 88 180.053 178.966 1.087 1
1 1021 . 16 1 1 A 88 88 ARG CA C 88 59.558 59.282 0.276 1
1 1022 . 16 1 1 A 88 88 ARG CB C 88 29.684 30.207 -0.523 1
1 1025 . 16 1 1 A 88 88 ARG N N 88 120.788 119.160 1.628 1
1 1026 . 16 1 1 A 89 89 ASN H H 89 8.973 8.360 0.613 1
1 1027 . 16 1 1 A 89 89 ASN HA H 89 4.354 4.625 -0.271 1
1 1032 . 16 1 1 A 89 89 ASN C C 89 178.382 178.675 -0.293 1
1 1033 . 16 1 1 A 89 89 ASN CA C 89 55.334 55.844 -0.510 1
1 1034 . 16 1 1 A 89 89 ASN CB C 89 37.864 38.290 -0.426 1
1 1035 . 16 1 1 A 89 89 ASN N N 89 121.012 117.827 3.185 1
1 1037 . 16 1 1 A 90 90 GLN H H 90 8.152 7.967 0.185 1
1 1038 . 16 1 1 A 90 90 GLN HA H 90 4.020 4.141 -0.121 1
1 1045 . 16 1 1 A 90 90 GLN C C 90 179.075 178.536 0.539 1
1 1046 . 16 1 1 A 90 90 GLN CA C 90 59.318 58.922 0.396 1
1 1047 . 16 1 1 A 90 90 GLN CB C 90 28.049 28.204 -0.155 1
1 1049 . 16 1 1 A 90 90 GLN N N 90 122.122 120.343 1.779 1
1 1051 . 16 1 1 A 91 91 GLN H H 91 7.514 8.226 -0.712 1
1 1052 . 16 1 1 A 91 91 GLN HA H 91 4.053 4.080 -0.027 1
1 1059 . 16 1 1 A 91 91 GLN C C 91 177.081 177.949 -0.868 1
1 1060 . 16 1 1 A 91 91 GLN CA C 91 58.031 58.389 -0.358 1
1 1061 . 16 1 1 A 91 91 GLN CB C 91 28.365 27.913 0.452 1
1 1063 . 16 1 1 A 91 91 GLN N N 91 118.124 118.182 -0.058 1
1 1065 . 16 1 1 A 92 92 ALA H H 92 7.704 7.349 0.355 1
1 1066 . 16 1 1 A 92 92 ALA HA H 92 4.246 4.270 -0.024 1
1 1070 . 16 1 1 A 92 92 ALA C C 92 178.450 178.037 0.413 1
1 1071 . 16 1 1 A 92 92 ALA CA C 92 52.671 52.644 0.027 1
1 1072 . 16 1 1 A 92 92 ALA CB C 92 19.316 19.700 -0.384 1
1 1073 . 16 1 1 A 92 92 ALA N N 92 119.880 120.290 -0.410 1
1 1074 . 16 1 1 A 93 93 GLY H H 93 7.693 7.802 -0.109 1
1 1075 . 16 1 1 A 93 93 GLY HA2 H 93 3.941 3.950 -0.009 1
1 1076 . 16 1 1 A 93 93 GLY HA3 H 93 3.744 3.956 -0.212 1
1 1077 . 16 1 1 A 93 93 GLY C C 93 174.344 175.174 -0.830 1
1 1078 . 16 1 1 A 93 93 GLY CA C 93 45.949 46.364 -0.415 1
1 1079 . 16 1 1 A 93 93 GLY N N 93 105.347 106.354 -1.007 1
1 1080 . 16 1 1 A 94 94 ASN H H 94 7.076 8.741 -1.665 1
1 1081 . 16 1 1 A 94 94 ASN HA H 94 4.115 4.688 -0.573 1
1 1085 . 16 1 1 A 94 94 ASN C C 94 175.410 175.702 -0.292 1
1 1086 . 16 1 1 A 94 94 ASN CA C 94 52.651 52.921 -0.270 1
1 1087 . 16 1 1 A 94 94 ASN CB C 94 38.330 39.674 -1.344 1
1 1088 . 16 1 1 A 94 94 ASN N N 94 115.747 116.565 -0.818 1
1 1090 . 16 1 1 A 95 95 GLY H H 95 8.236 8.097 0.139 1
1 1091 . 16 1 1 A 95 95 GLY HA2 H 95 3.633 3.801 -0.168 1
1 1092 . 16 1 1 A 95 95 GLY HA3 H 95 3.633 3.929 -0.296 1
1 1093 . 16 1 1 A 95 95 GLY C C 95 174.450 174.141 0.309 1
1 1094 . 16 1 1 A 95 95 GLY CA C 95 45.522 45.487 0.035 1
1 1095 . 16 1 1 A 95 95 GLY N N 95 109.166 107.102 2.064 1
1 1096 . 16 1 1 A 96 96 TRP H H 96 7.899 7.846 0.053 1
1 1097 . 16 1 1 A 96 96 TRP HA H 96 5.241 4.971 0.270 1
1 1106 . 16 1 1 A 96 96 TRP C C 96 175.661 176.453 -0.792 1
1 1107 . 16 1 1 A 96 96 TRP CA C 96 55.090 57.268 -2.178 1
1 1108 . 16 1 1 A 96 96 TRP CB C 96 27.138 31.601 -4.463 1
1 1114 . 16 1 1 A 96 96 TRP N N 96 122.840 121.362 1.478 1
1 1116 . 16 1 1 A 97 97 ASP H H 97 7.344 9.204 -1.860 1
1 1117 . 16 1 1 A 97 97 ASP HA H 97 4.829 4.407 0.422 1
1 1120 . 16 1 1 A 97 97 ASP C C 97 175.019 176.480 -1.461 1
1 1121 . 16 1 1 A 97 97 ASP CA C 97 52.149 56.369 -4.220 1
1 1122 . 16 1 1 A 97 97 ASP CB C 97 42.697 39.428 3.269 1
1 1123 . 16 1 1 A 97 97 ASP N N 97 126.861 117.342 9.519 1
1 1124 . 16 1 1 A 98 98 PHE H H 98 8.566 8.442 0.124 1
1 1125 . 16 1 1 A 98 98 PHE HA H 98 3.727 3.957 -0.230 1
1 1133 . 16 1 1 A 98 98 PHE C C 98 177.443 177.491 -0.048 1
1 1134 . 16 1 1 A 98 98 PHE CA C 98 62.471 62.080 0.391 1
1 1135 . 16 1 1 A 98 98 PHE CB C 98 39.919 39.220 0.699 1
1 1141 . 16 1 1 A 98 98 PHE N N 98 117.781 119.973 -2.192 1
1 1142 . 16 1 1 A 99 99 ASP H H 99 8.259 8.354 -0.095 1
1 1143 . 16 1 1 A 99 99 ASP HA H 99 3.960 4.161 -0.201 1
1 1146 . 16 1 1 A 99 99 ASP C C 99 178.132 178.434 -0.302 1
1 1147 . 16 1 1 A 99 99 ASP CA C 99 57.658 56.569 1.089 1
1 1148 . 16 1 1 A 99 99 ASP CB C 99 38.572 40.431 -1.859 1
1 1149 . 16 1 1 A 99 99 ASP N N 99 121.709 119.647 2.062 1
1 1150 . 16 1 1 A 100 100 MET H H 100 8.008 7.740 0.268 1
1 1151 . 16 1 1 A 100 100 MET HA H 100 3.644 4.515 -0.871 1
1 1156 . 16 1 1 A 100 100 MET C C 100 180.008 176.761 3.247 1
1 1157 . 16 1 1 A 100 100 MET CA C 100 58.598 58.383 0.215 1
1 1158 . 16 1 1 A 100 100 MET CB C 100 33.423 33.696 -0.273 1
1 1160 . 16 1 1 A 100 100 MET N N 100 119.668 116.307 3.361 1
1 1161 . 16 1 1 A 101 101 LEU H H 101 7.961 8.386 -0.425 1
1 1162 . 16 1 1 A 101 101 LEU HA H 101 3.523 4.104 -0.581 1
1 1172 . 16 1 1 A 101 101 LEU C C 101 173.873 177.555 -3.682 1
1 1173 . 16 1 1 A 101 101 LEU CA C 101 58.743 55.321 3.422 1
1 1174 . 16 1 1 A 101 101 LEU CB C 101 42.632 42.519 0.113 1
1 1178 . 16 1 1 A 101 101 LEU N N 101 119.752 119.306 0.446 1
1 1179 . 16 1 1 A 102 102 THR H H 102 6.955 8.889 -1.934 1
1 1180 . 16 1 1 A 102 102 THR HA H 102 4.134 4.275 -0.141 1
1 1185 . 16 1 1 A 102 102 THR C C 102 176.513 174.716 1.797 1
1 1186 . 16 1 1 A 102 102 THR CA C 102 61.125 63.360 -2.235 1
1 1187 . 16 1 1 A 102 102 THR CB C 102 71.415 66.670 4.745 1
1 1189 . 16 1 1 A 102 102 THR N N 102 124.665 120.249 4.416 1
1 1190 . 16 1 1 A 103 103 GLY H H 103 7.816 8.659 -0.843 1
1 1191 . 16 1 1 A 103 103 GLY HA2 H 103 3.824 4.084 -0.260 1
1 1192 . 16 1 1 A 103 103 GLY HA3 H 103 3.824 4.151 -0.327 1
1 1193 . 16 1 1 A 103 103 GLY C C 103 174.126 175.097 -0.971 1
1 1194 . 16 1 1 A 103 103 GLY CA C 103 47.805 46.679 1.126 1
1 1195 . 16 1 1 A 103 103 GLY N N 103 114.191 111.934 2.257 1
1 1196 . 16 1 1 A 104 104 SER H H 104 8.860 8.258 0.602 1
1 1197 . 16 1 1 A 104 104 SER HA H 104 4.758 4.401 0.357 1
1 1200 . 16 1 1 A 104 104 SER C C 104 174.591 175.367 -0.776 1
1 1201 . 16 1 1 A 104 104 SER CA C 104 56.755 61.069 -4.314 1
1 1202 . 16 1 1 A 104 104 SER CB C 104 65.050 63.369 1.681 1
1 1203 . 16 1 1 A 104 104 SER N N 104 114.771 113.577 1.194 1
1 1204 . 16 1 1 A 105 105 GLY H H 105 8.788 8.662 0.126 1
1 1205 . 16 1 1 A 105 105 GLY HA2 H 105 3.733 3.841 -0.108 1
1 1206 . 16 1 1 A 105 105 GLY HA3 H 105 3.733 3.883 -0.150 1
1 1207 . 16 1 1 A 105 105 GLY CA C 105 47.247 46.746 0.501 1
1 1208 . 16 1 1 A 105 105 GLY N N 105 110.394 108.427 1.967 1
1 1209 . 16 1 1 A 106 106 ASN HA H 106 4.454 4.640 -0.186 1
1 1212 . 16 1 1 A 106 106 ASN C C 106 175.180 176.364 -1.184 1
1 1213 . 16 1 1 A 106 106 ASN CA C 106 54.492 54.554 -0.062 1
1 1214 . 16 1 1 A 106 106 ASN CB C 106 37.282 40.209 -2.927 1
1 1215 . 16 1 1 A 107 107 TYR H H 107 8.241 7.921 0.320 1
1 1216 . 16 1 1 A 107 107 TYR HA H 107 4.335 4.912 -0.577 1
1 1223 . 16 1 1 A 107 107 TYR C C 107 173.954 176.261 -2.307 1
1 1224 . 16 1 1 A 107 107 TYR CA C 107 57.727 57.151 0.576 1
1 1225 . 16 1 1 A 107 107 TYR CB C 107 37.063 39.378 -2.315 1
1 1230 . 16 1 1 A 107 107 TYR N N 107 120.708 114.493 6.215 1
1 1231 . 16 1 1 A 108 108 SER H H 108 7.117 7.938 -0.821 1
1 1232 . 16 1 1 A 108 108 SER HA H 108 4.221 4.691 -0.470 1
1 1235 . 16 1 1 A 108 108 SER C C 108 174.834 174.217 0.617 1
1 1236 . 16 1 1 A 108 108 SER CA C 108 59.859 58.700 1.159 1
1 1237 . 16 1 1 A 108 108 SER CB C 108 63.846 64.421 -0.575 1
1 1238 . 16 1 1 A 108 108 SER N N 108 113.362 112.029 1.333 1
1 1239 . 16 1 1 A 109 109 SER H H 109 8.053 7.931 0.122 1
1 1240 . 16 1 1 A 109 109 SER HA H 109 4.560 4.333 0.227 1
1 1243 . 16 1 1 A 109 109 SER CA C 109 57.141 60.874 -3.733 1
1 1244 . 16 1 1 A 109 109 SER CB C 109 64.874 61.921 2.953 1
1 1245 . 16 1 1 A 109 109 SER N N 109 116.657 113.115 3.542 1
1 1246 . 16 1 1 A 110 110 THR HA H 110 3.541 3.996 -0.455 1
1 1251 . 16 1 1 A 110 110 THR C C 110 175.477 175.712 -0.235 1
1 1252 . 16 1 1 A 110 110 THR CA C 110 66.443 65.860 0.583 1
1 1253 . 16 1 1 A 110 110 THR CB C 110 68.091 68.467 -0.376 1
1 1255 . 16 1 1 A 111 111 ASP H H 111 8.224 8.335 -0.111 1
1 1256 . 16 1 1 A 111 111 ASP HA H 111 4.237 4.322 -0.085 1
1 1259 . 16 1 1 A 111 111 ASP C C 111 177.520 178.630 -1.110 1
1 1260 . 16 1 1 A 111 111 ASP CA C 111 57.559 57.355 0.204 1
1 1261 . 16 1 1 A 111 111 ASP CB C 111 40.292 40.634 -0.342 1
1 1262 . 16 1 1 A 111 111 ASP N N 111 119.490 120.440 -0.950 1
1 1263 . 16 1 1 A 112 112 ALA H H 112 7.431 7.798 -0.367 1
1 1264 . 16 1 1 A 112 112 ALA HA H 112 4.191 4.102 0.089 1
1 1268 . 16 1 1 A 112 112 ALA C C 112 180.646 179.362 1.284 1
1 1269 . 16 1 1 A 112 112 ALA CA C 112 54.534 54.750 -0.216 1
1 1270 . 16 1 1 A 112 112 ALA CB C 112 18.992 18.348 0.644 1
1 1271 . 16 1 1 A 112 112 ALA N N 112 119.710 121.936 -2.226 1
1 1272 . 16 1 1 A 113 113 GLN H H 113 7.576 7.420 0.156 1
1 1273 . 16 1 1 A 113 113 GLN HA H 113 3.562 4.084 -0.522 1
1 1278 . 16 1 1 A 113 113 GLN C C 113 176.756 178.133 -1.377 1
1 1279 . 16 1 1 A 113 113 GLN CA C 113 57.736 58.608 -0.872 1
1 1280 . 16 1 1 A 113 113 GLN CB C 113 29.110 28.765 0.345 1
1 1281 . 16 1 1 A 113 113 GLN N N 113 117.518 118.288 -0.770 1
1 1283 . 16 1 1 A 114 114 MET H H 114 8.192 8.636 -0.444 1
1 1284 . 16 1 1 A 114 114 MET HA H 114 4.231 4.230 0.001 1
1 1289 . 16 1 1 A 114 114 MET C C 114 175.648 178.044 -2.396 1
1 1290 . 16 1 1 A 114 114 MET CA C 114 57.446 58.005 -0.559 1
1 1291 . 16 1 1 A 114 114 MET CB C 114 33.570 32.329 1.241 1
1 1293 . 16 1 1 A 114 114 MET N N 114 111.509 119.016 -7.507 1
1 1294 . 16 1 1 A 115 115 GLN H H 115 6.940 7.404 -0.464 1
1 1295 . 16 1 1 A 115 115 GLN HA H 115 4.307 4.539 -0.232 1
1 1302 . 16 1 1 A 115 115 GLN C C 115 176.270 175.931 0.339 1
1 1303 . 16 1 1 A 115 115 GLN CA C 115 54.680 55.526 -0.846 1
1 1304 . 16 1 1 A 115 115 GLN CB C 115 28.233 28.875 -0.642 1
1 1306 . 16 1 1 A 115 115 GLN N N 115 114.300 115.892 -1.592 1
1 1308 . 16 1 1 A 116 116 TYR H H 116 6.677 7.911 -1.234 1
1 1309 . 16 1 1 A 116 116 TYR HA H 116 4.193 4.862 -0.669 1
1 1312 . 16 1 1 A 116 116 TYR C C 116 175.268 173.478 1.790 1
1 1313 . 16 1 1 A 116 116 TYR CA C 116 54.357 58.413 -4.056 1
1 1314 . 16 1 1 A 116 116 TYR CB C 116 35.498 37.242 -1.744 1
1 1315 . 16 1 1 A 116 116 TYR N N 116 117.919 119.152 -1.233 1
1 1316 . 16 1 1 A 117 117 ASP H H 117 8.081 8.637 -0.556 1
1 1317 . 16 1 1 A 117 117 ASP HA H 117 4.665 4.884 -0.219 1
1 1320 . 16 1 1 A 117 117 ASP CA C 117 52.422 50.123 2.299 1
1 1321 . 16 1 1 A 117 117 ASP CB C 117 42.416 43.691 -1.275 1
1 1322 . 16 1 1 A 117 117 ASP N N 117 120.887 126.233 -5.346 1
1 1323 . 16 1 1 A 118 118 PRO C C 118 179.180 179.092 0.088 1
1 1324 . 16 1 1 A 118 118 PRO CA C 118 65.942 65.643 0.299 1
1 1325 . 16 1 1 A 118 118 PRO CB C 118 32.197 31.712 0.485 1
1 1326 . 16 1 1 A 119 119 GLY H H 119 9.742 8.505 1.237 1
1 1327 . 16 1 1 A 119 119 GLY C C 119 175.622 175.321 0.301 1
1 1328 . 16 1 1 A 119 119 GLY CA C 119 46.785 46.551 0.234 1
1 1329 . 16 1 1 A 119 119 GLY N N 119 106.412 106.110 0.302 1
1 1330 . 16 1 1 A 120 120 LEU H H 120 6.666 6.983 -0.317 1
1 1331 . 16 1 1 A 120 120 LEU HA H 120 3.365 3.667 -0.302 1
1 1341 . 16 1 1 A 120 120 LEU C C 120 179.262 178.312 0.950 1
1 1342 . 16 1 1 A 120 120 LEU CA C 120 56.605 56.497 0.108 1
1 1343 . 16 1 1 A 120 120 LEU CB C 120 39.262 40.851 -1.589 1
1 1347 . 16 1 1 A 120 120 LEU N N 120 126.226 122.197 4.029 1
1 1348 . 16 1 1 A 121 121 PHE H H 121 7.356 8.486 -1.130 1
1 1349 . 16 1 1 A 121 121 PHE HA H 121 4.459 4.002 0.457 1
1 1352 . 16 1 1 A 121 121 PHE C C 121 179.716 178.086 1.630 1
1 1353 . 16 1 1 A 121 121 PHE CA C 121 62.838 62.133 0.705 1
1 1354 . 16 1 1 A 121 121 PHE CB C 121 37.603 39.571 -1.968 1
1 1355 . 16 1 1 A 121 121 PHE N N 121 117.437 119.201 -1.764 1
1 1356 . 16 1 1 A 122 122 ALA H H 122 7.926 8.266 -0.340 1
1 1357 . 16 1 1 A 122 122 ALA HA H 122 4.523 3.824 0.699 1
1 1361 . 16 1 1 A 122 122 ALA C C 122 180.435 179.602 0.833 1
1 1362 . 16 1 1 A 122 122 ALA CA C 122 55.527 54.974 0.553 1
1 1363 . 16 1 1 A 122 122 ALA CB C 122 17.814 18.274 -0.460 1
1 1364 . 16 1 1 A 122 122 ALA N N 122 121.068 121.248 -0.180 1
1 1365 . 16 1 1 A 123 123 GLN H H 123 7.507 7.535 -0.028 1
1 1366 . 16 1 1 A 123 123 GLN HA H 123 4.153 3.920 0.233 1
1 1371 . 16 1 1 A 123 123 GLN C C 123 180.561 178.707 1.854 1
1 1372 . 16 1 1 A 123 123 GLN CA C 123 59.948 59.003 0.945 1
1 1373 . 16 1 1 A 123 123 GLN CB C 123 29.135 28.193 0.942 1
1 1375 . 16 1 1 A 123 123 GLN N N 123 120.324 118.315 2.009 1
1 1376 . 16 1 1 A 124 124 ILE H H 124 8.318 7.838 0.480 1
1 1377 . 16 1 1 A 124 124 ILE HA H 124 3.635 3.907 -0.272 1
1 1387 . 16 1 1 A 124 124 ILE C C 124 176.481 178.164 -1.683 1
1 1388 . 16 1 1 A 124 124 ILE CA C 124 66.432 64.587 1.845 1
1 1389 . 16 1 1 A 124 124 ILE CB C 124 39.168 37.875 1.293 1
1 1393 . 16 1 1 A 124 124 ILE N N 124 123.747 118.300 5.447 1
1 1394 . 16 1 1 A 125 125 GLN H H 125 8.474 7.943 0.531 1
1 1395 . 16 1 1 A 125 125 GLN HA H 125 4.264 3.970 0.294 1
1 1402 . 16 1 1 A 125 125 GLN C C 125 178.947 177.996 0.951 1
1 1403 . 16 1 1 A 125 125 GLN CA C 125 59.651 58.502 1.149 1
1 1404 . 16 1 1 A 125 125 GLN CB C 125 28.880 28.472 0.408 1
1 1406 . 16 1 1 A 125 125 GLN N N 125 120.368 121.281 -0.913 1
1 1408 . 16 1 1 A 126 126 ALA H H 126 8.002 7.778 0.224 1
1 1409 . 16 1 1 A 126 126 ALA HA H 126 4.144 3.999 0.145 1
1 1413 . 16 1 1 A 126 126 ALA C C 126 179.316 179.920 -0.604 1
1 1414 . 16 1 1 A 126 126 ALA CA C 126 55.036 54.930 0.106 1
1 1415 . 16 1 1 A 126 126 ALA CB C 126 18.087 17.762 0.325 1
1 1416 . 16 1 1 A 126 126 ALA N N 126 121.661 121.104 0.557 1
1 1417 . 16 1 1 A 127 127 ALA H H 127 7.823 8.011 -0.188 1
1 1418 . 16 1 1 A 127 127 ALA HA H 127 4.162 3.964 0.198 1
1 1422 . 16 1 1 A 127 127 ALA C C 127 180.707 179.387 1.320 1
1 1423 . 16 1 1 A 127 127 ALA CA C 127 55.080 54.850 0.230 1
1 1424 . 16 1 1 A 127 127 ALA CB C 127 19.354 18.125 1.229 1
1 1425 . 16 1 1 A 127 127 ALA N N 127 119.853 119.504 0.349 1
1 1426 . 16 1 1 A 128 128 ALA H H 128 8.936 7.519 1.417 1
1 1427 . 16 1 1 A 128 128 ALA HA H 128 3.928 3.689 0.239 1
1 1431 . 16 1 1 A 128 128 ALA C C 128 181.031 179.425 1.606 1
1 1432 . 16 1 1 A 128 128 ALA CA C 128 55.502 54.675 0.827 1
1 1433 . 16 1 1 A 128 128 ALA CB C 128 16.609 17.886 -1.277 1
1 1434 . 16 1 1 A 128 128 ALA N N 128 121.355 120.131 1.224 1
1 1435 . 16 1 1 A 129 129 THR H H 129 8.543 7.433 1.110 1
1 1436 . 16 1 1 A 129 129 THR HA H 129 4.015 3.686 0.329 1
1 1441 . 16 1 1 A 129 129 THR C C 129 177.332 176.424 0.908 1
1 1442 . 16 1 1 A 129 129 THR CA C 129 65.893 65.266 0.627 1
1 1443 . 16 1 1 A 129 129 THR CB C 129 68.566 68.518 0.048 1
1 1445 . 16 1 1 A 129 129 THR N N 129 112.709 112.259 0.450 1
1 1446 . 16 1 1 A 130 130 LYS H H 130 8.126 7.508 0.618 1
1 1447 . 16 1 1 A 130 130 LYS HA H 130 4.000 4.037 -0.037 1
1 1456 . 16 1 1 A 130 130 LYS C C 130 179.082 178.474 0.608 1
1 1457 . 16 1 1 A 130 130 LYS CA C 130 60.299 58.559 1.740 1
1 1458 . 16 1 1 A 130 130 LYS CB C 130 32.767 32.079 0.688 1
1 1462 . 16 1 1 A 130 130 LYS N N 130 123.879 120.339 3.540 1
1 1463 . 16 1 1 A 131 131 ALA H H 131 7.184 7.669 -0.485 1
1 1464 . 16 1 1 A 131 131 ALA HA H 131 4.005 4.233 -0.228 1
1 1468 . 16 1 1 A 131 131 ALA C C 131 178.482 179.535 -1.053 1
1 1469 . 16 1 1 A 131 131 ALA CA C 131 55.027 55.098 -0.071 1
1 1470 . 16 1 1 A 131 131 ALA CB C 131 18.669 19.619 -0.950 1
1 1471 . 16 1 1 A 131 131 ALA N N 131 118.590 121.125 -2.535 1
1 1472 . 16 1 1 A 132 132 TRP H H 132 7.977 8.733 -0.756 1
1 1473 . 16 1 1 A 132 132 TRP HA H 132 4.001 4.248 -0.247 1
1 1480 . 16 1 1 A 132 132 TRP C C 132 177.332 175.820 1.512 1
1 1481 . 16 1 1 A 132 132 TRP CA C 132 60.431 57.409 3.022 1
1 1482 . 16 1 1 A 132 132 TRP CB C 132 27.786 27.567 0.219 1
1 1486 . 16 1 1 A 132 132 TRP N N 132 119.168 117.061 2.107 1
1 1488 . 16 1 1 A 133 133 ARG H H 133 8.006 8.100 -0.094 1
1 1489 . 16 1 1 A 133 133 ARG HA H 133 4.027 4.384 -0.357 1
1 1497 . 16 1 1 A 133 133 ARG C C 133 176.664 177.824 -1.160 1
1 1498 . 16 1 1 A 133 133 ARG CA C 133 59.355 57.301 2.054 1
1 1499 . 16 1 1 A 133 133 ARG CB C 133 30.451 32.355 -1.904 1
1 1502 . 16 1 1 A 133 133 ARG N N 133 113.062 120.668 -7.606 1
1 1504 . 16 1 1 A 134 134 LYS H H 134 7.322 7.562 -0.240 1
1 1505 . 16 1 1 A 134 134 LYS HA H 134 4.313 4.469 -0.156 1
1 1514 . 16 1 1 A 134 134 LYS C C 134 176.282 176.363 -0.081 1
1 1515 . 16 1 1 A 134 134 LYS CA C 134 54.922 56.532 -1.610 1
1 1516 . 16 1 1 A 134 134 LYS CB C 134 32.633 31.582 1.051 1
1 1520 . 16 1 1 A 134 134 LYS N N 134 118.170 118.198 -0.028 1
1 1521 . 16 1 1 A 135 135 LEU H H 135 7.440 7.673 -0.233 1
1 1522 . 16 1 1 A 135 135 LEU HA H 135 4.174 4.565 -0.391 1
1 1532 . 16 1 1 A 135 135 LEU CA C 135 54.408 53.154 1.254 1
1 1533 . 16 1 1 A 135 135 LEU CB C 135 40.407 41.011 -0.604 1
1 1537 . 16 1 1 A 135 135 LEU N N 135 123.358 121.360 1.998 1
1 1538 . 16 1 1 A 136 136 PRO HA H 136 4.437 4.424 0.013 1
1 1545 . 16 1 1 A 136 136 PRO C C 136 177.106 176.757 0.349 1
1 1546 . 16 1 1 A 136 136 PRO CA C 136 62.889 65.558 -2.669 1
1 1547 . 16 1 1 A 136 136 PRO CB C 136 32.192 31.519 0.673 1
1 1550 . 16 1 1 A 137 137 VAL H H 137 8.219 7.409 0.810 1
1 1551 . 16 1 1 A 137 137 VAL HA H 137 4.077 4.375 -0.298 1
1 1559 . 16 1 1 A 137 137 VAL C C 137 176.305 175.344 0.961 1
1 1560 . 16 1 1 A 137 137 VAL CA C 137 61.958 60.647 1.311 1
1 1561 . 16 1 1 A 137 137 VAL CB C 137 32.755 34.114 -1.359 1
1 1564 . 16 1 1 A 137 137 VAL N N 137 120.079 113.841 6.238 1
1 1565 . 16 1 1 A 138 138 LYS H H 138 8.444 8.346 0.098 1
1 1566 . 16 1 1 A 138 138 LYS HA H 138 4.316 4.239 0.077 1
1 1575 . 16 1 1 A 138 138 LYS C C 138 176.790 177.307 -0.517 1
1 1576 . 16 1 1 A 138 138 LYS CA C 138 56.792 58.482 -1.690 1
1 1577 . 16 1 1 A 138 138 LYS CB C 138 33.205 33.166 0.039 1
1 1581 . 16 1 1 A 138 138 LYS N N 138 126.449 126.482 -0.033 1
1 1582 . 16 1 1 A 139 139 GLY H H 139 8.518 7.385 1.133 1
1 1583 . 16 1 1 A 139 139 GLY HA2 H 139 4.070 4.115 -0.045 1
1 1584 . 16 1 1 A 139 139 GLY HA3 H 139 3.897 4.126 -0.229 1
1 1585 . 16 1 1 A 139 139 GLY C C 139 172.874 173.461 -0.587 1
1 1586 . 16 1 1 A 139 139 GLY CA C 139 45.157 45.658 -0.501 1
1 1587 . 16 1 1 A 139 139 GLY N N 139 112.617 106.683 5.934 1
1 6 . 17 1 1 A 2 2 VAL H H 2 8.992 9.216 -0.224 1
1 7 . 17 1 1 A 2 2 VAL HA H 2 5.370 4.865 0.505 1
1 15 . 17 1 1 A 2 2 VAL C C 2 174.325 174.624 -0.299 1
1 16 . 17 1 1 A 2 2 VAL CA C 2 61.267 60.604 0.663 1
1 17 . 17 1 1 A 2 2 VAL CB C 2 33.890 34.816 -0.926 1
1 20 . 17 1 1 A 2 2 VAL N N 2 126.939 119.490 7.449 1
1 21 . 17 1 1 A 3 3 THR H H 3 8.912 9.050 -0.138 1
1 22 . 17 1 1 A 3 3 THR HA H 3 4.505 5.232 -0.727 1
1 27 . 17 1 1 A 3 3 THR C C 3 172.710 173.014 -0.304 1
1 28 . 17 1 1 A 3 3 THR CA C 3 59.689 59.784 -0.095 1
1 29 . 17 1 1 A 3 3 THR CB C 3 72.398 71.773 0.625 1
1 31 . 17 1 1 A 3 3 THR N N 3 118.091 122.666 -4.575 1
1 32 . 17 1 1 A 4 4 GLU H H 4 8.631 8.939 -0.308 1
1 33 . 17 1 1 A 4 4 GLU HA H 4 5.788 4.940 0.848 1
1 38 . 17 1 1 A 4 4 GLU C C 4 175.758 174.147 1.611 1
1 39 . 17 1 1 A 4 4 GLU CA C 4 54.902 54.049 0.853 1
1 40 . 17 1 1 A 4 4 GLU CB C 4 35.097 33.206 1.891 1
1 42 . 17 1 1 A 4 4 GLU N N 4 120.966 125.051 -4.085 1
1 43 . 17 1 1 A 5 5 THR H H 5 9.188 8.360 0.828 1
1 44 . 17 1 1 A 5 5 THR HA H 5 4.739 4.672 0.067 1
1 49 . 17 1 1 A 5 5 THR C C 5 172.757 173.417 -0.660 1
1 50 . 17 1 1 A 5 5 THR CA C 5 60.382 60.749 -0.367 1
1 51 . 17 1 1 A 5 5 THR CB C 5 71.558 72.329 -0.771 1
1 53 . 17 1 1 A 5 5 THR N N 5 119.366 112.999 6.367 1
1 54 . 17 1 1 A 6 6 VAL H H 6 8.476 8.640 -0.164 1
1 55 . 17 1 1 A 6 6 VAL HA H 6 5.026 5.703 -0.677 1
1 63 . 17 1 1 A 6 6 VAL C C 6 176.674 175.036 1.638 1
1 64 . 17 1 1 A 6 6 VAL CA C 6 61.008 60.954 0.054 1
1 65 . 17 1 1 A 6 6 VAL CB C 6 33.861 34.808 -0.947 1
1 68 . 17 1 1 A 6 6 VAL N N 6 121.384 124.874 -3.490 1
1 69 . 17 1 1 A 7 7 ASP H H 7 8.848 8.653 0.195 1
1 70 . 17 1 1 A 7 7 ASP HA H 7 4.797 4.930 -0.133 1
1 73 . 17 1 1 A 7 7 ASP CA C 7 52.834 54.813 -1.979 1
1 74 . 17 1 1 A 7 7 ASP CB C 7 42.219 42.119 0.100 1
1 75 . 17 1 1 A 7 7 ASP N N 7 127.061 127.259 -0.198 1
1 76 . 17 1 1 A 8 8 GLY C C 8 175.143 175.185 -0.042 1
1 77 . 17 1 1 A 8 8 GLY CA C 8 46.553 46.821 -0.268 1
1 78 . 17 1 1 A 9 9 GLN H H 9 8.408 8.066 0.342 1
1 79 . 17 1 1 A 9 9 GLN HA H 9 4.541 4.209 0.332 1
1 86 . 17 1 1 A 9 9 GLN C C 9 176.463 176.783 -0.320 1
1 87 . 17 1 1 A 9 9 GLN CA C 9 55.167 55.322 -0.155 1
1 88 . 17 1 1 A 9 9 GLN CB C 9 29.376 27.858 1.518 1
1 90 . 17 1 1 A 9 9 GLN N N 9 118.300 117.138 1.162 1
1 92 . 17 1 1 A 10 10 GLY H H 10 8.162 8.907 -0.745 1
1 93 . 17 1 1 A 10 10 GLY HA2 H 10 4.174 3.947 0.227 1
1 94 . 17 1 1 A 10 10 GLY HA3 H 10 3.521 3.957 -0.436 1
1 95 . 17 1 1 A 10 10 GLY C C 10 174.092 173.681 0.411 1
1 96 . 17 1 1 A 10 10 GLY CA C 10 45.558 46.433 -0.875 1
1 97 . 17 1 1 A 10 10 GLY N N 10 108.747 110.248 -1.501 1
1 98 . 17 1 1 A 11 11 GLN H H 11 8.507 7.497 1.010 1
1 99 . 17 1 1 A 11 11 GLN HA H 11 4.202 4.992 -0.790 1
1 106 . 17 1 1 A 11 11 GLN C C 11 173.992 174.055 -0.063 1
1 107 . 17 1 1 A 11 11 GLN CA C 11 55.098 53.747 1.351 1
1 108 . 17 1 1 A 11 11 GLN CB C 11 29.097 32.182 -3.085 1
1 110 . 17 1 1 A 11 11 GLN N N 11 122.979 114.609 8.370 1
1 112 . 17 1 1 A 12 12 ALA H H 12 8.259 8.528 -0.269 1
1 113 . 17 1 1 A 12 12 ALA HA H 12 5.156 6.069 -0.913 1
1 117 . 17 1 1 A 12 12 ALA C C 12 177.284 176.283 1.001 1
1 118 . 17 1 1 A 12 12 ALA CA C 12 51.087 50.300 0.787 1
1 119 . 17 1 1 A 12 12 ALA CB C 12 20.500 22.034 -1.534 1
1 120 . 17 1 1 A 12 12 ALA N N 12 127.100 122.534 4.566 1
1 121 . 17 1 1 A 13 13 TRP H H 13 9.245 8.942 0.303 1
1 122 . 17 1 1 A 13 13 TRP HA H 13 4.717 5.442 -0.725 1
1 131 . 17 1 1 A 13 13 TRP C C 13 175.108 174.318 0.790 1
1 132 . 17 1 1 A 13 13 TRP CA C 13 55.966 55.754 0.212 1
1 133 . 17 1 1 A 13 13 TRP CB C 13 31.912 32.505 -0.593 1
1 139 . 17 1 1 A 13 13 TRP N N 13 123.088 118.998 4.090 1
1 141 . 17 1 1 A 14 14 ARG H H 14 8.575 8.741 -0.166 1
1 142 . 17 1 1 A 14 14 ARG HA H 14 5.335 4.505 0.830 1
1 150 . 17 1 1 A 14 14 ARG C C 14 175.191 174.438 0.753 1
1 151 . 17 1 1 A 14 14 ARG CA C 14 53.106 55.192 -2.086 1
1 152 . 17 1 1 A 14 14 ARG CB C 14 32.749 31.566 1.183 1
1 154 . 17 1 1 A 14 14 ARG N N 14 121.163 120.496 0.667 1
1 156 . 17 1 1 A 15 15 HIS H H 15 8.595 8.093 0.502 1
1 157 . 17 1 1 A 15 15 HIS HA H 15 4.790 4.956 -0.166 1
1 161 . 17 1 1 A 15 15 HIS C C 15 173.770 174.174 -0.404 1
1 162 . 17 1 1 A 15 15 HIS CA C 15 55.289 54.310 0.979 1
1 163 . 17 1 1 A 15 15 HIS CB C 15 33.208 33.587 -0.379 1
1 165 . 17 1 1 A 15 15 HIS N N 15 117.643 119.306 -1.663 1
1 166 . 17 1 1 A 16 16 HIS H H 16 8.993 8.575 0.418 1
1 167 . 17 1 1 A 16 16 HIS HA H 16 5.158 5.110 0.048 1
1 171 . 17 1 1 A 16 16 HIS C C 16 173.608 174.675 -1.067 1
1 172 . 17 1 1 A 16 16 HIS CA C 16 56.450 54.690 1.760 1
1 173 . 17 1 1 A 16 16 HIS CB C 16 34.171 31.742 2.429 1
1 175 . 17 1 1 A 16 16 HIS N N 16 123.520 118.186 5.334 1
1 176 . 17 1 1 A 17 17 ASN H H 17 7.829 9.350 -1.521 1
1 177 . 17 1 1 A 17 17 ASN HA H 17 4.713 5.323 -0.610 1
1 182 . 17 1 1 A 17 17 ASN C C 17 173.682 175.691 -2.009 1
1 183 . 17 1 1 A 17 17 ASN CA C 17 51.822 51.652 0.170 1
1 184 . 17 1 1 A 17 17 ASN CB C 17 43.176 41.285 1.891 1
1 185 . 17 1 1 A 17 17 ASN N N 17 122.213 120.680 1.533 1
1 187 . 17 1 1 A 18 18 GLY H H 18 8.423 8.443 -0.020 1
1 188 . 17 1 1 A 18 18 GLY HA2 H 18 3.931 3.616 0.315 1
1 189 . 17 1 1 A 18 18 GLY HA3 H 18 3.707 3.792 -0.085 1
1 190 . 17 1 1 A 18 18 GLY C C 18 173.985 173.583 0.402 1
1 191 . 17 1 1 A 18 18 GLY CA C 18 43.949 45.349 -1.400 1
1 192 . 17 1 1 A 18 18 GLY N N 18 106.991 109.796 -2.805 1
1 193 . 17 1 1 A 19 19 PHE H H 19 8.338 7.848 0.490 1
1 194 . 17 1 1 A 19 19 PHE HA H 19 4.068 5.251 -1.183 1
1 197 . 17 1 1 A 19 19 PHE C C 19 176.568 174.808 1.760 1
1 198 . 17 1 1 A 19 19 PHE CA C 19 59.338 56.390 2.948 1
1 199 . 17 1 1 A 19 19 PHE CB C 19 40.201 41.290 -1.089 1
1 200 . 17 1 1 A 19 19 PHE N N 19 116.857 118.863 -2.006 1
1 201 . 17 1 1 A 20 20 ASP H H 20 8.794 9.085 -0.291 1
1 202 . 17 1 1 A 20 20 ASP HA H 20 4.485 4.809 -0.324 1
1 205 . 17 1 1 A 20 20 ASP C C 20 177.379 177.221 0.158 1
1 206 . 17 1 1 A 20 20 ASP CA C 20 54.140 54.913 -0.773 1
1 207 . 17 1 1 A 20 20 ASP CB C 20 41.915 40.907 1.008 1
1 208 . 17 1 1 A 20 20 ASP N N 20 123.025 125.806 -2.781 1
1 209 . 17 1 1 A 21 21 PHE H H 21 8.862 9.121 -0.259 1
1 210 . 17 1 1 A 21 21 PHE HA H 21 4.087 4.110 -0.023 1
1 218 . 17 1 1 A 21 21 PHE C C 21 176.952 177.274 -0.322 1
1 219 . 17 1 1 A 21 21 PHE CA C 21 61.095 62.362 -1.267 1
1 220 . 17 1 1 A 21 21 PHE CB C 21 38.678 39.347 -0.669 1
1 226 . 17 1 1 A 21 21 PHE N N 21 127.163 125.579 1.584 1
1 227 . 17 1 1 A 22 22 ALA H H 22 8.561 8.473 0.088 1
1 228 . 17 1 1 A 22 22 ALA HA H 22 3.878 4.048 -0.170 1
1 232 . 17 1 1 A 22 22 ALA C C 22 180.710 179.817 0.893 1
1 233 . 17 1 1 A 22 22 ALA CA C 22 55.211 55.302 -0.091 1
1 234 . 17 1 1 A 22 22 ALA CB C 22 18.321 18.524 -0.203 1
1 235 . 17 1 1 A 22 22 ALA N N 22 120.293 121.251 -0.958 1
1 236 . 17 1 1 A 23 23 VAL H H 23 7.241 8.097 -0.856 1
1 237 . 17 1 1 A 23 23 VAL HA H 23 3.684 3.510 0.174 1
1 245 . 17 1 1 A 23 23 VAL C C 23 177.101 178.026 -0.925 1
1 246 . 17 1 1 A 23 23 VAL CA C 23 65.237 66.956 -1.719 1
1 247 . 17 1 1 A 23 23 VAL CB C 23 31.780 31.552 0.228 1
1 250 . 17 1 1 A 23 23 VAL N N 23 118.775 117.496 1.279 1
1 251 . 17 1 1 A 24 24 ILE H H 24 6.761 7.865 -1.104 1
1 252 . 17 1 1 A 24 24 ILE HA H 24 3.196 3.514 -0.318 1
1 262 . 17 1 1 A 24 24 ILE C C 24 177.287 177.923 -0.636 1
1 263 . 17 1 1 A 24 24 ILE CA C 24 63.404 65.667 -2.263 1
1 264 . 17 1 1 A 24 24 ILE CB C 24 36.294 37.788 -1.494 1
1 268 . 17 1 1 A 24 24 ILE N N 24 119.036 119.655 -0.619 1
1 269 . 17 1 1 A 25 25 LYS H H 25 8.032 8.275 -0.243 1
1 270 . 17 1 1 A 25 25 LYS HA H 25 3.809 3.614 0.195 1
1 279 . 17 1 1 A 25 25 LYS C C 25 179.450 178.955 0.495 1
1 280 . 17 1 1 A 25 25 LYS CA C 25 59.621 59.538 0.083 1
1 281 . 17 1 1 A 25 25 LYS CB C 25 32.259 32.084 0.175 1
1 285 . 17 1 1 A 25 25 LYS N N 25 118.368 120.537 -2.169 1
1 286 . 17 1 1 A 26 26 GLU H H 26 7.845 8.167 -0.322 1
1 287 . 17 1 1 A 26 26 GLU HA H 26 4.021 4.101 -0.080 1
1 292 . 17 1 1 A 26 26 GLU C C 26 179.191 179.321 -0.130 1
1 293 . 17 1 1 A 26 26 GLU CA C 26 59.530 58.848 0.682 1
1 294 . 17 1 1 A 26 26 GLU CB C 26 29.449 29.415 0.034 1
1 296 . 17 1 1 A 26 26 GLU N N 26 120.522 118.632 1.890 1
1 297 . 17 1 1 A 27 27 LEU H H 27 8.165 8.176 -0.011 1
1 298 . 17 1 1 A 27 27 LEU HA H 27 4.163 4.146 0.017 1
1 308 . 17 1 1 A 27 27 LEU C C 27 177.256 178.440 -1.184 1
1 309 . 17 1 1 A 27 27 LEU CA C 27 58.049 57.678 0.371 1
1 310 . 17 1 1 A 27 27 LEU CB C 27 41.365 41.645 -0.280 1
1 314 . 17 1 1 A 27 27 LEU N N 27 120.879 121.650 -0.771 1
1 315 . 17 1 1 A 28 28 LYS H H 28 8.902 8.210 0.692 1
1 316 . 17 1 1 A 28 28 LYS HA H 28 4.199 4.326 -0.127 1
1 317 . 17 1 1 A 28 28 LYS C C 28 179.707 179.124 0.583 1
1 318 . 17 1 1 A 28 28 LYS CA C 28 60.097 59.122 0.975 1
1 319 . 17 1 1 A 28 28 LYS CB C 28 33.420 31.844 1.576 1
1 320 . 17 1 1 A 28 28 LYS N N 28 120.050 119.625 0.425 1
1 321 . 17 1 1 A 29 29 THR H H 29 8.294 7.913 0.381 1
1 322 . 17 1 1 A 29 29 THR HA H 29 3.892 3.927 -0.035 1
1 327 . 17 1 1 A 29 29 THR C C 29 175.711 176.594 -0.883 1
1 328 . 17 1 1 A 29 29 THR CA C 29 66.846 66.715 0.131 1
1 329 . 17 1 1 A 29 29 THR CB C 29 68.794 68.665 0.129 1
1 331 . 17 1 1 A 29 29 THR N N 29 115.933 116.498 -0.565 1
1 332 . 17 1 1 A 30 30 ALA H H 30 8.244 8.650 -0.406 1
1 333 . 17 1 1 A 30 30 ALA HA H 30 4.241 4.274 -0.033 1
1 337 . 17 1 1 A 30 30 ALA C C 30 179.128 179.357 -0.229 1
1 338 . 17 1 1 A 30 30 ALA CA C 30 55.714 55.693 0.021 1
1 339 . 17 1 1 A 30 30 ALA CB C 30 18.955 18.206 0.749 1
1 340 . 17 1 1 A 30 30 ALA N N 30 124.617 123.237 1.380 1
1 341 . 17 1 1 A 31 31 ALA H H 31 8.968 8.565 0.403 1
1 342 . 17 1 1 A 31 31 ALA HA H 31 3.890 4.058 -0.168 1
1 346 . 17 1 1 A 31 31 ALA C C 31 180.352 180.072 0.280 1
1 347 . 17 1 1 A 31 31 ALA CA C 31 55.454 55.464 -0.010 1
1 348 . 17 1 1 A 31 31 ALA CB C 31 17.124 18.434 -1.310 1
1 349 . 17 1 1 A 31 31 ALA N N 31 119.327 120.073 -0.746 1
1 350 . 17 1 1 A 32 32 SER H H 32 7.995 7.840 0.155 1
1 351 . 17 1 1 A 32 32 SER HA H 32 4.238 4.380 -0.142 1
1 354 . 17 1 1 A 32 32 SER C C 32 175.612 175.429 0.183 1
1 355 . 17 1 1 A 32 32 SER CA C 32 61.203 61.038 0.165 1
1 356 . 17 1 1 A 32 32 SER CB C 32 63.406 63.411 -0.005 1
1 357 . 17 1 1 A 32 32 SER N N 32 111.962 113.782 -1.820 1
1 358 . 17 1 1 A 33 33 GLN H H 33 8.333 7.824 0.509 1
1 359 . 17 1 1 A 33 33 GLN HA H 33 3.992 4.324 -0.332 1
1 366 . 17 1 1 A 33 33 GLN C C 33 177.486 177.194 0.292 1
1 367 . 17 1 1 A 33 33 GLN CA C 33 58.277 57.860 0.417 1
1 368 . 17 1 1 A 33 33 GLN CB C 33 29.140 30.012 -0.872 1
1 370 . 17 1 1 A 33 33 GLN N N 33 119.527 119.293 0.234 1
1 372 . 17 1 1 A 34 34 TYR H H 34 8.587 8.323 0.264 1
1 373 . 17 1 1 A 34 34 TYR HA H 34 4.792 4.570 0.222 1
1 380 . 17 1 1 A 34 34 TYR C C 34 176.499 176.754 -0.255 1
1 381 . 17 1 1 A 34 34 TYR CA C 34 57.711 59.125 -1.414 1
1 382 . 17 1 1 A 34 34 TYR CB C 34 39.561 39.114 0.447 1
1 387 . 17 1 1 A 34 34 TYR N N 34 114.610 114.980 -0.370 1
1 388 . 17 1 1 A 35 35 GLY H H 35 7.346 8.146 -0.800 1
1 389 . 17 1 1 A 35 35 GLY HA2 H 35 4.785 4.099 0.686 1
1 390 . 17 1 1 A 35 35 GLY HA3 H 35 4.007 4.105 -0.098 1
1 391 . 17 1 1 A 35 35 GLY C C 35 175.796 173.388 2.408 1
1 392 . 17 1 1 A 35 35 GLY CA C 35 44.355 44.793 -0.438 1
1 393 . 17 1 1 A 35 35 GLY N N 35 108.501 106.433 2.068 1
1 394 . 17 1 1 A 36 36 ALA H H 36 9.363 8.285 1.078 1
1 395 . 17 1 1 A 36 36 ALA HA H 36 4.217 4.561 -0.344 1
1 399 . 17 1 1 A 36 36 ALA C C 36 178.039 177.742 0.297 1
1 400 . 17 1 1 A 36 36 ALA CA C 36 56.114 51.994 4.120 1
1 401 . 17 1 1 A 36 36 ALA CB C 36 19.179 19.489 -0.310 1
1 402 . 17 1 1 A 36 36 ALA N N 36 125.811 123.251 2.560 1
1 403 . 17 1 1 A 37 37 THR H H 37 8.070 8.844 -0.774 1
1 404 . 17 1 1 A 37 37 THR HA H 37 4.570 4.546 0.024 1
1 409 . 17 1 1 A 37 37 THR C C 37 173.685 174.209 -0.524 1
1 410 . 17 1 1 A 37 37 THR CA C 37 59.822 62.880 -3.058 1
1 411 . 17 1 1 A 37 37 THR CB C 37 68.267 71.563 -3.296 1
1 413 . 17 1 1 A 37 37 THR N N 37 129.410 118.869 10.541 1
1 414 . 17 1 1 A 38 38 ALA H H 38 6.853 7.475 -0.622 1
1 415 . 17 1 1 A 38 38 ALA HA H 38 4.601 4.552 0.049 1
1 419 . 17 1 1 A 38 38 ALA CA C 38 50.758 50.758 0.000 1
1 420 . 17 1 1 A 38 38 ALA CB C 38 18.325 19.442 -1.117 1
1 421 . 17 1 1 A 38 38 ALA N N 38 124.674 123.478 1.196 1
1 422 . 17 1 1 A 40 40 TYR HA H 40 4.032 4.039 -0.007 1
1 429 . 17 1 1 A 40 40 TYR C C 40 176.456 177.245 -0.789 1
1 430 . 17 1 1 A 40 40 TYR CA C 40 61.010 61.720 -0.710 1
1 431 . 17 1 1 A 40 40 TYR CB C 40 39.286 38.652 0.634 1
1 436 . 17 1 1 A 41 41 THR H H 41 6.874 8.310 -1.436 1
1 437 . 17 1 1 A 41 41 THR HA H 41 3.616 3.786 -0.170 1
1 442 . 17 1 1 A 41 41 THR C C 41 176.930 176.567 0.363 1
1 443 . 17 1 1 A 41 41 THR CA C 41 65.557 65.456 0.101 1
1 444 . 17 1 1 A 41 41 THR CB C 41 68.228 69.155 -0.927 1
1 446 . 17 1 1 A 41 41 THR N N 41 115.143 113.997 1.146 1
1 447 . 17 1 1 A 42 42 LEU H H 42 8.623 7.405 1.218 1
1 448 . 17 1 1 A 42 42 LEU HA H 42 3.708 4.023 -0.315 1
1 458 . 17 1 1 A 42 42 LEU C C 42 178.206 178.900 -0.694 1
1 459 . 17 1 1 A 42 42 LEU CA C 42 57.417 57.819 -0.402 1
1 460 . 17 1 1 A 42 42 LEU CB C 42 41.342 41.222 0.120 1
1 464 . 17 1 1 A 42 42 LEU N N 42 120.418 118.592 1.826 1
1 465 . 17 1 1 A 43 43 ALA H H 43 7.735 7.624 0.111 1
1 466 . 17 1 1 A 43 43 ALA HA H 43 4.020 3.979 0.041 1
1 470 . 17 1 1 A 43 43 ALA C C 43 180.826 180.505 0.321 1
1 471 . 17 1 1 A 43 43 ALA CA C 43 54.925 54.957 -0.032 1
1 472 . 17 1 1 A 43 43 ALA CB C 43 17.506 18.307 -0.801 1
1 473 . 17 1 1 A 43 43 ALA N N 43 120.203 121.714 -1.511 1
1 474 . 17 1 1 A 44 44 ILE H H 44 7.149 7.335 -0.186 1
1 475 . 17 1 1 A 44 44 ILE HA H 44 3.603 3.578 0.025 1
1 485 . 17 1 1 A 44 44 ILE C C 44 178.594 178.244 0.350 1
1 486 . 17 1 1 A 44 44 ILE CA C 44 64.782 64.482 0.300 1
1 487 . 17 1 1 A 44 44 ILE CB C 44 37.472 37.718 -0.246 1
1 491 . 17 1 1 A 44 44 ILE N N 44 118.881 119.423 -0.542 1
1 492 . 17 1 1 A 45 45 VAL H H 45 7.968 7.790 0.178 1
1 493 . 17 1 1 A 45 45 VAL HA H 45 2.925 3.397 -0.472 1
1 501 . 17 1 1 A 45 45 VAL C C 45 177.023 177.297 -0.274 1
1 502 . 17 1 1 A 45 45 VAL CA C 45 67.081 66.693 0.388 1
1 503 . 17 1 1 A 45 45 VAL CB C 45 30.854 31.092 -0.238 1
1 506 . 17 1 1 A 45 45 VAL N N 45 120.764 119.450 1.314 1
1 507 . 17 1 1 A 46 46 GLU H H 46 8.399 7.963 0.436 1
1 508 . 17 1 1 A 46 46 GLU HA H 46 3.848 3.861 -0.013 1
1 513 . 17 1 1 A 46 46 GLU C C 46 178.656 179.005 -0.349 1
1 514 . 17 1 1 A 46 46 GLU CA C 46 59.491 59.423 0.068 1
1 515 . 17 1 1 A 46 46 GLU CB C 46 28.991 28.997 -0.006 1
1 517 . 17 1 1 A 46 46 GLU N N 46 116.599 119.984 -3.385 1
1 518 . 17 1 1 A 47 47 SER H H 47 7.273 7.999 -0.726 1
1 519 . 17 1 1 A 47 47 SER HA H 47 4.287 4.146 0.141 1
1 521 . 17 1 1 A 47 47 SER CA C 47 61.047 62.224 -1.177 1
1 522 . 17 1 1 A 47 47 SER CB C 47 63.016 63.022 -0.006 1
1 523 . 17 1 1 A 47 47 SER N N 47 113.609 117.550 -3.941 1
1 524 . 17 1 1 A 48 48 VAL H H 48 8.006 8.084 -0.078 1
1 525 . 17 1 1 A 48 48 VAL HA H 48 3.556 3.564 -0.008 1
1 533 . 17 1 1 A 48 48 VAL C C 48 177.257 176.605 0.652 1
1 534 . 17 1 1 A 48 48 VAL CA C 48 65.025 66.157 -1.132 1
1 535 . 17 1 1 A 48 48 VAL CB C 48 31.841 31.469 0.372 1
1 538 . 17 1 1 A 48 48 VAL N N 48 122.327 121.586 0.741 1
1 539 . 17 1 1 A 49 49 ALA H H 49 8.369 7.567 0.802 1
1 540 . 17 1 1 A 49 49 ALA HA H 49 4.115 4.164 -0.049 1
1 544 . 17 1 1 A 49 49 ALA C C 49 177.307 177.336 -0.029 1
1 545 . 17 1 1 A 49 49 ALA CA C 49 53.253 52.563 0.690 1
1 546 . 17 1 1 A 49 49 ALA CB C 49 20.131 18.980 1.151 1
1 547 . 17 1 1 A 49 49 ALA N N 49 118.050 120.520 -2.470 1
1 548 . 17 1 1 A 50 50 ASP H H 50 7.052 7.788 -0.736 1
1 549 . 17 1 1 A 50 50 ASP HA H 50 4.788 4.642 0.146 1
1 552 . 17 1 1 A 50 50 ASP C C 50 175.481 175.731 -0.250 1
1 553 . 17 1 1 A 50 50 ASP CA C 50 53.681 53.694 -0.013 1
1 554 . 17 1 1 A 50 50 ASP CB C 50 39.333 41.318 -1.985 1
1 555 . 17 1 1 A 50 50 ASP N N 50 116.997 116.532 0.465 1
1 556 . 17 1 1 A 51 51 ASN H H 51 8.535 7.711 0.824 1
1 557 . 17 1 1 A 51 51 ASN HA H 51 4.628 4.732 -0.104 1
1 562 . 17 1 1 A 51 51 ASN C C 51 174.077 174.395 -0.318 1
1 563 . 17 1 1 A 51 51 ASN CA C 51 52.315 50.983 1.332 1
1 564 . 17 1 1 A 51 51 ASN CB C 51 41.928 40.920 1.008 1
1 565 . 17 1 1 A 51 51 ASN N N 51 118.626 115.388 3.238 1
1 567 . 17 1 1 A 52 52 TRP H H 52 8.555 8.483 0.072 1
1 574 . 17 1 1 A 52 52 TRP C C 52 173.269 176.502 -3.233 1
1 575 . 17 1 1 A 52 52 TRP CA C 52 55.031 56.671 -1.640 1
1 576 . 17 1 1 A 52 52 TRP CB C 52 26.801 30.530 -3.729 1
1 582 . 17 1 1 A 52 52 TRP N N 52 120.693 121.063 -0.370 1
1 584 . 17 1 1 A 53 53 LEU H H 53 7.847 9.089 -1.242 1
1 585 . 17 1 1 A 53 53 LEU HA H 53 4.859 4.969 -0.110 1
1 595 . 17 1 1 A 53 53 LEU C C 53 177.397 175.194 2.203 1
1 596 . 17 1 1 A 53 53 LEU CA C 53 53.619 53.694 -0.075 1
1 597 . 17 1 1 A 53 53 LEU CB C 53 41.812 45.455 -3.643 1
1 601 . 17 1 1 A 53 53 LEU N N 53 124.741 120.191 4.550 1
1 602 . 17 1 1 A 54 54 THR H H 54 8.850 8.520 0.330 1
1 603 . 17 1 1 A 54 54 THR HA H 54 4.598 4.684 -0.086 1
1 608 . 17 1 1 A 54 54 THR CA C 54 60.531 58.704 1.827 1
1 609 . 17 1 1 A 54 54 THR CB C 54 67.183 70.333 -3.150 1
1 611 . 17 1 1 A 54 54 THR N N 54 113.407 109.946 3.461 1
1 612 . 17 1 1 A 55 55 PRO HA H 55 4.511 4.377 0.134 1
1 619 . 17 1 1 A 55 55 PRO C C 55 179.383 178.939 0.444 1
1 620 . 17 1 1 A 55 55 PRO CA C 55 67.159 64.948 2.211 1
1 621 . 17 1 1 A 55 55 PRO CB C 55 32.095 31.673 0.422 1
1 622 . 17 1 1 A 56 56 THR H H 56 8.575 7.768 0.807 1
1 623 . 17 1 1 A 56 56 THR HA H 56 4.229 4.103 0.126 1
1 628 . 17 1 1 A 56 56 THR C C 56 176.668 176.224 0.444 1
1 629 . 17 1 1 A 56 56 THR CA C 56 66.943 65.891 1.052 1
1 630 . 17 1 1 A 56 56 THR CB C 56 68.129 68.270 -0.141 1
1 632 . 17 1 1 A 56 56 THR N N 56 114.855 112.165 2.690 1
1 633 . 17 1 1 A 57 57 ASP H H 57 8.730 7.949 0.781 1
1 634 . 17 1 1 A 57 57 ASP HA H 57 4.425 4.728 -0.303 1
1 637 . 17 1 1 A 57 57 ASP C C 57 178.351 179.368 -1.017 1
1 638 . 17 1 1 A 57 57 ASP CA C 57 57.963 57.618 0.345 1
1 639 . 17 1 1 A 57 57 ASP CB C 57 40.134 40.768 -0.634 1
1 640 . 17 1 1 A 57 57 ASP N N 57 126.239 120.392 5.847 1
1 641 . 17 1 1 A 58 58 TRP H H 58 8.244 8.393 -0.149 1
1 642 . 17 1 1 A 58 58 TRP HA H 58 4.030 4.522 -0.492 1
1 650 . 17 1 1 A 58 58 TRP C C 58 177.432 179.312 -1.880 1
1 651 . 17 1 1 A 58 58 TRP CA C 58 62.731 60.187 2.544 1
1 652 . 17 1 1 A 58 58 TRP CB C 58 29.122 29.385 -0.263 1
1 657 . 17 1 1 A 58 58 TRP N N 58 119.241 120.495 -1.254 1
1 659 . 17 1 1 A 59 59 ASN H H 59 8.098 8.857 -0.759 1
1 660 . 17 1 1 A 59 59 ASN HA H 59 4.424 4.376 0.048 1
1 663 . 17 1 1 A 59 59 ASN C C 59 176.952 178.086 -1.134 1
1 664 . 17 1 1 A 59 59 ASN CA C 59 58.135 56.348 1.787 1
1 665 . 17 1 1 A 59 59 ASN CB C 59 40.168 38.197 1.971 1
1 666 . 17 1 1 A 59 59 ASN N N 59 115.747 118.104 -2.357 1
1 667 . 17 1 1 A 60 60 THR H H 60 8.712 7.921 0.791 1
1 668 . 17 1 1 A 60 60 THR HA H 60 3.717 4.007 -0.290 1
1 673 . 17 1 1 A 60 60 THR C C 60 176.044 177.063 -1.019 1
1 674 . 17 1 1 A 60 60 THR CA C 60 66.576 66.179 0.397 1
1 675 . 17 1 1 A 60 60 THR CB C 60 69.251 68.176 1.075 1
1 677 . 17 1 1 A 60 60 THR N N 60 114.896 118.345 -3.449 1
1 678 . 17 1 1 A 61 61 LEU H H 61 8.485 8.400 0.085 1
1 679 . 17 1 1 A 61 61 LEU HA H 61 3.391 3.999 -0.608 1
1 689 . 17 1 1 A 61 61 LEU C C 61 177.433 179.314 -1.881 1
1 690 . 17 1 1 A 61 61 LEU CA C 61 58.354 58.459 -0.105 1
1 691 . 17 1 1 A 61 61 LEU CB C 61 41.761 42.368 -0.607 1
1 695 . 17 1 1 A 61 61 LEU N N 61 123.433 122.312 1.121 1
1 696 . 17 1 1 A 62 62 VAL H H 62 8.073 7.903 0.170 1
1 697 . 17 1 1 A 62 62 VAL HA H 62 3.207 3.324 -0.117 1
1 705 . 17 1 1 A 62 62 VAL C C 62 177.585 177.584 0.001 1
1 706 . 17 1 1 A 62 62 VAL CA C 62 67.345 66.549 0.796 1
1 707 . 17 1 1 A 62 62 VAL CB C 62 30.905 31.155 -0.250 1
1 710 . 17 1 1 A 62 62 VAL N N 62 116.018 117.628 -1.610 1
1 711 . 17 1 1 A 63 63 ARG H H 63 7.765 8.019 -0.254 1
1 712 . 17 1 1 A 63 63 ARG HA H 63 3.602 3.883 -0.281 1
1 719 . 17 1 1 A 63 63 ARG C C 63 177.818 178.467 -0.649 1
1 720 . 17 1 1 A 63 63 ARG CA C 63 58.049 59.561 -1.512 1
1 721 . 17 1 1 A 63 63 ARG CB C 63 29.955 29.998 -0.043 1
1 724 . 17 1 1 A 63 63 ARG N N 63 116.700 120.187 -3.487 1
1 725 . 17 1 1 A 64 64 ALA H H 64 7.574 7.719 -0.145 1
1 726 . 17 1 1 A 64 64 ALA HA H 64 4.158 4.284 -0.126 1
1 730 . 17 1 1 A 64 64 ALA C C 64 179.886 179.362 0.524 1
1 731 . 17 1 1 A 64 64 ALA CA C 64 54.007 54.070 -0.063 1
1 732 . 17 1 1 A 64 64 ALA CB C 64 19.147 19.709 -0.562 1
1 733 . 17 1 1 A 64 64 ALA N N 64 117.555 120.320 -2.765 1
1 734 . 17 1 1 A 65 65 VAL H H 65 7.554 7.854 -0.300 1
1 735 . 17 1 1 A 65 65 VAL HA H 65 4.253 3.826 0.427 1
1 743 . 17 1 1 A 65 65 VAL C C 65 174.180 176.035 -1.855 1
1 744 . 17 1 1 A 65 65 VAL CA C 65 62.683 65.366 -2.683 1
1 745 . 17 1 1 A 65 65 VAL CB C 65 33.458 31.288 2.170 1
1 748 . 17 1 1 A 65 65 VAL N N 65 110.013 115.472 -5.459 1
1 749 . 17 1 1 A 66 66 LEU H H 66 7.792 6.991 0.801 1
1 750 . 17 1 1 A 66 66 LEU HA H 66 4.790 4.849 -0.059 1
1 760 . 17 1 1 A 66 66 LEU C C 66 177.537 175.432 2.105 1
1 761 . 17 1 1 A 66 66 LEU CA C 66 52.823 52.806 0.017 1
1 762 . 17 1 1 A 66 66 LEU CB C 66 44.071 45.915 -1.844 1
1 766 . 17 1 1 A 66 66 LEU N N 66 118.967 120.436 -1.469 1
1 767 . 17 1 1 A 67 67 SER H H 67 9.208 8.370 0.838 1
1 768 . 17 1 1 A 67 67 SER HA H 67 4.414 4.939 -0.525 1
1 771 . 17 1 1 A 67 67 SER CA C 67 57.943 57.644 0.299 1
1 772 . 17 1 1 A 67 67 SER CB C 67 64.743 66.142 -1.399 1
1 773 . 17 1 1 A 67 67 SER N N 67 116.378 116.063 0.315 1
1 774 . 17 1 1 A 69 69 GLY HA2 H 69 3.916 3.776 0.140 1
1 775 . 17 1 1 A 69 69 GLY HA3 H 69 3.867 3.795 0.072 1
1 776 . 17 1 1 A 69 69 GLY C C 69 176.783 175.536 1.247 1
1 777 . 17 1 1 A 69 69 GLY CA C 69 46.977 46.724 0.253 1
1 778 . 17 1 1 A 70 70 ASP H H 70 7.674 8.165 -0.491 1
1 779 . 17 1 1 A 70 70 ASP HA H 70 4.511 3.799 0.712 1
1 782 . 17 1 1 A 70 70 ASP C C 70 178.096 178.371 -0.275 1
1 783 . 17 1 1 A 70 70 ASP CA C 70 57.262 56.540 0.722 1
1 784 . 17 1 1 A 70 70 ASP CB C 70 40.594 39.703 0.891 1
1 785 . 17 1 1 A 70 70 ASP N N 70 123.930 121.868 2.062 1
1 786 . 17 1 1 A 71 71 HIS H H 71 8.729 7.832 0.897 1
1 787 . 17 1 1 A 71 71 HIS HA H 71 4.235 4.157 0.078 1
1 790 . 17 1 1 A 71 71 HIS C C 71 176.769 176.639 0.130 1
1 791 . 17 1 1 A 71 71 HIS CA C 71 60.041 59.988 0.053 1
1 792 . 17 1 1 A 71 71 HIS CB C 71 30.682 30.130 0.552 1
1 793 . 17 1 1 A 71 71 HIS N N 71 121.003 119.549 1.454 1
1 794 . 17 1 1 A 72 72 LEU H H 72 7.620 7.995 -0.375 1
1 795 . 17 1 1 A 72 72 LEU HA H 72 3.769 3.963 -0.194 1
1 805 . 17 1 1 A 72 72 LEU C C 72 180.275 179.176 1.099 1
1 806 . 17 1 1 A 72 72 LEU CA C 72 58.192 58.041 0.151 1
1 807 . 17 1 1 A 72 72 LEU CB C 72 41.381 41.244 0.137 1
1 811 . 17 1 1 A 72 72 LEU N N 72 118.569 118.553 0.016 1
1 812 . 17 1 1 A 73 73 LEU H H 73 7.542 7.599 -0.057 1
1 813 . 17 1 1 A 73 73 LEU HA H 73 4.107 4.278 -0.171 1
1 823 . 17 1 1 A 73 73 LEU C C 73 179.436 179.192 0.244 1
1 824 . 17 1 1 A 73 73 LEU CA C 73 58.026 57.210 0.816 1
1 825 . 17 1 1 A 73 73 LEU CB C 73 41.638 42.192 -0.554 1
1 829 . 17 1 1 A 73 73 LEU N N 73 121.418 120.383 1.035 1
1 830 . 17 1 1 A 74 74 TRP H H 74 8.786 7.928 0.858 1
1 831 . 17 1 1 A 74 74 TRP HA H 74 3.589 5.197 -1.608 1
1 840 . 17 1 1 A 74 74 TRP C C 74 176.816 178.706 -1.890 1
1 841 . 17 1 1 A 74 74 TRP CA C 74 63.046 59.828 3.218 1
1 842 . 17 1 1 A 74 74 TRP CB C 74 28.065 28.875 -0.810 1
1 848 . 17 1 1 A 74 74 TRP N N 74 121.111 118.159 2.952 1
1 850 . 17 1 1 A 75 75 LYS H H 75 8.939 7.574 1.365 1
1 851 . 17 1 1 A 75 75 LYS HA H 75 3.055 4.202 -1.147 1
1 860 . 17 1 1 A 75 75 LYS C C 75 177.967 179.393 -1.426 1
1 861 . 17 1 1 A 75 75 LYS CA C 75 60.029 58.703 1.326 1
1 862 . 17 1 1 A 75 75 LYS CB C 75 32.533 32.885 -0.352 1
1 866 . 17 1 1 A 75 75 LYS N N 75 119.783 118.571 1.212 1
1 867 . 17 1 1 A 76 76 SER H H 76 7.832 7.824 0.008 1
1 868 . 17 1 1 A 76 76 SER HA H 76 4.040 4.338 -0.298 1
1 871 . 17 1 1 A 76 76 SER C C 76 177.816 176.903 0.913 1
1 872 . 17 1 1 A 76 76 SER CA C 76 62.105 61.491 0.614 1
1 873 . 17 1 1 A 76 76 SER CB C 76 62.679 63.015 -0.336 1
1 874 . 17 1 1 A 76 76 SER N N 76 113.395 115.119 -1.724 1
1 875 . 17 1 1 A 77 77 GLU H H 77 7.590 7.669 -0.079 1
1 876 . 17 1 1 A 77 77 GLU HA H 77 4.042 4.338 -0.296 1
1 881 . 17 1 1 A 77 77 GLU C C 77 177.809 178.716 -0.907 1
1 882 . 17 1 1 A 77 77 GLU CA C 77 58.270 58.168 0.102 1
1 883 . 17 1 1 A 77 77 GLU CB C 77 29.208 29.567 -0.359 1
1 885 . 17 1 1 A 77 77 GLU N N 77 121.574 122.079 -0.505 1
1 886 . 17 1 1 A 78 78 PHE H H 78 9.081 7.841 1.240 1
1 887 . 17 1 1 A 78 78 PHE HA H 78 3.778 4.143 -0.365 1
1 895 . 17 1 1 A 78 78 PHE C C 78 178.114 177.312 0.802 1
1 896 . 17 1 1 A 78 78 PHE CA C 78 60.629 61.358 -0.729 1
1 897 . 17 1 1 A 78 78 PHE CB C 78 38.295 38.893 -0.598 1
1 902 . 17 1 1 A 78 78 PHE N N 78 122.682 122.758 -0.076 1
1 903 . 17 1 1 A 79 79 PHE H H 79 8.890 8.011 0.879 1
1 904 . 17 1 1 A 79 79 PHE HA H 79 3.800 4.041 -0.241 1
1 912 . 17 1 1 A 79 79 PHE C C 79 178.354 178.268 0.086 1
1 913 . 17 1 1 A 79 79 PHE CA C 79 60.704 61.710 -1.006 1
1 914 . 17 1 1 A 79 79 PHE CB C 79 37.184 38.271 -1.087 1
1 920 . 17 1 1 A 79 79 PHE N N 79 121.056 117.450 3.606 1
1 921 . 17 1 1 A 80 80 GLU H H 80 7.793 8.232 -0.439 1
1 922 . 17 1 1 A 80 80 GLU HA H 80 4.082 3.975 0.107 1
1 927 . 17 1 1 A 80 80 GLU C C 80 179.068 179.561 -0.493 1
1 928 . 17 1 1 A 80 80 GLU CA C 80 59.735 59.433 0.302 1
1 929 . 17 1 1 A 80 80 GLU CB C 80 28.722 29.246 -0.524 1
1 931 . 17 1 1 A 80 80 GLU N N 80 120.312 118.689 1.623 1
1 932 . 17 1 1 A 81 81 ASN H H 81 8.624 8.546 0.078 1
1 933 . 17 1 1 A 81 81 ASN HA H 81 4.521 4.495 0.026 1
1 938 . 17 1 1 A 81 81 ASN C C 81 179.262 178.183 1.079 1
1 939 . 17 1 1 A 81 81 ASN CA C 81 55.504 56.401 -0.897 1
1 940 . 17 1 1 A 81 81 ASN CB C 81 37.517 37.728 -0.211 1
1 941 . 17 1 1 A 81 81 ASN N N 81 119.338 118.427 0.911 1
1 943 . 17 1 1 A 82 82 CYS H H 82 8.554 7.793 0.761 1
1 944 . 17 1 1 A 82 82 CYS HA H 82 3.792 3.935 -0.143 1
1 947 . 17 1 1 A 82 82 CYS C C 82 176.478 176.870 -0.392 1
1 948 . 17 1 1 A 82 82 CYS CA C 82 65.232 63.104 2.128 1
1 949 . 17 1 1 A 82 82 CYS CB C 82 26.762 26.799 -0.037 1
1 950 . 17 1 1 A 82 82 CYS N N 82 120.576 118.177 2.399 1
1 951 . 17 1 1 A 83 83 ARG H H 83 8.522 7.850 0.672 1
1 952 . 17 1 1 A 83 83 ARG HA H 83 3.932 4.092 -0.160 1
1 960 . 17 1 1 A 83 83 ARG C C 83 179.138 178.683 0.455 1
1 961 . 17 1 1 A 83 83 ARG CA C 83 60.443 59.063 1.380 1
1 962 . 17 1 1 A 83 83 ARG CB C 83 29.550 29.971 -0.421 1
1 965 . 17 1 1 A 83 83 ARG N N 83 123.035 119.656 3.379 1
1 967 . 17 1 1 A 84 84 ASP H H 84 7.791 8.256 -0.465 1
1 968 . 17 1 1 A 84 84 ASP HA H 84 4.353 4.408 -0.055 1
1 971 . 17 1 1 A 84 84 ASP C C 84 178.649 178.628 0.021 1
1 972 . 17 1 1 A 84 84 ASP CA C 84 57.767 57.628 0.139 1
1 973 . 17 1 1 A 84 84 ASP CB C 84 41.305 41.735 -0.430 1
1 974 . 17 1 1 A 84 84 ASP N N 84 120.332 119.610 0.722 1
1 975 . 17 1 1 A 85 85 THR H H 85 8.370 7.936 0.434 1
1 976 . 17 1 1 A 85 85 THR HA H 85 3.730 3.865 -0.135 1
1 981 . 17 1 1 A 85 85 THR C C 85 175.198 176.557 -1.359 1
1 982 . 17 1 1 A 85 85 THR CA C 85 66.830 65.680 1.150 1
1 983 . 17 1 1 A 85 85 THR CB C 85 68.533 68.362 0.171 1
1 985 . 17 1 1 A 85 85 THR N N 85 117.360 115.598 1.762 1
1 986 . 17 1 1 A 86 86 ALA H H 86 8.845 8.328 0.517 1
1 987 . 17 1 1 A 86 86 ALA HA H 86 3.991 4.046 -0.055 1
1 991 . 17 1 1 A 86 86 ALA C C 86 179.980 179.942 0.038 1
1 992 . 17 1 1 A 86 86 ALA CA C 86 55.769 55.647 0.122 1
1 993 . 17 1 1 A 86 86 ALA CB C 86 17.881 18.706 -0.825 1
1 994 . 17 1 1 A 86 86 ALA N N 86 123.613 123.026 0.587 1
1 995 . 17 1 1 A 87 87 LYS H H 87 7.686 8.555 -0.869 1
1 996 . 17 1 1 A 87 87 LYS HA H 87 4.099 4.038 0.061 1
1 1005 . 17 1 1 A 87 87 LYS C C 87 179.592 179.536 0.056 1
1 1006 . 17 1 1 A 87 87 LYS CA C 87 59.708 59.814 -0.106 1
1 1007 . 17 1 1 A 87 87 LYS CB C 87 32.054 32.235 -0.181 1
1 1011 . 17 1 1 A 87 87 LYS N N 87 119.623 117.357 2.266 1
1 1012 . 17 1 1 A 88 88 ARG H H 88 7.683 7.567 0.116 1
1 1013 . 17 1 1 A 88 88 ARG HA H 88 4.051 4.158 -0.107 1
1 1020 . 17 1 1 A 88 88 ARG C C 88 180.053 178.276 1.777 1
1 1021 . 17 1 1 A 88 88 ARG CA C 88 59.558 58.890 0.668 1
1 1022 . 17 1 1 A 88 88 ARG CB C 88 29.684 29.713 -0.029 1
1 1025 . 17 1 1 A 88 88 ARG N N 88 120.788 119.121 1.667 1
1 1026 . 17 1 1 A 89 89 ASN H H 89 8.973 7.848 1.125 1
1 1027 . 17 1 1 A 89 89 ASN HA H 89 4.354 4.566 -0.212 1
1 1032 . 17 1 1 A 89 89 ASN C C 89 178.382 177.838 0.544 1
1 1033 . 17 1 1 A 89 89 ASN CA C 89 55.334 55.885 -0.551 1
1 1034 . 17 1 1 A 89 89 ASN CB C 89 37.864 38.447 -0.583 1
1 1035 . 17 1 1 A 89 89 ASN N N 89 121.012 117.984 3.028 1
1 1037 . 17 1 1 A 90 90 GLN H H 90 8.152 8.462 -0.310 1
1 1038 . 17 1 1 A 90 90 GLN HA H 90 4.020 4.115 -0.095 1
1 1045 . 17 1 1 A 90 90 GLN C C 90 179.075 179.087 -0.012 1
1 1046 . 17 1 1 A 90 90 GLN CA C 90 59.318 58.967 0.351 1
1 1047 . 17 1 1 A 90 90 GLN CB C 90 28.049 28.152 -0.103 1
1 1049 . 17 1 1 A 90 90 GLN N N 90 122.122 118.972 3.150 1
1 1051 . 17 1 1 A 91 91 GLN H H 91 7.514 8.606 -1.092 1
1 1052 . 17 1 1 A 91 91 GLN HA H 91 4.053 4.058 -0.005 1
1 1059 . 17 1 1 A 91 91 GLN C C 91 177.081 177.948 -0.867 1
1 1060 . 17 1 1 A 91 91 GLN CA C 91 58.031 58.572 -0.541 1
1 1061 . 17 1 1 A 91 91 GLN CB C 91 28.365 27.721 0.644 1
1 1063 . 17 1 1 A 91 91 GLN N N 91 118.124 117.991 0.133 1
1 1065 . 17 1 1 A 92 92 ALA H H 92 7.704 7.127 0.577 1
1 1066 . 17 1 1 A 92 92 ALA HA H 92 4.246 4.265 -0.019 1
1 1070 . 17 1 1 A 92 92 ALA C C 92 178.450 178.133 0.317 1
1 1071 . 17 1 1 A 92 92 ALA CA C 92 52.671 52.815 -0.144 1
1 1072 . 17 1 1 A 92 92 ALA CB C 92 19.316 19.704 -0.388 1
1 1073 . 17 1 1 A 92 92 ALA N N 92 119.880 119.389 0.491 1
1 1074 . 17 1 1 A 93 93 GLY H H 93 7.693 7.841 -0.148 1
1 1075 . 17 1 1 A 93 93 GLY HA2 H 93 3.941 4.002 -0.061 1
1 1076 . 17 1 1 A 93 93 GLY HA3 H 93 3.744 4.013 -0.269 1
1 1077 . 17 1 1 A 93 93 GLY C C 93 174.344 175.180 -0.836 1
1 1078 . 17 1 1 A 93 93 GLY CA C 93 45.949 46.404 -0.455 1
1 1079 . 17 1 1 A 93 93 GLY N N 93 105.347 106.123 -0.776 1
1 1080 . 17 1 1 A 94 94 ASN H H 94 7.076 8.173 -1.097 1
1 1081 . 17 1 1 A 94 94 ASN HA H 94 4.115 4.841 -0.726 1
1 1085 . 17 1 1 A 94 94 ASN C C 94 175.410 175.709 -0.299 1
1 1086 . 17 1 1 A 94 94 ASN CA C 94 52.651 52.538 0.113 1
1 1087 . 17 1 1 A 94 94 ASN CB C 94 38.330 40.007 -1.677 1
1 1088 . 17 1 1 A 94 94 ASN N N 94 115.747 116.170 -0.423 1
1 1090 . 17 1 1 A 95 95 GLY H H 95 8.236 8.483 -0.247 1
1 1091 . 17 1 1 A 95 95 GLY HA2 H 95 3.633 3.920 -0.287 1
1 1092 . 17 1 1 A 95 95 GLY HA3 H 95 3.633 3.997 -0.364 1
1 1093 . 17 1 1 A 95 95 GLY C C 95 174.450 173.704 0.746 1
1 1094 . 17 1 1 A 95 95 GLY CA C 95 45.522 46.954 -1.432 1
1 1095 . 17 1 1 A 95 95 GLY N N 95 109.166 108.988 0.178 1
1 1096 . 17 1 1 A 96 96 TRP H H 96 7.899 7.854 0.045 1
1 1097 . 17 1 1 A 96 96 TRP HA H 96 5.241 4.999 0.242 1
1 1106 . 17 1 1 A 96 96 TRP C C 96 175.661 175.001 0.660 1
1 1107 . 17 1 1 A 96 96 TRP CA C 96 55.090 57.270 -2.180 1
1 1108 . 17 1 1 A 96 96 TRP CB C 96 27.138 32.463 -5.325 1
1 1114 . 17 1 1 A 96 96 TRP N N 96 122.840 120.222 2.618 1
1 1116 . 17 1 1 A 97 97 ASP H H 97 7.344 8.966 -1.622 1
1 1117 . 17 1 1 A 97 97 ASP HA H 97 4.829 4.165 0.664 1
1 1120 . 17 1 1 A 97 97 ASP C C 97 175.019 176.496 -1.477 1
1 1121 . 17 1 1 A 97 97 ASP CA C 97 52.149 56.456 -4.307 1
1 1122 . 17 1 1 A 97 97 ASP CB C 97 42.697 39.286 3.411 1
1 1123 . 17 1 1 A 97 97 ASP N N 97 126.861 122.942 3.919 1
1 1124 . 17 1 1 A 98 98 PHE H H 98 8.566 8.463 0.103 1
1 1125 . 17 1 1 A 98 98 PHE HA H 98 3.727 4.000 -0.273 1
1 1133 . 17 1 1 A 98 98 PHE C C 98 177.443 177.598 -0.155 1
1 1134 . 17 1 1 A 98 98 PHE CA C 98 62.471 62.167 0.304 1
1 1135 . 17 1 1 A 98 98 PHE CB C 98 39.919 39.130 0.789 1
1 1141 . 17 1 1 A 98 98 PHE N N 98 117.781 120.124 -2.343 1
1 1142 . 17 1 1 A 99 99 ASP H H 99 8.259 8.486 -0.227 1
1 1143 . 17 1 1 A 99 99 ASP HA H 99 3.960 4.187 -0.227 1
1 1146 . 17 1 1 A 99 99 ASP C C 99 178.132 178.471 -0.339 1
1 1147 . 17 1 1 A 99 99 ASP CA C 99 57.658 56.680 0.978 1
1 1148 . 17 1 1 A 99 99 ASP CB C 99 38.572 40.323 -1.751 1
1 1149 . 17 1 1 A 99 99 ASP N N 99 121.709 119.672 2.037 1
1 1150 . 17 1 1 A 100 100 MET H H 100 8.008 7.925 0.083 1
1 1151 . 17 1 1 A 100 100 MET HA H 100 3.644 4.342 -0.698 1
1 1156 . 17 1 1 A 100 100 MET C C 100 180.008 176.505 3.503 1
1 1157 . 17 1 1 A 100 100 MET CA C 100 58.598 58.289 0.309 1
1 1158 . 17 1 1 A 100 100 MET CB C 100 33.423 33.560 -0.137 1
1 1160 . 17 1 1 A 100 100 MET N N 100 119.668 116.373 3.295 1
1 1161 . 17 1 1 A 101 101 LEU H H 101 7.961 8.105 -0.144 1
1 1162 . 17 1 1 A 101 101 LEU HA H 101 3.523 4.489 -0.966 1
1 1172 . 17 1 1 A 101 101 LEU C C 101 173.873 176.403 -2.530 1
1 1173 . 17 1 1 A 101 101 LEU CA C 101 58.743 54.351 4.392 1
1 1174 . 17 1 1 A 101 101 LEU CB C 101 42.632 41.330 1.302 1
1 1178 . 17 1 1 A 101 101 LEU N N 101 119.752 114.130 5.622 1
1 1179 . 17 1 1 A 102 102 THR H H 102 6.955 8.415 -1.460 1
1 1180 . 17 1 1 A 102 102 THR HA H 102 4.134 4.290 -0.156 1
1 1185 . 17 1 1 A 102 102 THR C C 102 176.513 175.249 1.264 1
1 1186 . 17 1 1 A 102 102 THR CA C 102 61.125 62.127 -1.002 1
1 1187 . 17 1 1 A 102 102 THR CB C 102 71.415 70.355 1.060 1
1 1189 . 17 1 1 A 102 102 THR N N 102 124.665 113.895 10.770 1
1 1190 . 17 1 1 A 103 103 GLY H H 103 7.816 7.915 -0.099 1
1 1191 . 17 1 1 A 103 103 GLY HA2 H 103 3.824 3.954 -0.130 1
1 1192 . 17 1 1 A 103 103 GLY HA3 H 103 3.824 4.033 -0.209 1
1 1193 . 17 1 1 A 103 103 GLY C C 103 174.126 175.069 -0.943 1
1 1194 . 17 1 1 A 103 103 GLY CA C 103 47.805 46.623 1.182 1
1 1195 . 17 1 1 A 103 103 GLY N N 103 114.191 111.505 2.686 1
1 1196 . 17 1 1 A 104 104 SER H H 104 8.860 8.258 0.602 1
1 1197 . 17 1 1 A 104 104 SER HA H 104 4.758 4.428 0.330 1
1 1200 . 17 1 1 A 104 104 SER C C 104 174.591 175.127 -0.536 1
1 1201 . 17 1 1 A 104 104 SER CA C 104 56.755 59.772 -3.017 1
1 1202 . 17 1 1 A 104 104 SER CB C 104 65.050 63.765 1.285 1
1 1203 . 17 1 1 A 104 104 SER N N 104 114.771 112.711 2.060 1
1 1204 . 17 1 1 A 105 105 GLY H H 105 8.788 7.769 1.019 1
1 1205 . 17 1 1 A 105 105 GLY HA2 H 105 3.733 3.910 -0.177 1
1 1206 . 17 1 1 A 105 105 GLY HA3 H 105 3.733 3.952 -0.219 1
1 1207 . 17 1 1 A 105 105 GLY CA C 105 47.247 46.073 1.174 1
1 1208 . 17 1 1 A 105 105 GLY N N 105 110.394 108.828 1.566 1
1 1209 . 17 1 1 A 106 106 ASN HA H 106 4.454 4.429 0.025 1
1 1212 . 17 1 1 A 106 106 ASN C C 106 175.180 176.002 -0.822 1
1 1213 . 17 1 1 A 106 106 ASN CA C 106 54.492 55.814 -1.322 1
1 1214 . 17 1 1 A 106 106 ASN CB C 106 37.282 39.008 -1.726 1
1 1215 . 17 1 1 A 107 107 TYR H H 107 8.241 7.454 0.787 1
1 1216 . 17 1 1 A 107 107 TYR HA H 107 4.335 4.807 -0.472 1
1 1223 . 17 1 1 A 107 107 TYR C C 107 173.954 177.290 -3.336 1
1 1224 . 17 1 1 A 107 107 TYR CA C 107 57.727 58.081 -0.354 1
1 1225 . 17 1 1 A 107 107 TYR CB C 107 37.063 39.891 -2.828 1
1 1230 . 17 1 1 A 107 107 TYR N N 107 120.708 114.587 6.121 1
1 1231 . 17 1 1 A 108 108 SER H H 108 7.117 8.158 -1.041 1
1 1232 . 17 1 1 A 108 108 SER HA H 108 4.221 4.249 -0.028 1
1 1235 . 17 1 1 A 108 108 SER C C 108 174.834 174.143 0.691 1
1 1236 . 17 1 1 A 108 108 SER CA C 108 59.859 61.196 -1.337 1
1 1237 . 17 1 1 A 108 108 SER CB C 108 63.846 62.886 0.960 1
1 1238 . 17 1 1 A 108 108 SER N N 108 113.362 116.832 -3.470 1
1 1239 . 17 1 1 A 109 109 SER H H 109 8.053 7.643 0.410 1
1 1240 . 17 1 1 A 109 109 SER HA H 109 4.560 4.264 0.296 1
1 1243 . 17 1 1 A 109 109 SER CA C 109 57.141 60.790 -3.649 1
1 1244 . 17 1 1 A 109 109 SER CB C 109 64.874 61.844 3.030 1
1 1245 . 17 1 1 A 109 109 SER N N 109 116.657 113.058 3.599 1
1 1246 . 17 1 1 A 110 110 THR HA H 110 3.541 3.895 -0.354 1
1 1251 . 17 1 1 A 110 110 THR C C 110 175.477 176.287 -0.810 1
1 1252 . 17 1 1 A 110 110 THR CA C 110 66.443 65.864 0.579 1
1 1253 . 17 1 1 A 110 110 THR CB C 110 68.091 68.593 -0.502 1
1 1255 . 17 1 1 A 111 111 ASP H H 111 8.224 8.270 -0.046 1
1 1256 . 17 1 1 A 111 111 ASP HA H 111 4.237 4.346 -0.109 1
1 1259 . 17 1 1 A 111 111 ASP C C 111 177.520 178.692 -1.172 1
1 1260 . 17 1 1 A 111 111 ASP CA C 111 57.559 57.089 0.470 1
1 1261 . 17 1 1 A 111 111 ASP CB C 111 40.292 40.626 -0.334 1
1 1262 . 17 1 1 A 111 111 ASP N N 111 119.490 120.500 -1.010 1
1 1263 . 17 1 1 A 112 112 ALA H H 112 7.431 8.162 -0.731 1
1 1264 . 17 1 1 A 112 112 ALA HA H 112 4.191 4.574 -0.383 1
1 1268 . 17 1 1 A 112 112 ALA C C 112 180.646 178.911 1.735 1
1 1269 . 17 1 1 A 112 112 ALA CA C 112 54.534 54.687 -0.153 1
1 1270 . 17 1 1 A 112 112 ALA CB C 112 18.992 18.091 0.901 1
1 1271 . 17 1 1 A 112 112 ALA N N 112 119.710 121.832 -2.122 1
1 1272 . 17 1 1 A 113 113 GLN H H 113 7.576 7.364 0.212 1
1 1273 . 17 1 1 A 113 113 GLN HA H 113 3.562 4.098 -0.536 1
1 1278 . 17 1 1 A 113 113 GLN C C 113 176.756 178.054 -1.298 1
1 1279 . 17 1 1 A 113 113 GLN CA C 113 57.736 58.038 -0.302 1
1 1280 . 17 1 1 A 113 113 GLN CB C 113 29.110 28.319 0.791 1
1 1281 . 17 1 1 A 113 113 GLN N N 113 117.518 117.297 0.221 1
1 1283 . 17 1 1 A 114 114 MET H H 114 8.192 7.763 0.429 1
1 1284 . 17 1 1 A 114 114 MET HA H 114 4.231 3.777 0.454 1
1 1289 . 17 1 1 A 114 114 MET C C 114 175.648 178.029 -2.381 1
1 1290 . 17 1 1 A 114 114 MET CA C 114 57.446 57.800 -0.354 1
1 1291 . 17 1 1 A 114 114 MET CB C 114 33.570 32.318 1.252 1
1 1293 . 17 1 1 A 114 114 MET N N 114 111.509 119.528 -8.019 1
1 1294 . 17 1 1 A 115 115 GLN H H 115 6.940 7.285 -0.345 1
1 1295 . 17 1 1 A 115 115 GLN HA H 115 4.307 4.523 -0.216 1
1 1302 . 17 1 1 A 115 115 GLN C C 115 176.270 175.020 1.250 1
1 1303 . 17 1 1 A 115 115 GLN CA C 115 54.680 55.644 -0.964 1
1 1304 . 17 1 1 A 115 115 GLN CB C 115 28.233 28.797 -0.564 1
1 1306 . 17 1 1 A 115 115 GLN N N 115 114.300 116.263 -1.963 1
1 1308 . 17 1 1 A 116 116 TYR H H 116 6.677 7.895 -1.218 1
1 1309 . 17 1 1 A 116 116 TYR HA H 116 4.193 4.357 -0.164 1
1 1312 . 17 1 1 A 116 116 TYR C C 116 175.268 174.797 0.471 1
1 1313 . 17 1 1 A 116 116 TYR CA C 116 54.357 58.358 -4.001 1
1 1314 . 17 1 1 A 116 116 TYR CB C 116 35.498 37.037 -1.539 1
1 1315 . 17 1 1 A 116 116 TYR N N 116 117.919 116.535 1.384 1
1 1316 . 17 1 1 A 117 117 ASP H H 117 8.081 8.863 -0.782 1
1 1317 . 17 1 1 A 117 117 ASP HA H 117 4.665 5.071 -0.406 1
1 1320 . 17 1 1 A 117 117 ASP CA C 117 52.422 52.409 0.013 1
1 1321 . 17 1 1 A 117 117 ASP CB C 117 42.416 41.016 1.400 1
1 1322 . 17 1 1 A 117 117 ASP N N 117 120.887 123.826 -2.939 1
1 1323 . 17 1 1 A 118 118 PRO C C 118 179.180 178.688 0.492 1
1 1324 . 17 1 1 A 118 118 PRO CA C 118 65.942 64.795 1.147 1
1 1325 . 17 1 1 A 118 118 PRO CB C 118 32.197 32.038 0.159 1
1 1326 . 17 1 1 A 119 119 GLY H H 119 9.742 8.685 1.057 1
1 1327 . 17 1 1 A 119 119 GLY C C 119 175.622 175.550 0.072 1
1 1328 . 17 1 1 A 119 119 GLY CA C 119 46.785 46.919 -0.134 1
1 1329 . 17 1 1 A 119 119 GLY N N 119 106.412 106.655 -0.243 1
1 1330 . 17 1 1 A 120 120 LEU H H 120 6.666 8.357 -1.691 1
1 1331 . 17 1 1 A 120 120 LEU HA H 120 3.365 3.683 -0.318 1
1 1341 . 17 1 1 A 120 120 LEU C C 120 179.262 178.524 0.738 1
1 1342 . 17 1 1 A 120 120 LEU CA C 120 56.605 56.856 -0.251 1
1 1343 . 17 1 1 A 120 120 LEU CB C 120 39.262 41.376 -2.114 1
1 1347 . 17 1 1 A 120 120 LEU N N 120 126.226 123.117 3.109 1
1 1348 . 17 1 1 A 121 121 PHE H H 121 7.356 8.775 -1.419 1
1 1349 . 17 1 1 A 121 121 PHE HA H 121 4.459 4.102 0.357 1
1 1352 . 17 1 1 A 121 121 PHE C C 121 179.716 177.990 1.726 1
1 1353 . 17 1 1 A 121 121 PHE CA C 121 62.838 62.203 0.635 1
1 1354 . 17 1 1 A 121 121 PHE CB C 121 37.603 39.508 -1.905 1
1 1355 . 17 1 1 A 121 121 PHE N N 121 117.437 119.474 -2.037 1
1 1356 . 17 1 1 A 122 122 ALA H H 122 7.926 7.977 -0.051 1
1 1357 . 17 1 1 A 122 122 ALA HA H 122 4.523 3.907 0.616 1
1 1361 . 17 1 1 A 122 122 ALA C C 122 180.435 179.849 0.586 1
1 1362 . 17 1 1 A 122 122 ALA CA C 122 55.527 55.302 0.225 1
1 1363 . 17 1 1 A 122 122 ALA CB C 122 17.814 18.158 -0.344 1
1 1364 . 17 1 1 A 122 122 ALA N N 122 121.068 121.471 -0.403 1
1 1365 . 17 1 1 A 123 123 GLN H H 123 7.507 8.052 -0.545 1
1 1366 . 17 1 1 A 123 123 GLN HA H 123 4.153 3.821 0.332 1
1 1371 . 17 1 1 A 123 123 GLN C C 123 180.561 178.363 2.198 1
1 1372 . 17 1 1 A 123 123 GLN CA C 123 59.948 59.019 0.929 1
1 1373 . 17 1 1 A 123 123 GLN CB C 123 29.135 28.048 1.087 1
1 1375 . 17 1 1 A 123 123 GLN N N 123 120.324 117.150 3.174 1
1 1376 . 17 1 1 A 124 124 ILE H H 124 8.318 8.105 0.213 1
1 1377 . 17 1 1 A 124 124 ILE HA H 124 3.635 3.852 -0.217 1
1 1387 . 17 1 1 A 124 124 ILE C C 124 176.481 178.083 -1.602 1
1 1388 . 17 1 1 A 124 124 ILE CA C 124 66.432 64.553 1.879 1
1 1389 . 17 1 1 A 124 124 ILE CB C 124 39.168 37.798 1.370 1
1 1393 . 17 1 1 A 124 124 ILE N N 124 123.747 118.129 5.618 1
1 1394 . 17 1 1 A 125 125 GLN H H 125 8.474 7.847 0.627 1
1 1395 . 17 1 1 A 125 125 GLN HA H 125 4.264 3.850 0.414 1
1 1402 . 17 1 1 A 125 125 GLN C C 125 178.947 177.753 1.194 1
1 1403 . 17 1 1 A 125 125 GLN CA C 125 59.651 58.456 1.195 1
1 1404 . 17 1 1 A 125 125 GLN CB C 125 28.880 28.381 0.499 1
1 1406 . 17 1 1 A 125 125 GLN N N 125 120.368 121.124 -0.756 1
1 1408 . 17 1 1 A 126 126 ALA H H 126 8.002 7.803 0.199 1
1 1409 . 17 1 1 A 126 126 ALA HA H 126 4.144 4.015 0.129 1
1 1413 . 17 1 1 A 126 126 ALA C C 126 179.316 179.755 -0.439 1
1 1414 . 17 1 1 A 126 126 ALA CA C 126 55.036 55.012 0.024 1
1 1415 . 17 1 1 A 126 126 ALA CB C 126 18.087 18.299 -0.212 1
1 1416 . 17 1 1 A 126 126 ALA N N 126 121.661 121.072 0.589 1
1 1417 . 17 1 1 A 127 127 ALA H H 127 7.823 7.983 -0.160 1
1 1418 . 17 1 1 A 127 127 ALA HA H 127 4.162 3.987 0.175 1
1 1422 . 17 1 1 A 127 127 ALA C C 127 180.707 179.366 1.341 1
1 1423 . 17 1 1 A 127 127 ALA CA C 127 55.080 54.850 0.230 1
1 1424 . 17 1 1 A 127 127 ALA CB C 127 19.354 18.216 1.138 1
1 1425 . 17 1 1 A 127 127 ALA N N 127 119.853 119.978 -0.125 1
1 1426 . 17 1 1 A 128 128 ALA H H 128 8.936 7.554 1.382 1
1 1427 . 17 1 1 A 128 128 ALA HA H 128 3.928 3.576 0.352 1
1 1431 . 17 1 1 A 128 128 ALA C C 128 181.031 179.258 1.773 1
1 1432 . 17 1 1 A 128 128 ALA CA C 128 55.502 54.513 0.989 1
1 1433 . 17 1 1 A 128 128 ALA CB C 128 16.609 17.691 -1.082 1
1 1434 . 17 1 1 A 128 128 ALA N N 128 121.355 120.004 1.351 1
1 1435 . 17 1 1 A 129 129 THR H H 129 8.543 7.708 0.835 1
1 1436 . 17 1 1 A 129 129 THR HA H 129 4.015 3.639 0.376 1
1 1441 . 17 1 1 A 129 129 THR C C 129 177.332 176.438 0.894 1
1 1442 . 17 1 1 A 129 129 THR CA C 129 65.893 65.478 0.415 1
1 1443 . 17 1 1 A 129 129 THR CB C 129 68.566 68.139 0.427 1
1 1445 . 17 1 1 A 129 129 THR N N 129 112.709 111.182 1.527 1
1 1446 . 17 1 1 A 130 130 LYS H H 130 8.126 7.474 0.652 1
1 1447 . 17 1 1 A 130 130 LYS HA H 130 4.000 3.995 0.005 1
1 1456 . 17 1 1 A 130 130 LYS C C 130 179.082 178.409 0.673 1
1 1457 . 17 1 1 A 130 130 LYS CA C 130 60.299 58.735 1.564 1
1 1458 . 17 1 1 A 130 130 LYS CB C 130 32.767 32.117 0.650 1
1 1462 . 17 1 1 A 130 130 LYS N N 130 123.879 121.922 1.957 1
1 1463 . 17 1 1 A 131 131 ALA H H 131 7.184 7.676 -0.492 1
1 1464 . 17 1 1 A 131 131 ALA HA H 131 4.005 4.238 -0.233 1
1 1468 . 17 1 1 A 131 131 ALA C C 131 178.482 179.611 -1.129 1
1 1469 . 17 1 1 A 131 131 ALA CA C 131 55.027 55.196 -0.169 1
1 1470 . 17 1 1 A 131 131 ALA CB C 131 18.669 19.639 -0.970 1
1 1471 . 17 1 1 A 131 131 ALA N N 131 118.590 120.912 -2.322 1
1 1472 . 17 1 1 A 132 132 TRP H H 132 7.977 8.600 -0.623 1
1 1473 . 17 1 1 A 132 132 TRP HA H 132 4.001 4.215 -0.214 1
1 1480 . 17 1 1 A 132 132 TRP C C 132 177.332 175.874 1.458 1
1 1481 . 17 1 1 A 132 132 TRP CA C 132 60.431 57.445 2.986 1
1 1482 . 17 1 1 A 132 132 TRP CB C 132 27.786 27.559 0.227 1
1 1486 . 17 1 1 A 132 132 TRP N N 132 119.168 117.277 1.891 1
1 1488 . 17 1 1 A 133 133 ARG H H 133 8.006 8.223 -0.217 1
1 1489 . 17 1 1 A 133 133 ARG HA H 133 4.027 4.441 -0.414 1
1 1497 . 17 1 1 A 133 133 ARG C C 133 176.664 177.816 -1.152 1
1 1498 . 17 1 1 A 133 133 ARG CA C 133 59.355 57.378 1.977 1
1 1499 . 17 1 1 A 133 133 ARG CB C 133 30.451 32.197 -1.746 1
1 1502 . 17 1 1 A 133 133 ARG N N 133 113.062 120.688 -7.626 1
1 1504 . 17 1 1 A 134 134 LYS H H 134 7.322 7.569 -0.247 1
1 1505 . 17 1 1 A 134 134 LYS HA H 134 4.313 4.449 -0.136 1
1 1514 . 17 1 1 A 134 134 LYS C C 134 176.282 176.166 0.116 1
1 1515 . 17 1 1 A 134 134 LYS CA C 134 54.922 56.564 -1.642 1
1 1516 . 17 1 1 A 134 134 LYS CB C 134 32.633 31.292 1.341 1
1 1520 . 17 1 1 A 134 134 LYS N N 134 118.170 118.395 -0.225 1
1 1521 . 17 1 1 A 135 135 LEU H H 135 7.440 8.144 -0.704 1
1 1522 . 17 1 1 A 135 135 LEU HA H 135 4.174 4.695 -0.521 1
1 1532 . 17 1 1 A 135 135 LEU CA C 135 54.408 52.628 1.780 1
1 1533 . 17 1 1 A 135 135 LEU CB C 135 40.407 42.167 -1.760 1
1 1537 . 17 1 1 A 135 135 LEU N N 135 123.358 121.107 2.251 1
1 1538 . 17 1 1 A 136 136 PRO HA H 136 4.437 4.696 -0.259 1
1 1545 . 17 1 1 A 136 136 PRO C C 136 177.106 176.161 0.945 1
1 1546 . 17 1 1 A 136 136 PRO CA C 136 62.889 62.193 0.696 1
1 1547 . 17 1 1 A 136 136 PRO CB C 136 32.192 33.050 -0.858 1
1 1550 . 17 1 1 A 137 137 VAL H H 137 8.219 8.367 -0.148 1
1 1551 . 17 1 1 A 137 137 VAL HA H 137 4.077 4.273 -0.196 1
1 1559 . 17 1 1 A 137 137 VAL C C 137 176.305 176.197 0.108 1
1 1560 . 17 1 1 A 137 137 VAL CA C 137 61.958 62.114 -0.156 1
1 1561 . 17 1 1 A 137 137 VAL CB C 137 32.755 32.812 -0.057 1
1 1564 . 17 1 1 A 137 137 VAL N N 137 120.079 121.386 -1.307 1
1 1565 . 17 1 1 A 138 138 LYS H H 138 8.444 8.357 0.087 1
1 1566 . 17 1 1 A 138 138 LYS HA H 138 4.316 4.293 0.023 1
1 1575 . 17 1 1 A 138 138 LYS C C 138 176.790 177.265 -0.475 1
1 1576 . 17 1 1 A 138 138 LYS CA C 138 56.792 56.101 0.691 1
1 1577 . 17 1 1 A 138 138 LYS CB C 138 33.205 32.059 1.146 1
1 1581 . 17 1 1 A 138 138 LYS N N 138 126.449 125.452 0.997 1
1 1582 . 17 1 1 A 139 139 GLY H H 139 8.518 8.648 -0.130 1
1 1583 . 17 1 1 A 139 139 GLY HA2 H 139 4.070 3.899 0.171 1
1 1584 . 17 1 1 A 139 139 GLY HA3 H 139 3.897 3.903 -0.006 1
1 1585 . 17 1 1 A 139 139 GLY C C 139 172.874 173.791 -0.917 1
1 1586 . 17 1 1 A 139 139 GLY CA C 139 45.157 46.178 -1.021 1
1 1587 . 17 1 1 A 139 139 GLY N N 139 112.617 113.095 -0.478 1
1 6 . 18 1 1 A 2 2 VAL H H 2 8.992 8.182 0.810 1
1 7 . 18 1 1 A 2 2 VAL HA H 2 5.370 4.739 0.631 1
1 15 . 18 1 1 A 2 2 VAL C C 2 174.325 174.279 0.046 1
1 16 . 18 1 1 A 2 2 VAL CA C 2 61.267 60.583 0.684 1
1 17 . 18 1 1 A 2 2 VAL CB C 2 33.890 35.068 -1.178 1
1 20 . 18 1 1 A 2 2 VAL N N 2 126.939 119.257 7.682 1
1 21 . 18 1 1 A 3 3 THR H H 3 8.912 8.967 -0.055 1
1 22 . 18 1 1 A 3 3 THR HA H 3 4.505 5.275 -0.770 1
1 27 . 18 1 1 A 3 3 THR C C 3 172.710 173.732 -1.022 1
1 28 . 18 1 1 A 3 3 THR CA C 3 59.689 59.605 0.084 1
1 29 . 18 1 1 A 3 3 THR CB C 3 72.398 72.250 0.148 1
1 31 . 18 1 1 A 3 3 THR N N 3 118.091 122.811 -4.720 1
1 32 . 18 1 1 A 4 4 GLU H H 4 8.631 8.993 -0.362 1
1 33 . 18 1 1 A 4 4 GLU HA H 4 5.788 5.240 0.548 1
1 38 . 18 1 1 A 4 4 GLU C C 4 175.758 174.617 1.141 1
1 39 . 18 1 1 A 4 4 GLU CA C 4 54.902 54.135 0.767 1
1 40 . 18 1 1 A 4 4 GLU CB C 4 35.097 32.465 2.632 1
1 42 . 18 1 1 A 4 4 GLU N N 4 120.966 122.902 -1.936 1
1 43 . 18 1 1 A 5 5 THR H H 5 9.188 8.690 0.498 1
1 44 . 18 1 1 A 5 5 THR HA H 5 4.739 4.818 -0.079 1
1 49 . 18 1 1 A 5 5 THR C C 5 172.757 172.322 0.435 1
1 50 . 18 1 1 A 5 5 THR CA C 5 60.382 60.786 -0.404 1
1 51 . 18 1 1 A 5 5 THR CB C 5 71.558 70.633 0.925 1
1 53 . 18 1 1 A 5 5 THR N N 5 119.366 114.477 4.889 1
1 54 . 18 1 1 A 6 6 VAL H H 6 8.476 8.819 -0.343 1
1 55 . 18 1 1 A 6 6 VAL HA H 6 5.026 5.477 -0.451 1
1 63 . 18 1 1 A 6 6 VAL C C 6 176.674 173.465 3.209 1
1 64 . 18 1 1 A 6 6 VAL CA C 6 61.008 59.080 1.928 1
1 65 . 18 1 1 A 6 6 VAL CB C 6 33.861 35.904 -2.043 1
1 68 . 18 1 1 A 6 6 VAL N N 6 121.384 119.178 2.206 1
1 69 . 18 1 1 A 7 7 ASP H H 7 8.848 8.832 0.016 1
1 70 . 18 1 1 A 7 7 ASP HA H 7 4.797 5.083 -0.286 1
1 73 . 18 1 1 A 7 7 ASP CA C 7 52.834 53.220 -0.386 1
1 74 . 18 1 1 A 7 7 ASP CB C 7 42.219 43.140 -0.921 1
1 75 . 18 1 1 A 7 7 ASP N N 7 127.061 124.040 3.021 1
1 76 . 18 1 1 A 8 8 GLY C C 8 175.143 174.127 1.016 1
1 77 . 18 1 1 A 8 8 GLY CA C 8 46.553 46.835 -0.282 1
1 78 . 18 1 1 A 9 9 GLN H H 9 8.408 7.605 0.803 1
1 79 . 18 1 1 A 9 9 GLN HA H 9 4.541 4.281 0.260 1
1 86 . 18 1 1 A 9 9 GLN C C 9 176.463 177.138 -0.675 1
1 87 . 18 1 1 A 9 9 GLN CA C 9 55.167 55.128 0.039 1
1 88 . 18 1 1 A 9 9 GLN CB C 9 29.376 27.643 1.733 1
1 90 . 18 1 1 A 9 9 GLN N N 9 118.300 116.393 1.907 1
1 92 . 18 1 1 A 10 10 GLY H H 10 8.162 7.944 0.218 1
1 93 . 18 1 1 A 10 10 GLY HA2 H 10 4.174 3.955 0.219 1
1 94 . 18 1 1 A 10 10 GLY HA3 H 10 3.521 3.961 -0.440 1
1 95 . 18 1 1 A 10 10 GLY C C 10 174.092 173.735 0.357 1
1 96 . 18 1 1 A 10 10 GLY CA C 10 45.558 46.447 -0.889 1
1 97 . 18 1 1 A 10 10 GLY N N 10 108.747 110.311 -1.564 1
1 98 . 18 1 1 A 11 11 GLN H H 11 8.507 7.194 1.313 1
1 99 . 18 1 1 A 11 11 GLN HA H 11 4.202 4.910 -0.708 1
1 106 . 18 1 1 A 11 11 GLN C C 11 173.992 174.002 -0.010 1
1 107 . 18 1 1 A 11 11 GLN CA C 11 55.098 53.777 1.321 1
1 108 . 18 1 1 A 11 11 GLN CB C 11 29.097 32.097 -3.000 1
1 110 . 18 1 1 A 11 11 GLN N N 11 122.979 115.294 7.685 1
1 112 . 18 1 1 A 12 12 ALA H H 12 8.259 8.637 -0.378 1
1 113 . 18 1 1 A 12 12 ALA HA H 12 5.156 5.416 -0.260 1
1 117 . 18 1 1 A 12 12 ALA C C 12 177.284 175.907 1.377 1
1 118 . 18 1 1 A 12 12 ALA CA C 12 51.087 50.185 0.902 1
1 119 . 18 1 1 A 12 12 ALA CB C 12 20.500 21.212 -0.712 1
1 120 . 18 1 1 A 12 12 ALA N N 12 127.100 122.757 4.343 1
1 121 . 18 1 1 A 13 13 TRP H H 13 9.245 9.342 -0.097 1
1 122 . 18 1 1 A 13 13 TRP HA H 13 4.717 5.107 -0.390 1
1 131 . 18 1 1 A 13 13 TRP C C 13 175.108 175.370 -0.262 1
1 132 . 18 1 1 A 13 13 TRP CA C 13 55.966 56.560 -0.594 1
1 133 . 18 1 1 A 13 13 TRP CB C 13 31.912 32.396 -0.484 1
1 139 . 18 1 1 A 13 13 TRP N N 13 123.088 123.470 -0.382 1
1 141 . 18 1 1 A 14 14 ARG H H 14 8.575 8.926 -0.351 1
1 142 . 18 1 1 A 14 14 ARG HA H 14 5.335 4.919 0.416 1
1 150 . 18 1 1 A 14 14 ARG C C 14 175.191 174.589 0.602 1
1 151 . 18 1 1 A 14 14 ARG CA C 14 53.106 54.742 -1.636 1
1 152 . 18 1 1 A 14 14 ARG CB C 14 32.749 34.584 -1.835 1
1 154 . 18 1 1 A 14 14 ARG N N 14 121.163 121.106 0.057 1
1 156 . 18 1 1 A 15 15 HIS H H 15 8.595 8.957 -0.362 1
1 157 . 18 1 1 A 15 15 HIS HA H 15 4.790 4.952 -0.162 1
1 161 . 18 1 1 A 15 15 HIS C C 15 173.770 173.786 -0.016 1
1 162 . 18 1 1 A 15 15 HIS CA C 15 55.289 54.821 0.468 1
1 163 . 18 1 1 A 15 15 HIS CB C 15 33.208 33.568 -0.360 1
1 165 . 18 1 1 A 15 15 HIS N N 15 117.643 118.928 -1.285 1
1 166 . 18 1 1 A 16 16 HIS H H 16 8.993 8.970 0.023 1
1 167 . 18 1 1 A 16 16 HIS HA H 16 5.158 4.845 0.313 1
1 171 . 18 1 1 A 16 16 HIS C C 16 173.608 173.635 -0.027 1
1 172 . 18 1 1 A 16 16 HIS CA C 16 56.450 55.091 1.359 1
1 173 . 18 1 1 A 16 16 HIS CB C 16 34.171 31.354 2.817 1
1 175 . 18 1 1 A 16 16 HIS N N 16 123.520 123.590 -0.070 1
1 176 . 18 1 1 A 17 17 ASN H H 17 7.829 8.695 -0.866 1
1 177 . 18 1 1 A 17 17 ASN HA H 17 4.713 5.304 -0.591 1
1 182 . 18 1 1 A 17 17 ASN C C 17 173.682 175.614 -1.932 1
1 183 . 18 1 1 A 17 17 ASN CA C 17 51.822 51.218 0.604 1
1 184 . 18 1 1 A 17 17 ASN CB C 17 43.176 41.343 1.833 1
1 185 . 18 1 1 A 17 17 ASN N N 17 122.213 126.691 -4.478 1
1 187 . 18 1 1 A 18 18 GLY H H 18 8.423 8.580 -0.157 1
1 188 . 18 1 1 A 18 18 GLY HA2 H 18 3.931 3.961 -0.030 1
1 189 . 18 1 1 A 18 18 GLY HA3 H 18 3.707 4.073 -0.366 1
1 190 . 18 1 1 A 18 18 GLY C C 18 173.985 172.954 1.031 1
1 191 . 18 1 1 A 18 18 GLY CA C 18 43.949 44.517 -0.568 1
1 192 . 18 1 1 A 18 18 GLY N N 18 106.991 112.192 -5.201 1
1 193 . 18 1 1 A 19 19 PHE H H 19 8.338 8.424 -0.086 1
1 194 . 18 1 1 A 19 19 PHE HA H 19 4.068 4.624 -0.556 1
1 197 . 18 1 1 A 19 19 PHE C C 19 176.568 175.896 0.672 1
1 198 . 18 1 1 A 19 19 PHE CA C 19 59.338 59.048 0.290 1
1 199 . 18 1 1 A 19 19 PHE CB C 19 40.201 39.525 0.676 1
1 200 . 18 1 1 A 19 19 PHE N N 19 116.857 118.568 -1.711 1
1 201 . 18 1 1 A 20 20 ASP H H 20 8.794 8.636 0.158 1
1 202 . 18 1 1 A 20 20 ASP HA H 20 4.485 4.838 -0.353 1
1 205 . 18 1 1 A 20 20 ASP C C 20 177.379 177.252 0.127 1
1 206 . 18 1 1 A 20 20 ASP CA C 20 54.140 54.441 -0.301 1
1 207 . 18 1 1 A 20 20 ASP CB C 20 41.915 42.138 -0.223 1
1 208 . 18 1 1 A 20 20 ASP N N 20 123.025 124.229 -1.204 1
1 209 . 18 1 1 A 21 21 PHE H H 21 8.862 9.164 -0.302 1
1 210 . 18 1 1 A 21 21 PHE HA H 21 4.087 4.110 -0.023 1
1 218 . 18 1 1 A 21 21 PHE C C 21 176.952 177.295 -0.343 1
1 219 . 18 1 1 A 21 21 PHE CA C 21 61.095 62.366 -1.271 1
1 220 . 18 1 1 A 21 21 PHE CB C 21 38.678 39.285 -0.607 1
1 226 . 18 1 1 A 21 21 PHE N N 21 127.163 127.592 -0.429 1
1 227 . 18 1 1 A 22 22 ALA H H 22 8.561 8.385 0.176 1
1 228 . 18 1 1 A 22 22 ALA HA H 22 3.878 3.901 -0.023 1
1 232 . 18 1 1 A 22 22 ALA C C 22 180.710 180.259 0.451 1
1 233 . 18 1 1 A 22 22 ALA CA C 22 55.211 55.115 0.096 1
1 234 . 18 1 1 A 22 22 ALA CB C 22 18.321 18.144 0.177 1
1 235 . 18 1 1 A 22 22 ALA N N 22 120.293 121.355 -1.062 1
1 236 . 18 1 1 A 23 23 VAL H H 23 7.241 7.974 -0.733 1
1 237 . 18 1 1 A 23 23 VAL HA H 23 3.684 3.522 0.162 1
1 245 . 18 1 1 A 23 23 VAL C C 23 177.101 178.090 -0.989 1
1 246 . 18 1 1 A 23 23 VAL CA C 23 65.237 66.938 -1.701 1
1 247 . 18 1 1 A 23 23 VAL CB C 23 31.780 31.586 0.194 1
1 250 . 18 1 1 A 23 23 VAL N N 23 118.775 117.986 0.789 1
1 251 . 18 1 1 A 24 24 ILE H H 24 6.761 8.182 -1.421 1
1 252 . 18 1 1 A 24 24 ILE HA H 24 3.196 3.484 -0.288 1
1 262 . 18 1 1 A 24 24 ILE C C 24 177.287 178.007 -0.720 1
1 263 . 18 1 1 A 24 24 ILE CA C 24 63.404 65.605 -2.201 1
1 264 . 18 1 1 A 24 24 ILE CB C 24 36.294 37.771 -1.477 1
1 268 . 18 1 1 A 24 24 ILE N N 24 119.036 119.631 -0.595 1
1 269 . 18 1 1 A 25 25 LYS H H 25 8.032 8.176 -0.144 1
1 270 . 18 1 1 A 25 25 LYS HA H 25 3.809 3.642 0.167 1
1 279 . 18 1 1 A 25 25 LYS C C 25 179.450 178.478 0.972 1
1 280 . 18 1 1 A 25 25 LYS CA C 25 59.621 59.546 0.075 1
1 281 . 18 1 1 A 25 25 LYS CB C 25 32.259 31.928 0.331 1
1 285 . 18 1 1 A 25 25 LYS N N 25 118.368 120.574 -2.206 1
1 286 . 18 1 1 A 26 26 GLU H H 26 7.845 7.994 -0.149 1
1 287 . 18 1 1 A 26 26 GLU HA H 26 4.021 4.218 -0.197 1
1 292 . 18 1 1 A 26 26 GLU C C 26 179.191 178.782 0.409 1
1 293 . 18 1 1 A 26 26 GLU CA C 26 59.530 58.794 0.736 1
1 294 . 18 1 1 A 26 26 GLU CB C 26 29.449 29.414 0.035 1
1 296 . 18 1 1 A 26 26 GLU N N 26 120.522 118.713 1.809 1
1 297 . 18 1 1 A 27 27 LEU H H 27 8.165 8.447 -0.282 1
1 298 . 18 1 1 A 27 27 LEU HA H 27 4.163 4.174 -0.011 1
1 308 . 18 1 1 A 27 27 LEU C C 27 177.256 178.403 -1.147 1
1 309 . 18 1 1 A 27 27 LEU CA C 27 58.049 57.447 0.602 1
1 310 . 18 1 1 A 27 27 LEU CB C 27 41.365 41.107 0.258 1
1 314 . 18 1 1 A 27 27 LEU N N 27 120.879 121.284 -0.405 1
1 315 . 18 1 1 A 28 28 LYS H H 28 8.902 8.172 0.730 1
1 316 . 18 1 1 A 28 28 LYS HA H 28 4.199 4.071 0.128 1
1 317 . 18 1 1 A 28 28 LYS C C 28 179.707 179.242 0.465 1
1 318 . 18 1 1 A 28 28 LYS CA C 28 60.097 59.170 0.927 1
1 319 . 18 1 1 A 28 28 LYS CB C 28 33.420 31.830 1.590 1
1 320 . 18 1 1 A 28 28 LYS N N 28 120.050 119.532 0.518 1
1 321 . 18 1 1 A 29 29 THR H H 29 8.294 8.058 0.236 1
1 322 . 18 1 1 A 29 29 THR HA H 29 3.892 3.874 0.018 1
1 327 . 18 1 1 A 29 29 THR C C 29 175.711 176.483 -0.772 1
1 328 . 18 1 1 A 29 29 THR CA C 29 66.846 66.486 0.360 1
1 329 . 18 1 1 A 29 29 THR CB C 29 68.794 68.771 0.023 1
1 331 . 18 1 1 A 29 29 THR N N 29 115.933 116.943 -1.010 1
1 332 . 18 1 1 A 30 30 ALA H H 30 8.244 8.769 -0.525 1
1 333 . 18 1 1 A 30 30 ALA HA H 30 4.241 4.190 0.051 1
1 337 . 18 1 1 A 30 30 ALA C C 30 179.128 179.810 -0.682 1
1 338 . 18 1 1 A 30 30 ALA CA C 30 55.714 55.238 0.476 1
1 339 . 18 1 1 A 30 30 ALA CB C 30 18.955 18.577 0.378 1
1 340 . 18 1 1 A 30 30 ALA N N 30 124.617 124.024 0.593 1
1 341 . 18 1 1 A 31 31 ALA H H 31 8.968 8.297 0.671 1
1 342 . 18 1 1 A 31 31 ALA HA H 31 3.890 4.076 -0.186 1
1 346 . 18 1 1 A 31 31 ALA C C 31 180.352 179.624 0.728 1
1 347 . 18 1 1 A 31 31 ALA CA C 31 55.454 55.105 0.349 1
1 348 . 18 1 1 A 31 31 ALA CB C 31 17.124 18.139 -1.015 1
1 349 . 18 1 1 A 31 31 ALA N N 31 119.327 120.854 -1.527 1
1 350 . 18 1 1 A 32 32 SER H H 32 7.995 7.736 0.259 1
1 351 . 18 1 1 A 32 32 SER HA H 32 4.238 4.209 0.029 1
1 354 . 18 1 1 A 32 32 SER C C 32 175.612 175.715 -0.103 1
1 355 . 18 1 1 A 32 32 SER CA C 32 61.203 61.508 -0.305 1
1 356 . 18 1 1 A 32 32 SER CB C 32 63.406 63.426 -0.020 1
1 357 . 18 1 1 A 32 32 SER N N 32 111.962 114.358 -2.396 1
1 358 . 18 1 1 A 33 33 GLN H H 33 8.333 7.451 0.882 1
1 359 . 18 1 1 A 33 33 GLN HA H 33 3.992 4.163 -0.171 1
1 366 . 18 1 1 A 33 33 GLN C C 33 177.486 176.921 0.565 1
1 367 . 18 1 1 A 33 33 GLN CA C 33 58.277 57.488 0.789 1
1 368 . 18 1 1 A 33 33 GLN CB C 33 29.140 29.473 -0.333 1
1 370 . 18 1 1 A 33 33 GLN N N 33 119.527 118.869 0.658 1
1 372 . 18 1 1 A 34 34 TYR H H 34 8.587 8.119 0.468 1
1 373 . 18 1 1 A 34 34 TYR HA H 34 4.792 4.851 -0.059 1
1 380 . 18 1 1 A 34 34 TYR C C 34 176.499 176.868 -0.369 1
1 381 . 18 1 1 A 34 34 TYR CA C 34 57.711 57.872 -0.161 1
1 382 . 18 1 1 A 34 34 TYR CB C 34 39.561 38.881 0.680 1
1 387 . 18 1 1 A 34 34 TYR N N 34 114.610 115.784 -1.174 1
1 388 . 18 1 1 A 35 35 GLY H H 35 7.346 8.414 -1.068 1
1 389 . 18 1 1 A 35 35 GLY HA2 H 35 4.785 3.897 0.888 1
1 390 . 18 1 1 A 35 35 GLY HA3 H 35 4.007 3.979 0.028 1
1 391 . 18 1 1 A 35 35 GLY C C 35 175.796 174.722 1.074 1
1 392 . 18 1 1 A 35 35 GLY CA C 35 44.355 47.345 -2.990 1
1 393 . 18 1 1 A 35 35 GLY N N 35 108.501 109.071 -0.570 1
1 394 . 18 1 1 A 36 36 ALA H H 36 9.363 7.819 1.544 1
1 395 . 18 1 1 A 36 36 ALA HA H 36 4.217 4.499 -0.282 1
1 399 . 18 1 1 A 36 36 ALA C C 36 178.039 176.908 1.131 1
1 400 . 18 1 1 A 36 36 ALA CA C 36 56.114 51.660 4.454 1
1 401 . 18 1 1 A 36 36 ALA CB C 36 19.179 20.448 -1.269 1
1 402 . 18 1 1 A 36 36 ALA N N 36 125.811 122.913 2.898 1
1 403 . 18 1 1 A 37 37 THR H H 37 8.070 8.437 -0.367 1
1 404 . 18 1 1 A 37 37 THR HA H 37 4.570 4.284 0.286 1
1 409 . 18 1 1 A 37 37 THR C C 37 173.685 174.010 -0.325 1
1 410 . 18 1 1 A 37 37 THR CA C 37 59.822 62.226 -2.404 1
1 411 . 18 1 1 A 37 37 THR CB C 37 68.267 68.033 0.234 1
1 413 . 18 1 1 A 37 37 THR N N 37 129.410 113.934 15.476 1
1 414 . 18 1 1 A 38 38 ALA H H 38 6.853 7.890 -1.037 1
1 415 . 18 1 1 A 38 38 ALA HA H 38 4.601 4.872 -0.271 1
1 419 . 18 1 1 A 38 38 ALA CA C 38 50.758 48.987 1.771 1
1 420 . 18 1 1 A 38 38 ALA CB C 38 18.325 20.223 -1.898 1
1 421 . 18 1 1 A 38 38 ALA N N 38 124.674 126.141 -1.467 1
1 422 . 18 1 1 A 40 40 TYR HA H 40 4.032 4.008 0.024 1
1 429 . 18 1 1 A 40 40 TYR C C 40 176.456 177.389 -0.933 1
1 430 . 18 1 1 A 40 40 TYR CA C 40 61.010 61.927 -0.917 1
1 431 . 18 1 1 A 40 40 TYR CB C 40 39.286 38.492 0.794 1
1 436 . 18 1 1 A 41 41 THR H H 41 6.874 7.852 -0.978 1
1 437 . 18 1 1 A 41 41 THR HA H 41 3.616 3.930 -0.314 1
1 442 . 18 1 1 A 41 41 THR C C 41 176.930 176.320 0.610 1
1 443 . 18 1 1 A 41 41 THR CA C 41 65.557 65.172 0.385 1
1 444 . 18 1 1 A 41 41 THR CB C 41 68.228 68.845 -0.617 1
1 446 . 18 1 1 A 41 41 THR N N 41 115.143 113.993 1.150 1
1 447 . 18 1 1 A 42 42 LEU H H 42 8.623 7.964 0.659 1
1 448 . 18 1 1 A 42 42 LEU HA H 42 3.708 4.053 -0.345 1
1 458 . 18 1 1 A 42 42 LEU C C 42 178.206 179.562 -1.356 1
1 459 . 18 1 1 A 42 42 LEU CA C 42 57.417 57.186 0.231 1
1 460 . 18 1 1 A 42 42 LEU CB C 42 41.342 41.631 -0.289 1
1 464 . 18 1 1 A 42 42 LEU N N 42 120.418 121.616 -1.198 1
1 465 . 18 1 1 A 43 43 ALA H H 43 7.735 8.105 -0.370 1
1 466 . 18 1 1 A 43 43 ALA HA H 43 4.020 3.996 0.024 1
1 470 . 18 1 1 A 43 43 ALA C C 43 180.826 180.609 0.217 1
1 471 . 18 1 1 A 43 43 ALA CA C 43 54.925 54.984 -0.059 1
1 472 . 18 1 1 A 43 43 ALA CB C 43 17.506 18.220 -0.714 1
1 473 . 18 1 1 A 43 43 ALA N N 43 120.203 122.399 -2.196 1
1 474 . 18 1 1 A 44 44 ILE H H 44 7.149 7.399 -0.250 1
1 475 . 18 1 1 A 44 44 ILE HA H 44 3.603 3.634 -0.031 1
1 485 . 18 1 1 A 44 44 ILE C C 44 178.594 178.505 0.089 1
1 486 . 18 1 1 A 44 44 ILE CA C 44 64.782 64.163 0.619 1
1 487 . 18 1 1 A 44 44 ILE CB C 44 37.472 36.503 0.969 1
1 491 . 18 1 1 A 44 44 ILE N N 44 118.881 119.353 -0.472 1
1 492 . 18 1 1 A 45 45 VAL H H 45 7.968 7.818 0.150 1
1 493 . 18 1 1 A 45 45 VAL HA H 45 2.925 3.386 -0.461 1
1 501 . 18 1 1 A 45 45 VAL C C 45 177.023 177.701 -0.678 1
1 502 . 18 1 1 A 45 45 VAL CA C 45 67.081 67.002 0.079 1
1 503 . 18 1 1 A 45 45 VAL CB C 45 30.854 31.339 -0.485 1
1 506 . 18 1 1 A 45 45 VAL N N 45 120.764 120.461 0.303 1
1 507 . 18 1 1 A 46 46 GLU H H 46 8.399 8.289 0.110 1
1 508 . 18 1 1 A 46 46 GLU HA H 46 3.848 3.907 -0.059 1
1 513 . 18 1 1 A 46 46 GLU C C 46 178.656 178.367 0.289 1
1 514 . 18 1 1 A 46 46 GLU CA C 46 59.491 58.931 0.560 1
1 515 . 18 1 1 A 46 46 GLU CB C 46 28.991 28.399 0.592 1
1 517 . 18 1 1 A 46 46 GLU N N 46 116.599 119.918 -3.319 1
1 518 . 18 1 1 A 47 47 SER H H 47 7.273 7.812 -0.539 1
1 519 . 18 1 1 A 47 47 SER HA H 47 4.287 4.135 0.152 1
1 521 . 18 1 1 A 47 47 SER CA C 47 61.047 62.638 -1.591 1
1 522 . 18 1 1 A 47 47 SER CB C 47 63.016 62.936 0.080 1
1 523 . 18 1 1 A 47 47 SER N N 47 113.609 117.970 -4.361 1
1 524 . 18 1 1 A 48 48 VAL H H 48 8.006 7.878 0.128 1
1 525 . 18 1 1 A 48 48 VAL HA H 48 3.556 3.621 -0.065 1
1 533 . 18 1 1 A 48 48 VAL C C 48 177.257 177.431 -0.174 1
1 534 . 18 1 1 A 48 48 VAL CA C 48 65.025 66.229 -1.204 1
1 535 . 18 1 1 A 48 48 VAL CB C 48 31.841 31.301 0.540 1
1 538 . 18 1 1 A 48 48 VAL N N 48 122.327 121.683 0.644 1
1 539 . 18 1 1 A 49 49 ALA H H 49 8.369 8.102 0.267 1
1 540 . 18 1 1 A 49 49 ALA HA H 49 4.115 4.342 -0.227 1
1 544 . 18 1 1 A 49 49 ALA C C 49 177.307 177.692 -0.385 1
1 545 . 18 1 1 A 49 49 ALA CA C 49 53.253 53.123 0.130 1
1 546 . 18 1 1 A 49 49 ALA CB C 49 20.131 18.349 1.782 1
1 547 . 18 1 1 A 49 49 ALA N N 49 118.050 120.836 -2.786 1
1 548 . 18 1 1 A 50 50 ASP H H 50 7.052 7.821 -0.769 1
1 549 . 18 1 1 A 50 50 ASP HA H 50 4.788 4.532 0.256 1
1 552 . 18 1 1 A 50 50 ASP C C 50 175.481 176.124 -0.643 1
1 553 . 18 1 1 A 50 50 ASP CA C 50 53.681 54.446 -0.765 1
1 554 . 18 1 1 A 50 50 ASP CB C 50 39.333 41.003 -1.670 1
1 555 . 18 1 1 A 50 50 ASP N N 50 116.997 117.410 -0.413 1
1 556 . 18 1 1 A 51 51 ASN H H 51 8.535 7.403 1.132 1
1 557 . 18 1 1 A 51 51 ASN HA H 51 4.628 4.694 -0.066 1
1 562 . 18 1 1 A 51 51 ASN C C 51 174.077 175.428 -1.351 1
1 563 . 18 1 1 A 51 51 ASN CA C 51 52.315 51.637 0.678 1
1 564 . 18 1 1 A 51 51 ASN CB C 51 41.928 40.463 1.465 1
1 565 . 18 1 1 A 51 51 ASN N N 51 118.626 117.694 0.932 1
1 567 . 18 1 1 A 52 52 TRP H H 52 8.555 8.125 0.430 1
1 574 . 18 1 1 A 52 52 TRP C C 52 173.269 175.998 -2.729 1
1 575 . 18 1 1 A 52 52 TRP CA C 52 55.031 56.734 -1.703 1
1 576 . 18 1 1 A 52 52 TRP CB C 52 26.801 29.235 -2.434 1
1 582 . 18 1 1 A 52 52 TRP N N 52 120.693 120.510 0.183 1
1 584 . 18 1 1 A 53 53 LEU H H 53 7.847 7.398 0.449 1
1 585 . 18 1 1 A 53 53 LEU HA H 53 4.859 4.222 0.637 1
1 595 . 18 1 1 A 53 53 LEU C C 53 177.397 176.610 0.787 1
1 596 . 18 1 1 A 53 53 LEU CA C 53 53.619 55.221 -1.602 1
1 597 . 18 1 1 A 53 53 LEU CB C 53 41.812 42.434 -0.622 1
1 601 . 18 1 1 A 53 53 LEU N N 53 124.741 119.460 5.281 1
1 602 . 18 1 1 A 54 54 THR H H 54 8.850 8.619 0.231 1
1 603 . 18 1 1 A 54 54 THR HA H 54 4.598 4.771 -0.173 1
1 608 . 18 1 1 A 54 54 THR CA C 54 60.531 60.129 0.402 1
1 609 . 18 1 1 A 54 54 THR CB C 54 67.183 69.192 -2.009 1
1 611 . 18 1 1 A 54 54 THR N N 54 113.407 112.832 0.575 1
1 612 . 18 1 1 A 55 55 PRO HA H 55 4.511 4.445 0.066 1
1 619 . 18 1 1 A 55 55 PRO C C 55 179.383 177.710 1.673 1
1 620 . 18 1 1 A 55 55 PRO CA C 55 67.159 65.618 1.541 1
1 621 . 18 1 1 A 55 55 PRO CB C 55 32.095 31.673 0.422 1
1 622 . 18 1 1 A 56 56 THR H H 56 8.575 7.741 0.834 1
1 623 . 18 1 1 A 56 56 THR HA H 56 4.229 4.194 0.035 1
1 628 . 18 1 1 A 56 56 THR C C 56 176.668 176.962 -0.294 1
1 629 . 18 1 1 A 56 56 THR CA C 56 66.943 65.145 1.798 1
1 630 . 18 1 1 A 56 56 THR CB C 56 68.129 68.780 -0.651 1
1 632 . 18 1 1 A 56 56 THR N N 56 114.855 111.602 3.253 1
1 633 . 18 1 1 A 57 57 ASP H H 57 8.730 8.277 0.453 1
1 634 . 18 1 1 A 57 57 ASP HA H 57 4.425 4.521 -0.096 1
1 637 . 18 1 1 A 57 57 ASP C C 57 178.351 179.394 -1.043 1
1 638 . 18 1 1 A 57 57 ASP CA C 57 57.963 57.548 0.415 1
1 639 . 18 1 1 A 57 57 ASP CB C 57 40.134 40.576 -0.442 1
1 640 . 18 1 1 A 57 57 ASP N N 57 126.239 122.159 4.080 1
1 641 . 18 1 1 A 58 58 TRP H H 58 8.244 8.491 -0.247 1
1 642 . 18 1 1 A 58 58 TRP HA H 58 4.030 4.536 -0.506 1
1 650 . 18 1 1 A 58 58 TRP C C 58 177.432 179.396 -1.964 1
1 651 . 18 1 1 A 58 58 TRP CA C 58 62.731 60.417 2.314 1
1 652 . 18 1 1 A 58 58 TRP CB C 58 29.122 29.438 -0.316 1
1 657 . 18 1 1 A 58 58 TRP N N 58 119.241 120.616 -1.375 1
1 659 . 18 1 1 A 59 59 ASN H H 59 8.098 9.162 -1.064 1
1 660 . 18 1 1 A 59 59 ASN HA H 59 4.424 4.479 -0.055 1
1 663 . 18 1 1 A 59 59 ASN C C 59 176.952 177.882 -0.930 1
1 664 . 18 1 1 A 59 59 ASN CA C 59 58.135 56.449 1.686 1
1 665 . 18 1 1 A 59 59 ASN CB C 59 40.168 38.367 1.801 1
1 666 . 18 1 1 A 59 59 ASN N N 59 115.747 117.909 -2.162 1
1 667 . 18 1 1 A 60 60 THR H H 60 8.712 7.812 0.900 1
1 668 . 18 1 1 A 60 60 THR HA H 60 3.717 4.098 -0.381 1
1 673 . 18 1 1 A 60 60 THR C C 60 176.044 176.694 -0.650 1
1 674 . 18 1 1 A 60 60 THR CA C 60 66.576 66.390 0.186 1
1 675 . 18 1 1 A 60 60 THR CB C 60 69.251 68.588 0.663 1
1 677 . 18 1 1 A 60 60 THR N N 60 114.896 118.132 -3.236 1
1 678 . 18 1 1 A 61 61 LEU H H 61 8.485 8.368 0.117 1
1 679 . 18 1 1 A 61 61 LEU HA H 61 3.391 3.936 -0.545 1
1 689 . 18 1 1 A 61 61 LEU C C 61 177.433 178.686 -1.253 1
1 690 . 18 1 1 A 61 61 LEU CA C 61 58.354 58.554 -0.200 1
1 691 . 18 1 1 A 61 61 LEU CB C 61 41.761 42.438 -0.677 1
1 695 . 18 1 1 A 61 61 LEU N N 61 123.433 122.508 0.925 1
1 696 . 18 1 1 A 62 62 VAL H H 62 8.073 8.263 -0.190 1
1 697 . 18 1 1 A 62 62 VAL HA H 62 3.207 3.884 -0.677 1
1 705 . 18 1 1 A 62 62 VAL C C 62 177.585 177.805 -0.220 1
1 706 . 18 1 1 A 62 62 VAL CA C 62 67.345 65.158 2.187 1
1 707 . 18 1 1 A 62 62 VAL CB C 62 30.905 30.742 0.163 1
1 710 . 18 1 1 A 62 62 VAL N N 62 116.018 118.584 -2.566 1
1 711 . 18 1 1 A 63 63 ARG H H 63 7.765 7.865 -0.100 1
1 712 . 18 1 1 A 63 63 ARG HA H 63 3.602 3.886 -0.284 1
1 719 . 18 1 1 A 63 63 ARG C C 63 177.818 178.174 -0.356 1
1 720 . 18 1 1 A 63 63 ARG CA C 63 58.049 59.574 -1.525 1
1 721 . 18 1 1 A 63 63 ARG CB C 63 29.955 30.061 -0.106 1
1 724 . 18 1 1 A 63 63 ARG N N 63 116.700 121.401 -4.701 1
1 725 . 18 1 1 A 64 64 ALA H H 64 7.574 7.465 0.109 1
1 726 . 18 1 1 A 64 64 ALA HA H 64 4.158 4.301 -0.143 1
1 730 . 18 1 1 A 64 64 ALA C C 64 179.886 179.254 0.632 1
1 731 . 18 1 1 A 64 64 ALA CA C 64 54.007 54.092 -0.085 1
1 732 . 18 1 1 A 64 64 ALA CB C 64 19.147 19.722 -0.575 1
1 733 . 18 1 1 A 64 64 ALA N N 64 117.555 121.428 -3.873 1
1 734 . 18 1 1 A 65 65 VAL H H 65 7.554 7.982 -0.428 1
1 735 . 18 1 1 A 65 65 VAL HA H 65 4.253 3.831 0.422 1
1 743 . 18 1 1 A 65 65 VAL C C 65 174.180 176.491 -2.311 1
1 744 . 18 1 1 A 65 65 VAL CA C 65 62.683 65.531 -2.848 1
1 745 . 18 1 1 A 65 65 VAL CB C 65 33.458 31.462 1.996 1
1 748 . 18 1 1 A 65 65 VAL N N 65 110.013 115.522 -5.509 1
1 749 . 18 1 1 A 66 66 LEU H H 66 7.792 7.510 0.282 1
1 750 . 18 1 1 A 66 66 LEU HA H 66 4.790 4.569 0.221 1
1 760 . 18 1 1 A 66 66 LEU C C 66 177.537 175.799 1.738 1
1 761 . 18 1 1 A 66 66 LEU CA C 66 52.823 53.467 -0.644 1
1 762 . 18 1 1 A 66 66 LEU CB C 66 44.071 43.183 0.888 1
1 766 . 18 1 1 A 66 66 LEU N N 66 118.967 121.696 -2.729 1
1 767 . 18 1 1 A 67 67 SER H H 67 9.208 8.399 0.809 1
1 768 . 18 1 1 A 67 67 SER HA H 67 4.414 4.997 -0.583 1
1 771 . 18 1 1 A 67 67 SER CA C 67 57.943 57.668 0.275 1
1 772 . 18 1 1 A 67 67 SER CB C 67 64.743 65.886 -1.143 1
1 773 . 18 1 1 A 67 67 SER N N 67 116.378 116.712 -0.334 1
1 774 . 18 1 1 A 69 69 GLY HA2 H 69 3.916 3.634 0.282 1
1 775 . 18 1 1 A 69 69 GLY HA3 H 69 3.867 3.664 0.203 1
1 776 . 18 1 1 A 69 69 GLY C C 69 176.783 175.154 1.629 1
1 777 . 18 1 1 A 69 69 GLY CA C 69 46.977 46.897 0.080 1
1 778 . 18 1 1 A 70 70 ASP H H 70 7.674 7.959 -0.285 1
1 779 . 18 1 1 A 70 70 ASP HA H 70 4.511 3.348 1.163 1
1 782 . 18 1 1 A 70 70 ASP C C 70 178.096 178.071 0.025 1
1 783 . 18 1 1 A 70 70 ASP CA C 70 57.262 56.332 0.930 1
1 784 . 18 1 1 A 70 70 ASP CB C 70 40.594 39.750 0.844 1
1 785 . 18 1 1 A 70 70 ASP N N 70 123.930 121.961 1.969 1
1 786 . 18 1 1 A 71 71 HIS H H 71 8.729 8.227 0.502 1
1 787 . 18 1 1 A 71 71 HIS HA H 71 4.235 4.191 0.044 1
1 790 . 18 1 1 A 71 71 HIS C C 71 176.769 176.714 0.055 1
1 791 . 18 1 1 A 71 71 HIS CA C 71 60.041 58.938 1.103 1
1 792 . 18 1 1 A 71 71 HIS CB C 71 30.682 28.376 2.306 1
1 793 . 18 1 1 A 71 71 HIS N N 71 121.003 116.769 4.234 1
1 794 . 18 1 1 A 72 72 LEU H H 72 7.620 6.985 0.635 1
1 795 . 18 1 1 A 72 72 LEU HA H 72 3.769 3.911 -0.142 1
1 805 . 18 1 1 A 72 72 LEU C C 72 180.275 179.237 1.038 1
1 806 . 18 1 1 A 72 72 LEU CA C 72 58.192 57.930 0.262 1
1 807 . 18 1 1 A 72 72 LEU CB C 72 41.381 41.277 0.104 1
1 811 . 18 1 1 A 72 72 LEU N N 72 118.569 118.646 -0.077 1
1 812 . 18 1 1 A 73 73 LEU H H 73 7.542 7.972 -0.430 1
1 813 . 18 1 1 A 73 73 LEU HA H 73 4.107 4.132 -0.025 1
1 823 . 18 1 1 A 73 73 LEU C C 73 179.436 179.198 0.238 1
1 824 . 18 1 1 A 73 73 LEU CA C 73 58.026 57.380 0.646 1
1 825 . 18 1 1 A 73 73 LEU CB C 73 41.638 42.046 -0.408 1
1 829 . 18 1 1 A 73 73 LEU N N 73 121.418 120.794 0.624 1
1 830 . 18 1 1 A 74 74 TRP H H 74 8.786 7.971 0.815 1
1 831 . 18 1 1 A 74 74 TRP HA H 74 3.589 5.390 -1.801 1
1 840 . 18 1 1 A 74 74 TRP C C 74 176.816 178.720 -1.904 1
1 841 . 18 1 1 A 74 74 TRP CA C 74 63.046 60.070 2.976 1
1 842 . 18 1 1 A 74 74 TRP CB C 74 28.065 29.225 -1.160 1
1 848 . 18 1 1 A 74 74 TRP N N 74 121.111 118.129 2.982 1
1 850 . 18 1 1 A 75 75 LYS H H 75 8.939 7.780 1.159 1
1 851 . 18 1 1 A 75 75 LYS HA H 75 3.055 4.370 -1.315 1
1 860 . 18 1 1 A 75 75 LYS C C 75 177.967 179.469 -1.502 1
1 861 . 18 1 1 A 75 75 LYS CA C 75 60.029 58.914 1.115 1
1 862 . 18 1 1 A 75 75 LYS CB C 75 32.533 33.057 -0.524 1
1 866 . 18 1 1 A 75 75 LYS N N 75 119.783 118.783 1.000 1
1 867 . 18 1 1 A 76 76 SER H H 76 7.832 8.017 -0.185 1
1 868 . 18 1 1 A 76 76 SER HA H 76 4.040 4.285 -0.245 1
1 871 . 18 1 1 A 76 76 SER C C 76 177.816 177.240 0.576 1
1 872 . 18 1 1 A 76 76 SER CA C 76 62.105 62.393 -0.288 1
1 873 . 18 1 1 A 76 76 SER CB C 76 62.679 62.930 -0.251 1
1 874 . 18 1 1 A 76 76 SER N N 76 113.395 117.291 -3.896 1
1 875 . 18 1 1 A 77 77 GLU H H 77 7.590 7.690 -0.100 1
1 876 . 18 1 1 A 77 77 GLU HA H 77 4.042 4.267 -0.225 1
1 881 . 18 1 1 A 77 77 GLU C C 77 177.809 178.639 -0.830 1
1 882 . 18 1 1 A 77 77 GLU CA C 77 58.270 58.663 -0.393 1
1 883 . 18 1 1 A 77 77 GLU CB C 77 29.208 29.479 -0.271 1
1 885 . 18 1 1 A 77 77 GLU N N 77 121.574 121.877 -0.303 1
1 886 . 18 1 1 A 78 78 PHE H H 78 9.081 8.039 1.042 1
1 887 . 18 1 1 A 78 78 PHE HA H 78 3.778 4.342 -0.564 1
1 895 . 18 1 1 A 78 78 PHE C C 78 178.114 177.497 0.617 1
1 896 . 18 1 1 A 78 78 PHE CA C 78 60.629 61.470 -0.841 1
1 897 . 18 1 1 A 78 78 PHE CB C 78 38.295 39.262 -0.967 1
1 902 . 18 1 1 A 78 78 PHE N N 78 122.682 122.162 0.520 1
1 903 . 18 1 1 A 79 79 PHE H H 79 8.890 8.202 0.688 1
1 904 . 18 1 1 A 79 79 PHE HA H 79 3.800 3.878 -0.078 1
1 912 . 18 1 1 A 79 79 PHE C C 79 178.354 178.214 0.140 1
1 913 . 18 1 1 A 79 79 PHE CA C 79 60.704 62.283 -1.579 1
1 914 . 18 1 1 A 79 79 PHE CB C 79 37.184 38.464 -1.280 1
1 920 . 18 1 1 A 79 79 PHE N N 79 121.056 117.392 3.664 1
1 921 . 18 1 1 A 80 80 GLU H H 80 7.793 8.102 -0.309 1
1 922 . 18 1 1 A 80 80 GLU HA H 80 4.082 4.011 0.071 1
1 927 . 18 1 1 A 80 80 GLU C C 80 179.068 178.911 0.157 1
1 928 . 18 1 1 A 80 80 GLU CA C 80 59.735 59.365 0.370 1
1 929 . 18 1 1 A 80 80 GLU CB C 80 28.722 29.324 -0.602 1
1 931 . 18 1 1 A 80 80 GLU N N 80 120.312 118.979 1.333 1
1 932 . 18 1 1 A 81 81 ASN H H 81 8.624 9.002 -0.378 1
1 933 . 18 1 1 A 81 81 ASN HA H 81 4.521 4.417 0.104 1
1 938 . 18 1 1 A 81 81 ASN C C 81 179.262 177.714 1.548 1
1 939 . 18 1 1 A 81 81 ASN CA C 81 55.504 55.990 -0.486 1
1 940 . 18 1 1 A 81 81 ASN CB C 81 37.517 37.294 0.223 1
1 941 . 18 1 1 A 81 81 ASN N N 81 119.338 117.089 2.249 1
1 943 . 18 1 1 A 82 82 CYS H H 82 8.554 8.272 0.282 1
1 944 . 18 1 1 A 82 82 CYS HA H 82 3.792 4.041 -0.249 1
1 947 . 18 1 1 A 82 82 CYS C C 82 176.478 176.534 -0.056 1
1 948 . 18 1 1 A 82 82 CYS CA C 82 65.232 62.158 3.074 1
1 949 . 18 1 1 A 82 82 CYS CB C 82 26.762 26.734 0.028 1
1 950 . 18 1 1 A 82 82 CYS N N 82 120.576 117.850 2.726 1
1 951 . 18 1 1 A 83 83 ARG H H 83 8.522 7.779 0.743 1
1 952 . 18 1 1 A 83 83 ARG HA H 83 3.932 4.189 -0.257 1
1 960 . 18 1 1 A 83 83 ARG C C 83 179.138 178.551 0.587 1
1 961 . 18 1 1 A 83 83 ARG CA C 83 60.443 59.535 0.908 1
1 962 . 18 1 1 A 83 83 ARG CB C 83 29.550 29.870 -0.320 1
1 965 . 18 1 1 A 83 83 ARG N N 83 123.035 120.265 2.770 1
1 967 . 18 1 1 A 84 84 ASP H H 84 7.791 8.442 -0.651 1
1 968 . 18 1 1 A 84 84 ASP HA H 84 4.353 4.312 0.041 1
1 971 . 18 1 1 A 84 84 ASP C C 84 178.649 178.806 -0.157 1
1 972 . 18 1 1 A 84 84 ASP CA C 84 57.767 57.534 0.233 1
1 973 . 18 1 1 A 84 84 ASP CB C 84 41.305 41.829 -0.524 1
1 974 . 18 1 1 A 84 84 ASP N N 84 120.332 119.547 0.785 1
1 975 . 18 1 1 A 85 85 THR H H 85 8.370 8.217 0.153 1
1 976 . 18 1 1 A 85 85 THR HA H 85 3.730 3.934 -0.204 1
1 981 . 18 1 1 A 85 85 THR C C 85 175.198 176.537 -1.339 1
1 982 . 18 1 1 A 85 85 THR CA C 85 66.830 66.052 0.778 1
1 983 . 18 1 1 A 85 85 THR CB C 85 68.533 68.311 0.222 1
1 985 . 18 1 1 A 85 85 THR N N 85 117.360 115.437 1.923 1
1 986 . 18 1 1 A 86 86 ALA H H 86 8.845 7.839 1.006 1
1 987 . 18 1 1 A 86 86 ALA HA H 86 3.991 4.192 -0.201 1
1 991 . 18 1 1 A 86 86 ALA C C 86 179.980 179.397 0.583 1
1 992 . 18 1 1 A 86 86 ALA CA C 86 55.769 55.005 0.764 1
1 993 . 18 1 1 A 86 86 ALA CB C 86 17.881 18.480 -0.599 1
1 994 . 18 1 1 A 86 86 ALA N N 86 123.613 123.388 0.225 1
1 995 . 18 1 1 A 87 87 LYS H H 87 7.686 8.476 -0.790 1
1 996 . 18 1 1 A 87 87 LYS HA H 87 4.099 3.890 0.209 1
1 1005 . 18 1 1 A 87 87 LYS C C 87 179.592 179.542 0.050 1
1 1006 . 18 1 1 A 87 87 LYS CA C 87 59.708 59.693 0.015 1
1 1007 . 18 1 1 A 87 87 LYS CB C 87 32.054 32.285 -0.231 1
1 1011 . 18 1 1 A 87 87 LYS N N 87 119.623 118.056 1.567 1
1 1012 . 18 1 1 A 88 88 ARG H H 88 7.683 7.671 0.012 1
1 1013 . 18 1 1 A 88 88 ARG HA H 88 4.051 4.131 -0.080 1
1 1020 . 18 1 1 A 88 88 ARG C C 88 180.053 178.842 1.211 1
1 1021 . 18 1 1 A 88 88 ARG CA C 88 59.558 59.023 0.535 1
1 1022 . 18 1 1 A 88 88 ARG CB C 88 29.684 29.795 -0.111 1
1 1025 . 18 1 1 A 88 88 ARG N N 88 120.788 119.114 1.674 1
1 1026 . 18 1 1 A 89 89 ASN H H 89 8.973 7.991 0.982 1
1 1027 . 18 1 1 A 89 89 ASN HA H 89 4.354 4.613 -0.259 1
1 1032 . 18 1 1 A 89 89 ASN C C 89 178.382 178.561 -0.179 1
1 1033 . 18 1 1 A 89 89 ASN CA C 89 55.334 55.886 -0.552 1
1 1034 . 18 1 1 A 89 89 ASN CB C 89 37.864 37.946 -0.082 1
1 1035 . 18 1 1 A 89 89 ASN N N 89 121.012 117.903 3.109 1
1 1037 . 18 1 1 A 90 90 GLN H H 90 8.152 8.011 0.141 1
1 1038 . 18 1 1 A 90 90 GLN HA H 90 4.020 4.182 -0.162 1
1 1045 . 18 1 1 A 90 90 GLN C C 90 179.075 178.611 0.464 1
1 1046 . 18 1 1 A 90 90 GLN CA C 90 59.318 58.818 0.500 1
1 1047 . 18 1 1 A 90 90 GLN CB C 90 28.049 28.556 -0.507 1
1 1049 . 18 1 1 A 90 90 GLN N N 90 122.122 120.869 1.253 1
1 1051 . 18 1 1 A 91 91 GLN H H 91 7.514 8.405 -0.891 1
1 1052 . 18 1 1 A 91 91 GLN HA H 91 4.053 4.073 -0.020 1
1 1059 . 18 1 1 A 91 91 GLN C C 91 177.081 177.887 -0.806 1
1 1060 . 18 1 1 A 91 91 GLN CA C 91 58.031 58.695 -0.664 1
1 1061 . 18 1 1 A 91 91 GLN CB C 91 28.365 27.807 0.558 1
1 1063 . 18 1 1 A 91 91 GLN N N 91 118.124 118.179 -0.055 1
1 1065 . 18 1 1 A 92 92 ALA H H 92 7.704 7.483 0.221 1
1 1066 . 18 1 1 A 92 92 ALA HA H 92 4.246 4.272 -0.026 1
1 1070 . 18 1 1 A 92 92 ALA C C 92 178.450 178.039 0.411 1
1 1071 . 18 1 1 A 92 92 ALA CA C 92 52.671 52.683 -0.012 1
1 1072 . 18 1 1 A 92 92 ALA CB C 92 19.316 19.673 -0.357 1
1 1073 . 18 1 1 A 92 92 ALA N N 92 119.880 119.375 0.505 1
1 1074 . 18 1 1 A 93 93 GLY H H 93 7.693 7.899 -0.206 1
1 1075 . 18 1 1 A 93 93 GLY HA2 H 93 3.941 3.946 -0.005 1
1 1076 . 18 1 1 A 93 93 GLY HA3 H 93 3.744 3.956 -0.212 1
1 1077 . 18 1 1 A 93 93 GLY C C 93 174.344 174.689 -0.345 1
1 1078 . 18 1 1 A 93 93 GLY CA C 93 45.949 46.405 -0.456 1
1 1079 . 18 1 1 A 93 93 GLY N N 93 105.347 107.707 -2.360 1
1 1080 . 18 1 1 A 94 94 ASN H H 94 7.076 8.565 -1.489 1
1 1081 . 18 1 1 A 94 94 ASN HA H 94 4.115 4.844 -0.729 1
1 1085 . 18 1 1 A 94 94 ASN C C 94 175.410 175.860 -0.450 1
1 1086 . 18 1 1 A 94 94 ASN CA C 94 52.651 52.674 -0.023 1
1 1087 . 18 1 1 A 94 94 ASN CB C 94 38.330 39.936 -1.606 1
1 1088 . 18 1 1 A 94 94 ASN N N 94 115.747 117.742 -1.995 1
1 1090 . 18 1 1 A 95 95 GLY H H 95 8.236 8.271 -0.035 1
1 1091 . 18 1 1 A 95 95 GLY HA2 H 95 3.633 3.421 0.212 1
1 1092 . 18 1 1 A 95 95 GLY HA3 H 95 3.633 3.676 -0.043 1
1 1093 . 18 1 1 A 95 95 GLY C C 95 174.450 173.711 0.739 1
1 1094 . 18 1 1 A 95 95 GLY CA C 95 45.522 45.325 0.197 1
1 1095 . 18 1 1 A 95 95 GLY N N 95 109.166 109.180 -0.014 1
1 1096 . 18 1 1 A 96 96 TRP H H 96 7.899 7.461 0.438 1
1 1097 . 18 1 1 A 96 96 TRP HA H 96 5.241 5.060 0.181 1
1 1106 . 18 1 1 A 96 96 TRP C C 96 175.661 174.840 0.821 1
1 1107 . 18 1 1 A 96 96 TRP CA C 96 55.090 56.847 -1.757 1
1 1108 . 18 1 1 A 96 96 TRP CB C 96 27.138 31.837 -4.699 1
1 1114 . 18 1 1 A 96 96 TRP N N 96 122.840 121.075 1.765 1
1 1116 . 18 1 1 A 97 97 ASP H H 97 7.344 8.967 -1.623 1
1 1117 . 18 1 1 A 97 97 ASP HA H 97 4.829 5.311 -0.482 1
1 1120 . 18 1 1 A 97 97 ASP C C 97 175.019 176.607 -1.588 1
1 1121 . 18 1 1 A 97 97 ASP CA C 97 52.149 53.145 -0.996 1
1 1122 . 18 1 1 A 97 97 ASP CB C 97 42.697 43.962 -1.265 1
1 1123 . 18 1 1 A 97 97 ASP N N 97 126.861 121.078 5.783 1
1 1124 . 18 1 1 A 98 98 PHE H H 98 8.566 9.328 -0.762 1
1 1125 . 18 1 1 A 98 98 PHE HA H 98 3.727 4.378 -0.651 1
1 1133 . 18 1 1 A 98 98 PHE C C 98 177.443 176.233 1.210 1
1 1134 . 18 1 1 A 98 98 PHE CA C 98 62.471 59.907 2.564 1
1 1135 . 18 1 1 A 98 98 PHE CB C 98 39.919 37.960 1.959 1
1 1141 . 18 1 1 A 98 98 PHE N N 98 117.781 123.146 -5.365 1
1 1142 . 18 1 1 A 99 99 ASP H H 99 8.259 8.262 -0.003 1
1 1143 . 18 1 1 A 99 99 ASP HA H 99 3.960 4.619 -0.659 1
1 1146 . 18 1 1 A 99 99 ASP C C 99 178.132 177.758 0.374 1
1 1147 . 18 1 1 A 99 99 ASP CA C 99 57.658 55.564 2.094 1
1 1148 . 18 1 1 A 99 99 ASP CB C 99 38.572 40.705 -2.133 1
1 1149 . 18 1 1 A 99 99 ASP N N 99 121.709 120.249 1.460 1
1 1150 . 18 1 1 A 100 100 MET H H 100 8.008 7.327 0.681 1
1 1151 . 18 1 1 A 100 100 MET HA H 100 3.644 4.353 -0.709 1
1 1156 . 18 1 1 A 100 100 MET C C 100 180.008 176.698 3.310 1
1 1157 . 18 1 1 A 100 100 MET CA C 100 58.598 57.132 1.466 1
1 1158 . 18 1 1 A 100 100 MET CB C 100 33.423 33.336 0.087 1
1 1160 . 18 1 1 A 100 100 MET N N 100 119.668 116.130 3.538 1
1 1161 . 18 1 1 A 101 101 LEU H H 101 7.961 8.010 -0.049 1
1 1162 . 18 1 1 A 101 101 LEU HA H 101 3.523 4.553 -1.030 1
1 1172 . 18 1 1 A 101 101 LEU C C 101 173.873 176.216 -2.343 1
1 1173 . 18 1 1 A 101 101 LEU CA C 101 58.743 53.660 5.083 1
1 1174 . 18 1 1 A 101 101 LEU CB C 101 42.632 42.529 0.103 1
1 1178 . 18 1 1 A 101 101 LEU N N 101 119.752 120.193 -0.441 1
1 1179 . 18 1 1 A 102 102 THR H H 102 6.955 8.957 -2.002 1
1 1180 . 18 1 1 A 102 102 THR HA H 102 4.134 4.463 -0.329 1
1 1185 . 18 1 1 A 102 102 THR C C 102 176.513 174.302 2.211 1
1 1186 . 18 1 1 A 102 102 THR CA C 102 61.125 62.507 -1.382 1
1 1187 . 18 1 1 A 102 102 THR CB C 102 71.415 69.043 2.372 1
1 1189 . 18 1 1 A 102 102 THR N N 102 124.665 121.336 3.329 1
1 1190 . 18 1 1 A 103 103 GLY H H 103 7.816 8.735 -0.919 1
1 1191 . 18 1 1 A 103 103 GLY HA2 H 103 3.824 4.010 -0.186 1
1 1192 . 18 1 1 A 103 103 GLY HA3 H 103 3.824 4.104 -0.280 1
1 1193 . 18 1 1 A 103 103 GLY C C 103 174.126 174.786 -0.660 1
1 1194 . 18 1 1 A 103 103 GLY CA C 103 47.805 45.571 2.234 1
1 1195 . 18 1 1 A 103 103 GLY N N 103 114.191 112.112 2.079 1
1 1196 . 18 1 1 A 104 104 SER H H 104 8.860 8.915 -0.055 1
1 1197 . 18 1 1 A 104 104 SER HA H 104 4.758 4.239 0.519 1
1 1200 . 18 1 1 A 104 104 SER C C 104 174.591 174.936 -0.345 1
1 1201 . 18 1 1 A 104 104 SER CA C 104 56.755 59.067 -2.312 1
1 1202 . 18 1 1 A 104 104 SER CB C 104 65.050 61.038 4.012 1
1 1203 . 18 1 1 A 104 104 SER N N 104 114.771 115.201 -0.430 1
1 1204 . 18 1 1 A 105 105 GLY H H 105 8.788 8.265 0.523 1
1 1205 . 18 1 1 A 105 105 GLY HA2 H 105 3.733 4.022 -0.289 1
1 1206 . 18 1 1 A 105 105 GLY HA3 H 105 3.733 4.037 -0.304 1
1 1207 . 18 1 1 A 105 105 GLY CA C 105 47.247 45.987 1.260 1
1 1208 . 18 1 1 A 105 105 GLY N N 105 110.394 109.127 1.267 1
1 1209 . 18 1 1 A 106 106 ASN HA H 106 4.454 4.908 -0.454 1
1 1212 . 18 1 1 A 106 106 ASN C C 106 175.180 176.095 -0.915 1
1 1213 . 18 1 1 A 106 106 ASN CA C 106 54.492 54.166 0.326 1
1 1214 . 18 1 1 A 106 106 ASN CB C 106 37.282 41.486 -4.204 1
1 1215 . 18 1 1 A 107 107 TYR H H 107 8.241 8.271 -0.030 1
1 1216 . 18 1 1 A 107 107 TYR HA H 107 4.335 4.909 -0.574 1
1 1223 . 18 1 1 A 107 107 TYR C C 107 173.954 176.361 -2.407 1
1 1224 . 18 1 1 A 107 107 TYR CA C 107 57.727 56.282 1.445 1
1 1225 . 18 1 1 A 107 107 TYR CB C 107 37.063 38.148 -1.085 1
1 1230 . 18 1 1 A 107 107 TYR N N 107 120.708 114.970 5.738 1
1 1231 . 18 1 1 A 108 108 SER H H 108 7.117 8.270 -1.153 1
1 1232 . 18 1 1 A 108 108 SER HA H 108 4.221 4.081 0.140 1
1 1235 . 18 1 1 A 108 108 SER C C 108 174.834 174.991 -0.157 1
1 1236 . 18 1 1 A 108 108 SER CA C 108 59.859 61.915 -2.056 1
1 1237 . 18 1 1 A 108 108 SER CB C 108 63.846 63.479 0.367 1
1 1238 . 18 1 1 A 108 108 SER N N 108 113.362 118.531 -5.169 1
1 1239 . 18 1 1 A 109 109 SER H H 109 8.053 7.842 0.211 1
1 1240 . 18 1 1 A 109 109 SER HA H 109 4.560 4.221 0.339 1
1 1243 . 18 1 1 A 109 109 SER CA C 109 57.141 60.871 -3.730 1
1 1244 . 18 1 1 A 109 109 SER CB C 109 64.874 61.899 2.975 1
1 1245 . 18 1 1 A 109 109 SER N N 109 116.657 114.634 2.023 1
1 1246 . 18 1 1 A 110 110 THR HA H 110 3.541 3.925 -0.384 1
1 1251 . 18 1 1 A 110 110 THR C C 110 175.477 176.257 -0.780 1
1 1252 . 18 1 1 A 110 110 THR CA C 110 66.443 65.989 0.454 1
1 1253 . 18 1 1 A 110 110 THR CB C 110 68.091 68.538 -0.447 1
1 1255 . 18 1 1 A 111 111 ASP H H 111 8.224 8.388 -0.164 1
1 1256 . 18 1 1 A 111 111 ASP HA H 111 4.237 4.249 -0.012 1
1 1259 . 18 1 1 A 111 111 ASP C C 111 177.520 178.555 -1.035 1
1 1260 . 18 1 1 A 111 111 ASP CA C 111 57.559 57.445 0.114 1
1 1261 . 18 1 1 A 111 111 ASP CB C 111 40.292 40.275 0.017 1
1 1262 . 18 1 1 A 111 111 ASP N N 111 119.490 120.448 -0.958 1
1 1263 . 18 1 1 A 112 112 ALA H H 112 7.431 8.027 -0.596 1
1 1264 . 18 1 1 A 112 112 ALA HA H 112 4.191 4.086 0.105 1
1 1268 . 18 1 1 A 112 112 ALA C C 112 180.646 179.733 0.913 1
1 1269 . 18 1 1 A 112 112 ALA CA C 112 54.534 55.404 -0.870 1
1 1270 . 18 1 1 A 112 112 ALA CB C 112 18.992 18.260 0.732 1
1 1271 . 18 1 1 A 112 112 ALA N N 112 119.710 122.679 -2.969 1
1 1272 . 18 1 1 A 113 113 GLN H H 113 7.576 7.748 -0.172 1
1 1273 . 18 1 1 A 113 113 GLN HA H 113 3.562 4.340 -0.778 1
1 1278 . 18 1 1 A 113 113 GLN C C 113 176.756 178.344 -1.588 1
1 1279 . 18 1 1 A 113 113 GLN CA C 113 57.736 58.050 -0.314 1
1 1280 . 18 1 1 A 113 113 GLN CB C 113 29.110 28.427 0.683 1
1 1281 . 18 1 1 A 113 113 GLN N N 113 117.518 117.434 0.084 1
1 1283 . 18 1 1 A 114 114 MET H H 114 8.192 8.048 0.144 1
1 1284 . 18 1 1 A 114 114 MET HA H 114 4.231 4.210 0.021 1
1 1289 . 18 1 1 A 114 114 MET C C 114 175.648 178.104 -2.456 1
1 1290 . 18 1 1 A 114 114 MET CA C 114 57.446 58.234 -0.788 1
1 1291 . 18 1 1 A 114 114 MET CB C 114 33.570 32.155 1.415 1
1 1293 . 18 1 1 A 114 114 MET N N 114 111.509 119.961 -8.452 1
1 1294 . 18 1 1 A 115 115 GLN H H 115 6.940 7.468 -0.528 1
1 1295 . 18 1 1 A 115 115 GLN HA H 115 4.307 4.225 0.082 1
1 1302 . 18 1 1 A 115 115 GLN C C 115 176.270 175.768 0.502 1
1 1303 . 18 1 1 A 115 115 GLN CA C 115 54.680 55.808 -1.128 1
1 1304 . 18 1 1 A 115 115 GLN CB C 115 28.233 28.840 -0.607 1
1 1306 . 18 1 1 A 115 115 GLN N N 115 114.300 115.583 -1.283 1
1 1308 . 18 1 1 A 116 116 TYR H H 116 6.677 7.828 -1.151 1
1 1309 . 18 1 1 A 116 116 TYR HA H 116 4.193 4.292 -0.099 1
1 1312 . 18 1 1 A 116 116 TYR C C 116 175.268 174.009 1.259 1
1 1313 . 18 1 1 A 116 116 TYR CA C 116 54.357 58.775 -4.418 1
1 1314 . 18 1 1 A 116 116 TYR CB C 116 35.498 36.825 -1.327 1
1 1315 . 18 1 1 A 116 116 TYR N N 116 117.919 118.898 -0.979 1
1 1316 . 18 1 1 A 117 117 ASP H H 117 8.081 9.010 -0.929 1
1 1317 . 18 1 1 A 117 117 ASP HA H 117 4.665 4.995 -0.330 1
1 1320 . 18 1 1 A 117 117 ASP CA C 117 52.422 50.364 2.058 1
1 1321 . 18 1 1 A 117 117 ASP CB C 117 42.416 42.631 -0.215 1
1 1322 . 18 1 1 A 117 117 ASP N N 117 120.887 127.023 -6.136 1
1 1323 . 18 1 1 A 118 118 PRO C C 118 179.180 178.492 0.688 1
1 1324 . 18 1 1 A 118 118 PRO CA C 118 65.942 64.650 1.292 1
1 1325 . 18 1 1 A 118 118 PRO CB C 118 32.197 31.852 0.345 1
1 1326 . 18 1 1 A 119 119 GLY H H 119 9.742 8.169 1.573 1
1 1327 . 18 1 1 A 119 119 GLY C C 119 175.622 174.944 0.678 1
1 1328 . 18 1 1 A 119 119 GLY CA C 119 46.785 46.309 0.476 1
1 1329 . 18 1 1 A 119 119 GLY N N 119 106.412 106.370 0.042 1
1 1330 . 18 1 1 A 120 120 LEU H H 120 6.666 7.205 -0.539 1
1 1331 . 18 1 1 A 120 120 LEU HA H 120 3.365 3.384 -0.019 1
1 1341 . 18 1 1 A 120 120 LEU C C 120 179.262 178.565 0.697 1
1 1342 . 18 1 1 A 120 120 LEU CA C 120 56.605 57.571 -0.966 1
1 1343 . 18 1 1 A 120 120 LEU CB C 120 39.262 41.476 -2.214 1
1 1347 . 18 1 1 A 120 120 LEU N N 120 126.226 122.134 4.092 1
1 1348 . 18 1 1 A 121 121 PHE H H 121 7.356 8.474 -1.118 1
1 1349 . 18 1 1 A 121 121 PHE HA H 121 4.459 4.003 0.456 1
1 1352 . 18 1 1 A 121 121 PHE C C 121 179.716 177.411 2.305 1
1 1353 . 18 1 1 A 121 121 PHE CA C 121 62.838 62.178 0.660 1
1 1354 . 18 1 1 A 121 121 PHE CB C 121 37.603 39.462 -1.859 1
1 1355 . 18 1 1 A 121 121 PHE N N 121 117.437 119.379 -1.942 1
1 1356 . 18 1 1 A 122 122 ALA H H 122 7.926 7.984 -0.058 1
1 1357 . 18 1 1 A 122 122 ALA HA H 122 4.523 3.750 0.773 1
1 1361 . 18 1 1 A 122 122 ALA C C 122 180.435 179.283 1.152 1
1 1362 . 18 1 1 A 122 122 ALA CA C 122 55.527 55.176 0.351 1
1 1363 . 18 1 1 A 122 122 ALA CB C 122 17.814 18.058 -0.244 1
1 1364 . 18 1 1 A 122 122 ALA N N 122 121.068 121.374 -0.306 1
1 1365 . 18 1 1 A 123 123 GLN H H 123 7.507 7.504 0.003 1
1 1366 . 18 1 1 A 123 123 GLN HA H 123 4.153 4.024 0.129 1
1 1371 . 18 1 1 A 123 123 GLN C C 123 180.561 178.728 1.833 1
1 1372 . 18 1 1 A 123 123 GLN CA C 123 59.948 58.500 1.448 1
1 1373 . 18 1 1 A 123 123 GLN CB C 123 29.135 28.168 0.967 1
1 1375 . 18 1 1 A 123 123 GLN N N 123 120.324 117.517 2.807 1
1 1376 . 18 1 1 A 124 124 ILE H H 124 8.318 7.851 0.467 1
1 1377 . 18 1 1 A 124 124 ILE HA H 124 3.635 3.879 -0.244 1
1 1387 . 18 1 1 A 124 124 ILE C C 124 176.481 178.027 -1.546 1
1 1388 . 18 1 1 A 124 124 ILE CA C 124 66.432 64.186 2.246 1
1 1389 . 18 1 1 A 124 124 ILE CB C 124 39.168 37.871 1.297 1
1 1393 . 18 1 1 A 124 124 ILE N N 124 123.747 118.139 5.608 1
1 1394 . 18 1 1 A 125 125 GLN H H 125 8.474 7.861 0.613 1
1 1395 . 18 1 1 A 125 125 GLN HA H 125 4.264 3.908 0.356 1
1 1402 . 18 1 1 A 125 125 GLN C C 125 178.947 177.842 1.105 1
1 1403 . 18 1 1 A 125 125 GLN CA C 125 59.651 58.410 1.241 1
1 1404 . 18 1 1 A 125 125 GLN CB C 125 28.880 28.391 0.489 1
1 1406 . 18 1 1 A 125 125 GLN N N 125 120.368 121.093 -0.725 1
1 1408 . 18 1 1 A 126 126 ALA H H 126 8.002 7.604 0.398 1
1 1409 . 18 1 1 A 126 126 ALA HA H 126 4.144 3.966 0.178 1
1 1413 . 18 1 1 A 126 126 ALA C C 126 179.316 179.937 -0.621 1
1 1414 . 18 1 1 A 126 126 ALA CA C 126 55.036 55.026 0.010 1
1 1415 . 18 1 1 A 126 126 ALA CB C 126 18.087 18.117 -0.030 1
1 1416 . 18 1 1 A 126 126 ALA N N 126 121.661 121.007 0.654 1
1 1417 . 18 1 1 A 127 127 ALA H H 127 7.823 8.313 -0.490 1
1 1418 . 18 1 1 A 127 127 ALA HA H 127 4.162 4.033 0.129 1
1 1422 . 18 1 1 A 127 127 ALA C C 127 180.707 179.488 1.219 1
1 1423 . 18 1 1 A 127 127 ALA CA C 127 55.080 54.913 0.167 1
1 1424 . 18 1 1 A 127 127 ALA CB C 127 19.354 18.245 1.109 1
1 1425 . 18 1 1 A 127 127 ALA N N 127 119.853 120.007 -0.154 1
1 1426 . 18 1 1 A 128 128 ALA H H 128 8.936 7.978 0.958 1
1 1427 . 18 1 1 A 128 128 ALA HA H 128 3.928 3.596 0.332 1
1 1431 . 18 1 1 A 128 128 ALA C C 128 181.031 179.031 2.000 1
1 1432 . 18 1 1 A 128 128 ALA CA C 128 55.502 54.607 0.895 1
1 1433 . 18 1 1 A 128 128 ALA CB C 128 16.609 17.888 -1.279 1
1 1434 . 18 1 1 A 128 128 ALA N N 128 121.355 119.960 1.395 1
1 1435 . 18 1 1 A 129 129 THR H H 129 8.543 7.251 1.292 1
1 1436 . 18 1 1 A 129 129 THR HA H 129 4.015 3.713 0.302 1
1 1441 . 18 1 1 A 129 129 THR C C 129 177.332 176.000 1.332 1
1 1442 . 18 1 1 A 129 129 THR CA C 129 65.893 64.598 1.295 1
1 1443 . 18 1 1 A 129 129 THR CB C 129 68.566 68.574 -0.008 1
1 1445 . 18 1 1 A 129 129 THR N N 129 112.709 111.776 0.933 1
1 1446 . 18 1 1 A 130 130 LYS H H 130 8.126 7.729 0.397 1
1 1447 . 18 1 1 A 130 130 LYS HA H 130 4.000 3.948 0.052 1
1 1456 . 18 1 1 A 130 130 LYS C C 130 179.082 178.700 0.382 1
1 1457 . 18 1 1 A 130 130 LYS CA C 130 60.299 59.049 1.250 1
1 1458 . 18 1 1 A 130 130 LYS CB C 130 32.767 32.276 0.491 1
1 1462 . 18 1 1 A 130 130 LYS N N 130 123.879 120.842 3.037 1
1 1463 . 18 1 1 A 131 131 ALA H H 131 7.184 7.728 -0.544 1
1 1464 . 18 1 1 A 131 131 ALA HA H 131 4.005 4.273 -0.268 1
1 1468 . 18 1 1 A 131 131 ALA C C 131 178.482 179.591 -1.109 1
1 1469 . 18 1 1 A 131 131 ALA CA C 131 55.027 55.231 -0.204 1
1 1470 . 18 1 1 A 131 131 ALA CB C 131 18.669 19.570 -0.901 1
1 1471 . 18 1 1 A 131 131 ALA N N 131 118.590 120.587 -1.997 1
1 1472 . 18 1 1 A 132 132 TRP H H 132 7.977 8.632 -0.655 1
1 1473 . 18 1 1 A 132 132 TRP HA H 132 4.001 4.180 -0.179 1
1 1480 . 18 1 1 A 132 132 TRP C C 132 177.332 175.776 1.556 1
1 1481 . 18 1 1 A 132 132 TRP CA C 132 60.431 57.386 3.045 1
1 1482 . 18 1 1 A 132 132 TRP CB C 132 27.786 27.617 0.169 1
1 1486 . 18 1 1 A 132 132 TRP N N 132 119.168 116.997 2.171 1
1 1488 . 18 1 1 A 133 133 ARG H H 133 8.006 8.054 -0.048 1
1 1489 . 18 1 1 A 133 133 ARG HA H 133 4.027 4.415 -0.388 1
1 1497 . 18 1 1 A 133 133 ARG C C 133 176.664 178.138 -1.474 1
1 1498 . 18 1 1 A 133 133 ARG CA C 133 59.355 57.168 2.187 1
1 1499 . 18 1 1 A 133 133 ARG CB C 133 30.451 32.437 -1.986 1
1 1502 . 18 1 1 A 133 133 ARG N N 133 113.062 120.669 -7.607 1
1 1504 . 18 1 1 A 134 134 LYS H H 134 7.322 7.851 -0.529 1
1 1505 . 18 1 1 A 134 134 LYS HA H 134 4.313 4.276 0.037 1
1 1514 . 18 1 1 A 134 134 LYS C C 134 176.282 176.310 -0.028 1
1 1515 . 18 1 1 A 134 134 LYS CA C 134 54.922 57.420 -2.498 1
1 1516 . 18 1 1 A 134 134 LYS CB C 134 32.633 31.814 0.819 1
1 1520 . 18 1 1 A 134 134 LYS N N 134 118.170 116.512 1.658 1
1 1521 . 18 1 1 A 135 135 LEU H H 135 7.440 8.005 -0.565 1
1 1522 . 18 1 1 A 135 135 LEU HA H 135 4.174 4.418 -0.244 1
1 1532 . 18 1 1 A 135 135 LEU CA C 135 54.408 52.791 1.617 1
1 1533 . 18 1 1 A 135 135 LEU CB C 135 40.407 42.223 -1.816 1
1 1537 . 18 1 1 A 135 135 LEU N N 135 123.358 123.358 0.000 1
1 1538 . 18 1 1 A 136 136 PRO HA H 136 4.437 5.002 -0.565 1
1 1545 . 18 1 1 A 136 136 PRO C C 136 177.106 176.758 0.348 1
1 1546 . 18 1 1 A 136 136 PRO CA C 136 62.889 62.422 0.467 1
1 1547 . 18 1 1 A 136 136 PRO CB C 136 32.192 31.612 0.580 1
1 1550 . 18 1 1 A 137 137 VAL H H 137 8.219 8.303 -0.084 1
1 1551 . 18 1 1 A 137 137 VAL HA H 137 4.077 4.236 -0.159 1
1 1559 . 18 1 1 A 137 137 VAL C C 137 176.305 173.881 2.424 1
1 1560 . 18 1 1 A 137 137 VAL CA C 137 61.958 63.056 -1.098 1
1 1561 . 18 1 1 A 137 137 VAL CB C 137 32.755 30.736 2.019 1
1 1564 . 18 1 1 A 137 137 VAL N N 137 120.079 116.641 3.438 1
1 1565 . 18 1 1 A 138 138 LYS H H 138 8.444 8.571 -0.127 1
1 1566 . 18 1 1 A 138 138 LYS HA H 138 4.316 5.331 -1.015 1
1 1575 . 18 1 1 A 138 138 LYS C C 138 176.790 175.639 1.151 1
1 1576 . 18 1 1 A 138 138 LYS CA C 138 56.792 54.856 1.936 1
1 1577 . 18 1 1 A 138 138 LYS CB C 138 33.205 34.204 -0.999 1
1 1581 . 18 1 1 A 138 138 LYS N N 138 126.449 127.938 -1.489 1
1 1582 . 18 1 1 A 139 139 GLY H H 139 8.518 8.398 0.120 1
1 1583 . 18 1 1 A 139 139 GLY HA2 H 139 4.070 4.148 -0.078 1
1 1584 . 18 1 1 A 139 139 GLY HA3 H 139 3.897 4.152 -0.255 1
1 1585 . 18 1 1 A 139 139 GLY C C 139 172.874 174.329 -1.455 1
1 1586 . 18 1 1 A 139 139 GLY CA C 139 45.157 45.656 -0.499 1
1 1587 . 18 1 1 A 139 139 GLY N N 139 112.617 114.202 -1.585 1
1 6 . 19 1 1 A 2 2 VAL H H 2 8.992 8.828 0.164 1
1 7 . 19 1 1 A 2 2 VAL HA H 2 5.370 4.812 0.558 1
1 15 . 19 1 1 A 2 2 VAL C C 2 174.325 174.890 -0.565 1
1 16 . 19 1 1 A 2 2 VAL CA C 2 61.267 60.962 0.305 1
1 17 . 19 1 1 A 2 2 VAL CB C 2 33.890 34.207 -0.317 1
1 20 . 19 1 1 A 2 2 VAL N N 2 126.939 120.185 6.754 1
1 21 . 19 1 1 A 3 3 THR H H 3 8.912 8.766 0.146 1
1 22 . 19 1 1 A 3 3 THR HA H 3 4.505 4.979 -0.474 1
1 27 . 19 1 1 A 3 3 THR C C 3 172.710 172.868 -0.158 1
1 28 . 19 1 1 A 3 3 THR CA C 3 59.689 59.632 0.057 1
1 29 . 19 1 1 A 3 3 THR CB C 3 72.398 71.702 0.696 1
1 31 . 19 1 1 A 3 3 THR N N 3 118.091 120.100 -2.009 1
1 32 . 19 1 1 A 4 4 GLU H H 4 8.631 8.849 -0.218 1
1 33 . 19 1 1 A 4 4 GLU HA H 4 5.788 5.324 0.464 1
1 38 . 19 1 1 A 4 4 GLU C C 4 175.758 174.583 1.175 1
1 39 . 19 1 1 A 4 4 GLU CA C 4 54.902 55.167 -0.265 1
1 40 . 19 1 1 A 4 4 GLU CB C 4 35.097 32.870 2.227 1
1 42 . 19 1 1 A 4 4 GLU N N 4 120.966 122.082 -1.116 1
1 43 . 19 1 1 A 5 5 THR H H 5 9.188 8.955 0.233 1
1 44 . 19 1 1 A 5 5 THR HA H 5 4.739 5.161 -0.422 1
1 49 . 19 1 1 A 5 5 THR C C 5 172.757 173.248 -0.491 1
1 50 . 19 1 1 A 5 5 THR CA C 5 60.382 60.424 -0.042 1
1 51 . 19 1 1 A 5 5 THR CB C 5 71.558 71.075 0.483 1
1 53 . 19 1 1 A 5 5 THR N N 5 119.366 115.988 3.378 1
1 54 . 19 1 1 A 6 6 VAL H H 6 8.476 9.185 -0.709 1
1 55 . 19 1 1 A 6 6 VAL HA H 6 5.026 5.073 -0.047 1
1 63 . 19 1 1 A 6 6 VAL C C 6 176.674 173.381 3.293 1
1 64 . 19 1 1 A 6 6 VAL CA C 6 61.008 58.711 2.297 1
1 65 . 19 1 1 A 6 6 VAL CB C 6 33.861 35.148 -1.287 1
1 68 . 19 1 1 A 6 6 VAL N N 6 121.384 122.680 -1.296 1
1 69 . 19 1 1 A 7 7 ASP H H 7 8.848 8.426 0.422 1
1 70 . 19 1 1 A 7 7 ASP HA H 7 4.797 5.170 -0.373 1
1 73 . 19 1 1 A 7 7 ASP CA C 7 52.834 52.290 0.544 1
1 74 . 19 1 1 A 7 7 ASP CB C 7 42.219 44.020 -1.801 1
1 75 . 19 1 1 A 7 7 ASP N N 7 127.061 122.584 4.477 1
1 76 . 19 1 1 A 8 8 GLY C C 8 175.143 174.922 0.221 1
1 77 . 19 1 1 A 8 8 GLY CA C 8 46.553 46.920 -0.367 1
1 78 . 19 1 1 A 9 9 GLN H H 9 8.408 7.423 0.985 1
1 79 . 19 1 1 A 9 9 GLN HA H 9 4.541 4.383 0.158 1
1 86 . 19 1 1 A 9 9 GLN C C 9 176.463 176.183 0.280 1
1 87 . 19 1 1 A 9 9 GLN CA C 9 55.167 55.594 -0.427 1
1 88 . 19 1 1 A 9 9 GLN CB C 9 29.376 29.307 0.069 1
1 90 . 19 1 1 A 9 9 GLN N N 9 118.300 117.820 0.480 1
1 92 . 19 1 1 A 10 10 GLY H H 10 8.162 8.191 -0.029 1
1 93 . 19 1 1 A 10 10 GLY HA2 H 10 4.174 3.866 0.308 1
1 94 . 19 1 1 A 10 10 GLY HA3 H 10 3.521 3.868 -0.347 1
1 95 . 19 1 1 A 10 10 GLY C C 10 174.092 174.243 -0.151 1
1 96 . 19 1 1 A 10 10 GLY CA C 10 45.558 45.550 0.008 1
1 97 . 19 1 1 A 10 10 GLY N N 10 108.747 108.503 0.244 1
1 98 . 19 1 1 A 11 11 GLN H H 11 8.507 7.877 0.630 1
1 99 . 19 1 1 A 11 11 GLN HA H 11 4.202 4.269 -0.067 1
1 106 . 19 1 1 A 11 11 GLN C C 11 173.992 174.739 -0.747 1
1 107 . 19 1 1 A 11 11 GLN CA C 11 55.098 54.950 0.148 1
1 108 . 19 1 1 A 11 11 GLN CB C 11 29.097 29.127 -0.030 1
1 110 . 19 1 1 A 11 11 GLN N N 11 122.979 119.861 3.118 1
1 112 . 19 1 1 A 12 12 ALA H H 12 8.259 8.483 -0.224 1
1 113 . 19 1 1 A 12 12 ALA HA H 12 5.156 5.241 -0.085 1
1 117 . 19 1 1 A 12 12 ALA C C 12 177.284 175.766 1.518 1
1 118 . 19 1 1 A 12 12 ALA CA C 12 51.087 49.827 1.260 1
1 119 . 19 1 1 A 12 12 ALA CB C 12 20.500 22.196 -1.696 1
1 120 . 19 1 1 A 12 12 ALA N N 12 127.100 127.247 -0.147 1
1 121 . 19 1 1 A 13 13 TRP H H 13 9.245 9.011 0.234 1
1 122 . 19 1 1 A 13 13 TRP HA H 13 4.717 5.368 -0.651 1
1 131 . 19 1 1 A 13 13 TRP C C 13 175.108 175.258 -0.150 1
1 132 . 19 1 1 A 13 13 TRP CA C 13 55.966 55.790 0.176 1
1 133 . 19 1 1 A 13 13 TRP CB C 13 31.912 34.829 -2.917 1
1 139 . 19 1 1 A 13 13 TRP N N 13 123.088 120.634 2.454 1
1 141 . 19 1 1 A 14 14 ARG H H 14 8.575 9.135 -0.560 1
1 142 . 19 1 1 A 14 14 ARG HA H 14 5.335 5.395 -0.060 1
1 150 . 19 1 1 A 14 14 ARG C C 14 175.191 174.527 0.664 1
1 151 . 19 1 1 A 14 14 ARG CA C 14 53.106 54.981 -1.875 1
1 152 . 19 1 1 A 14 14 ARG CB C 14 32.749 34.468 -1.719 1
1 154 . 19 1 1 A 14 14 ARG N N 14 121.163 118.890 2.273 1
1 156 . 19 1 1 A 15 15 HIS H H 15 8.595 9.309 -0.714 1
1 157 . 19 1 1 A 15 15 HIS HA H 15 4.790 5.443 -0.653 1
1 161 . 19 1 1 A 15 15 HIS C C 15 173.770 172.850 0.920 1
1 162 . 19 1 1 A 15 15 HIS CA C 15 55.289 54.172 1.117 1
1 163 . 19 1 1 A 15 15 HIS CB C 15 33.208 32.991 0.217 1
1 165 . 19 1 1 A 15 15 HIS N N 15 117.643 115.835 1.808 1
1 166 . 19 1 1 A 16 16 HIS H H 16 8.993 8.913 0.080 1
1 167 . 19 1 1 A 16 16 HIS HA H 16 5.158 4.993 0.165 1
1 171 . 19 1 1 A 16 16 HIS C C 16 173.608 174.741 -1.133 1
1 172 . 19 1 1 A 16 16 HIS CA C 16 56.450 54.010 2.440 1
1 173 . 19 1 1 A 16 16 HIS CB C 16 34.171 31.345 2.826 1
1 175 . 19 1 1 A 16 16 HIS N N 16 123.520 118.255 5.265 1
1 176 . 19 1 1 A 17 17 ASN H H 17 7.829 9.431 -1.602 1
1 177 . 19 1 1 A 17 17 ASN HA H 17 4.713 5.166 -0.453 1
1 182 . 19 1 1 A 17 17 ASN C C 17 173.682 175.857 -2.175 1
1 183 . 19 1 1 A 17 17 ASN CA C 17 51.822 51.783 0.039 1
1 184 . 19 1 1 A 17 17 ASN CB C 17 43.176 41.575 1.601 1
1 185 . 19 1 1 A 17 17 ASN N N 17 122.213 119.966 2.247 1
1 187 . 19 1 1 A 18 18 GLY H H 18 8.423 8.381 0.042 1
1 188 . 19 1 1 A 18 18 GLY HA2 H 18 3.931 3.720 0.211 1
1 189 . 19 1 1 A 18 18 GLY HA3 H 18 3.707 3.947 -0.240 1
1 190 . 19 1 1 A 18 18 GLY C C 18 173.985 173.005 0.980 1
1 191 . 19 1 1 A 18 18 GLY CA C 18 43.949 44.886 -0.937 1
1 192 . 19 1 1 A 18 18 GLY N N 18 106.991 107.877 -0.886 1
1 193 . 19 1 1 A 19 19 PHE H H 19 8.338 8.171 0.167 1
1 194 . 19 1 1 A 19 19 PHE HA H 19 4.068 4.657 -0.589 1
1 197 . 19 1 1 A 19 19 PHE C C 19 176.568 174.929 1.639 1
1 198 . 19 1 1 A 19 19 PHE CA C 19 59.338 58.932 0.406 1
1 199 . 19 1 1 A 19 19 PHE CB C 19 40.201 39.016 1.185 1
1 200 . 19 1 1 A 19 19 PHE N N 19 116.857 119.140 -2.283 1
1 201 . 19 1 1 A 20 20 ASP H H 20 8.794 8.972 -0.178 1
1 202 . 19 1 1 A 20 20 ASP HA H 20 4.485 4.731 -0.246 1
1 205 . 19 1 1 A 20 20 ASP C C 20 177.379 176.943 0.436 1
1 206 . 19 1 1 A 20 20 ASP CA C 20 54.140 55.083 -0.943 1
1 207 . 19 1 1 A 20 20 ASP CB C 20 41.915 40.599 1.316 1
1 208 . 19 1 1 A 20 20 ASP N N 20 123.025 125.550 -2.525 1
1 209 . 19 1 1 A 21 21 PHE H H 21 8.862 9.089 -0.227 1
1 210 . 19 1 1 A 21 21 PHE HA H 21 4.087 4.101 -0.014 1
1 218 . 19 1 1 A 21 21 PHE C C 21 176.952 177.234 -0.282 1
1 219 . 19 1 1 A 21 21 PHE CA C 21 61.095 62.293 -1.198 1
1 220 . 19 1 1 A 21 21 PHE CB C 21 38.678 39.349 -0.671 1
1 226 . 19 1 1 A 21 21 PHE N N 21 127.163 125.858 1.305 1
1 227 . 19 1 1 A 22 22 ALA H H 22 8.561 8.409 0.152 1
1 228 . 19 1 1 A 22 22 ALA HA H 22 3.878 4.045 -0.167 1
1 232 . 19 1 1 A 22 22 ALA C C 22 180.710 180.011 0.699 1
1 233 . 19 1 1 A 22 22 ALA CA C 22 55.211 55.290 -0.079 1
1 234 . 19 1 1 A 22 22 ALA CB C 22 18.321 18.545 -0.224 1
1 235 . 19 1 1 A 22 22 ALA N N 22 120.293 121.231 -0.938 1
1 236 . 19 1 1 A 23 23 VAL H H 23 7.241 7.684 -0.443 1
1 237 . 19 1 1 A 23 23 VAL HA H 23 3.684 3.517 0.167 1
1 245 . 19 1 1 A 23 23 VAL C C 23 177.101 178.260 -1.159 1
1 246 . 19 1 1 A 23 23 VAL CA C 23 65.237 67.004 -1.767 1
1 247 . 19 1 1 A 23 23 VAL CB C 23 31.780 31.559 0.221 1
1 250 . 19 1 1 A 23 23 VAL N N 23 118.775 117.699 1.076 1
1 251 . 19 1 1 A 24 24 ILE H H 24 6.761 7.956 -1.195 1
1 252 . 19 1 1 A 24 24 ILE HA H 24 3.196 3.500 -0.304 1
1 262 . 19 1 1 A 24 24 ILE C C 24 177.287 178.246 -0.959 1
1 263 . 19 1 1 A 24 24 ILE CA C 24 63.404 65.698 -2.294 1
1 264 . 19 1 1 A 24 24 ILE CB C 24 36.294 37.782 -1.488 1
1 268 . 19 1 1 A 24 24 ILE N N 24 119.036 119.511 -0.475 1
1 269 . 19 1 1 A 25 25 LYS H H 25 8.032 8.153 -0.121 1
1 270 . 19 1 1 A 25 25 LYS HA H 25 3.809 3.683 0.126 1
1 279 . 19 1 1 A 25 25 LYS C C 25 179.450 179.001 0.449 1
1 280 . 19 1 1 A 25 25 LYS CA C 25 59.621 59.450 0.171 1
1 281 . 19 1 1 A 25 25 LYS CB C 25 32.259 31.931 0.328 1
1 285 . 19 1 1 A 25 25 LYS N N 25 118.368 120.337 -1.969 1
1 286 . 19 1 1 A 26 26 GLU H H 26 7.845 8.017 -0.172 1
1 287 . 19 1 1 A 26 26 GLU HA H 26 4.021 4.111 -0.090 1
1 292 . 19 1 1 A 26 26 GLU C C 26 179.191 179.457 -0.266 1
1 293 . 19 1 1 A 26 26 GLU CA C 26 59.530 59.213 0.317 1
1 294 . 19 1 1 A 26 26 GLU CB C 26 29.449 29.215 0.234 1
1 296 . 19 1 1 A 26 26 GLU N N 26 120.522 119.339 1.183 1
1 297 . 19 1 1 A 27 27 LEU H H 27 8.165 8.240 -0.075 1
1 298 . 19 1 1 A 27 27 LEU HA H 27 4.163 4.179 -0.016 1
1 308 . 19 1 1 A 27 27 LEU C C 27 177.256 178.341 -1.085 1
1 309 . 19 1 1 A 27 27 LEU CA C 27 58.049 57.700 0.349 1
1 310 . 19 1 1 A 27 27 LEU CB C 27 41.365 41.566 -0.201 1
1 314 . 19 1 1 A 27 27 LEU N N 27 120.879 122.134 -1.255 1
1 315 . 19 1 1 A 28 28 LYS H H 28 8.902 7.983 0.919 1
1 316 . 19 1 1 A 28 28 LYS HA H 28 4.199 4.513 -0.314 1
1 317 . 19 1 1 A 28 28 LYS C C 28 179.707 179.284 0.423 1
1 318 . 19 1 1 A 28 28 LYS CA C 28 60.097 58.917 1.180 1
1 319 . 19 1 1 A 28 28 LYS CB C 28 33.420 31.610 1.810 1
1 320 . 19 1 1 A 28 28 LYS N N 28 120.050 119.318 0.732 1
1 321 . 19 1 1 A 29 29 THR H H 29 8.294 8.134 0.160 1
1 322 . 19 1 1 A 29 29 THR HA H 29 3.892 3.873 0.019 1
1 327 . 19 1 1 A 29 29 THR C C 29 175.711 176.323 -0.612 1
1 328 . 19 1 1 A 29 29 THR CA C 29 66.846 66.470 0.376 1
1 329 . 19 1 1 A 29 29 THR CB C 29 68.794 68.747 0.047 1
1 331 . 19 1 1 A 29 29 THR N N 29 115.933 116.871 -0.938 1
1 332 . 19 1 1 A 30 30 ALA H H 30 8.244 8.802 -0.558 1
1 333 . 19 1 1 A 30 30 ALA HA H 30 4.241 4.094 0.147 1
1 337 . 19 1 1 A 30 30 ALA C C 30 179.128 179.451 -0.323 1
1 338 . 19 1 1 A 30 30 ALA CA C 30 55.714 55.736 -0.022 1
1 339 . 19 1 1 A 30 30 ALA CB C 30 18.955 18.336 0.619 1
1 340 . 19 1 1 A 30 30 ALA N N 30 124.617 123.127 1.490 1
1 341 . 19 1 1 A 31 31 ALA H H 31 8.968 8.510 0.458 1
1 342 . 19 1 1 A 31 31 ALA HA H 31 3.890 4.067 -0.177 1
1 346 . 19 1 1 A 31 31 ALA C C 31 180.352 179.300 1.052 1
1 347 . 19 1 1 A 31 31 ALA CA C 31 55.454 54.892 0.562 1
1 348 . 19 1 1 A 31 31 ALA CB C 31 17.124 18.274 -1.150 1
1 349 . 19 1 1 A 31 31 ALA N N 31 119.327 120.280 -0.953 1
1 350 . 19 1 1 A 32 32 SER H H 32 7.995 7.478 0.517 1
1 351 . 19 1 1 A 32 32 SER HA H 32 4.238 4.200 0.038 1
1 354 . 19 1 1 A 32 32 SER C C 32 175.612 177.070 -1.458 1
1 355 . 19 1 1 A 32 32 SER CA C 32 61.203 61.319 -0.116 1
1 356 . 19 1 1 A 32 32 SER CB C 32 63.406 62.760 0.646 1
1 357 . 19 1 1 A 32 32 SER N N 32 111.962 113.222 -1.260 1
1 358 . 19 1 1 A 33 33 GLN H H 33 8.333 7.337 0.996 1
1 359 . 19 1 1 A 33 33 GLN HA H 33 3.992 4.095 -0.103 1
1 366 . 19 1 1 A 33 33 GLN C C 33 177.486 177.313 0.173 1
1 367 . 19 1 1 A 33 33 GLN CA C 33 58.277 57.901 0.376 1
1 368 . 19 1 1 A 33 33 GLN CB C 33 29.140 29.215 -0.075 1
1 370 . 19 1 1 A 33 33 GLN N N 33 119.527 120.528 -1.001 1
1 372 . 19 1 1 A 34 34 TYR H H 34 8.587 7.951 0.636 1
1 373 . 19 1 1 A 34 34 TYR HA H 34 4.792 4.568 0.224 1
1 380 . 19 1 1 A 34 34 TYR C C 34 176.499 176.727 -0.228 1
1 381 . 19 1 1 A 34 34 TYR CA C 34 57.711 59.995 -2.284 1
1 382 . 19 1 1 A 34 34 TYR CB C 34 39.561 39.897 -0.336 1
1 387 . 19 1 1 A 34 34 TYR N N 34 114.610 116.285 -1.675 1
1 388 . 19 1 1 A 35 35 GLY H H 35 7.346 8.939 -1.593 1
1 389 . 19 1 1 A 35 35 GLY HA2 H 35 4.785 3.937 0.848 1
1 390 . 19 1 1 A 35 35 GLY HA3 H 35 4.007 3.960 0.047 1
1 391 . 19 1 1 A 35 35 GLY C C 35 175.796 174.230 1.566 1
1 392 . 19 1 1 A 35 35 GLY CA C 35 44.355 46.650 -2.295 1
1 393 . 19 1 1 A 35 35 GLY N N 35 108.501 107.973 0.528 1
1 394 . 19 1 1 A 36 36 ALA H H 36 9.363 8.400 0.963 1
1 395 . 19 1 1 A 36 36 ALA HA H 36 4.217 4.204 0.013 1
1 399 . 19 1 1 A 36 36 ALA C C 36 178.039 177.948 0.091 1
1 400 . 19 1 1 A 36 36 ALA CA C 36 56.114 53.294 2.820 1
1 401 . 19 1 1 A 36 36 ALA CB C 36 19.179 18.423 0.756 1
1 402 . 19 1 1 A 36 36 ALA N N 36 125.811 127.404 -1.593 1
1 403 . 19 1 1 A 37 37 THR H H 37 8.070 8.812 -0.742 1
1 404 . 19 1 1 A 37 37 THR HA H 37 4.570 4.255 0.315 1
1 409 . 19 1 1 A 37 37 THR C C 37 173.685 174.048 -0.363 1
1 410 . 19 1 1 A 37 37 THR CA C 37 59.822 63.862 -4.040 1
1 411 . 19 1 1 A 37 37 THR CB C 37 68.267 66.891 1.376 1
1 413 . 19 1 1 A 37 37 THR N N 37 129.410 116.435 12.975 1
1 414 . 19 1 1 A 38 38 ALA H H 38 6.853 7.313 -0.460 1
1 415 . 19 1 1 A 38 38 ALA HA H 38 4.601 4.516 0.085 1
1 419 . 19 1 1 A 38 38 ALA CA C 38 50.758 50.606 0.152 1
1 420 . 19 1 1 A 38 38 ALA CB C 38 18.325 19.847 -1.522 1
1 421 . 19 1 1 A 38 38 ALA N N 38 124.674 125.146 -0.472 1
1 422 . 19 1 1 A 40 40 TYR HA H 40 4.032 4.053 -0.021 1
1 429 . 19 1 1 A 40 40 TYR C C 40 176.456 177.353 -0.897 1
1 430 . 19 1 1 A 40 40 TYR CA C 40 61.010 61.821 -0.811 1
1 431 . 19 1 1 A 40 40 TYR CB C 40 39.286 38.798 0.488 1
1 436 . 19 1 1 A 41 41 THR H H 41 6.874 8.011 -1.137 1
1 437 . 19 1 1 A 41 41 THR HA H 41 3.616 3.868 -0.252 1
1 442 . 19 1 1 A 41 41 THR C C 41 176.930 176.587 0.343 1
1 443 . 19 1 1 A 41 41 THR CA C 41 65.557 65.550 0.007 1
1 444 . 19 1 1 A 41 41 THR CB C 41 68.228 69.214 -0.986 1
1 446 . 19 1 1 A 41 41 THR N N 41 115.143 114.042 1.101 1
1 447 . 19 1 1 A 42 42 LEU H H 42 8.623 7.391 1.232 1
1 448 . 19 1 1 A 42 42 LEU HA H 42 3.708 4.057 -0.349 1
1 458 . 19 1 1 A 42 42 LEU C C 42 178.206 178.981 -0.775 1
1 459 . 19 1 1 A 42 42 LEU CA C 42 57.417 57.770 -0.353 1
1 460 . 19 1 1 A 42 42 LEU CB C 42 41.342 41.231 0.111 1
1 464 . 19 1 1 A 42 42 LEU N N 42 120.418 118.725 1.693 1
1 465 . 19 1 1 A 43 43 ALA H H 43 7.735 7.833 -0.098 1
1 466 . 19 1 1 A 43 43 ALA HA H 43 4.020 3.977 0.043 1
1 470 . 19 1 1 A 43 43 ALA C C 43 180.826 180.648 0.178 1
1 471 . 19 1 1 A 43 43 ALA CA C 43 54.925 55.029 -0.104 1
1 472 . 19 1 1 A 43 43 ALA CB C 43 17.506 18.347 -0.841 1
1 473 . 19 1 1 A 43 43 ALA N N 43 120.203 121.836 -1.633 1
1 474 . 19 1 1 A 44 44 ILE H H 44 7.149 7.381 -0.232 1
1 475 . 19 1 1 A 44 44 ILE HA H 44 3.603 3.606 -0.003 1
1 485 . 19 1 1 A 44 44 ILE C C 44 178.594 177.775 0.819 1
1 486 . 19 1 1 A 44 44 ILE CA C 44 64.782 64.633 0.149 1
1 487 . 19 1 1 A 44 44 ILE CB C 44 37.472 37.652 -0.180 1
1 491 . 19 1 1 A 44 44 ILE N N 44 118.881 119.570 -0.689 1
1 492 . 19 1 1 A 45 45 VAL H H 45 7.968 7.766 0.202 1
1 493 . 19 1 1 A 45 45 VAL HA H 45 2.925 3.363 -0.438 1
1 501 . 19 1 1 A 45 45 VAL C C 45 177.023 178.081 -1.058 1
1 502 . 19 1 1 A 45 45 VAL CA C 45 67.081 67.037 0.044 1
1 503 . 19 1 1 A 45 45 VAL CB C 45 30.854 31.312 -0.458 1
1 506 . 19 1 1 A 45 45 VAL N N 45 120.764 119.914 0.850 1
1 507 . 19 1 1 A 46 46 GLU H H 46 8.399 8.155 0.244 1
1 508 . 19 1 1 A 46 46 GLU HA H 46 3.848 3.979 -0.131 1
1 513 . 19 1 1 A 46 46 GLU C C 46 178.656 178.546 0.110 1
1 514 . 19 1 1 A 46 46 GLU CA C 46 59.491 58.690 0.801 1
1 515 . 19 1 1 A 46 46 GLU CB C 46 28.991 28.148 0.843 1
1 517 . 19 1 1 A 46 46 GLU N N 46 116.599 119.573 -2.974 1
1 518 . 19 1 1 A 47 47 SER H H 47 7.273 7.575 -0.302 1
1 519 . 19 1 1 A 47 47 SER HA H 47 4.287 4.153 0.134 1
1 521 . 19 1 1 A 47 47 SER CA C 47 61.047 61.056 -0.009 1
1 522 . 19 1 1 A 47 47 SER CB C 47 63.016 62.918 0.098 1
1 523 . 19 1 1 A 47 47 SER N N 47 113.609 115.910 -2.301 1
1 524 . 19 1 1 A 48 48 VAL H H 48 8.006 7.954 0.052 1
1 525 . 19 1 1 A 48 48 VAL HA H 48 3.556 3.646 -0.090 1
1 533 . 19 1 1 A 48 48 VAL C C 48 177.257 176.491 0.766 1
1 534 . 19 1 1 A 48 48 VAL CA C 48 65.025 65.830 -0.805 1
1 535 . 19 1 1 A 48 48 VAL CB C 48 31.841 31.213 0.628 1
1 538 . 19 1 1 A 48 48 VAL N N 48 122.327 121.145 1.182 1
1 539 . 19 1 1 A 49 49 ALA H H 49 8.369 7.518 0.851 1
1 540 . 19 1 1 A 49 49 ALA HA H 49 4.115 4.230 -0.115 1
1 544 . 19 1 1 A 49 49 ALA C C 49 177.307 177.685 -0.378 1
1 545 . 19 1 1 A 49 49 ALA CA C 49 53.253 52.343 0.910 1
1 546 . 19 1 1 A 49 49 ALA CB C 49 20.131 18.675 1.456 1
1 547 . 19 1 1 A 49 49 ALA N N 49 118.050 120.663 -2.613 1
1 548 . 19 1 1 A 50 50 ASP H H 50 7.052 7.842 -0.790 1
1 549 . 19 1 1 A 50 50 ASP HA H 50 4.788 4.621 0.167 1
1 552 . 19 1 1 A 50 50 ASP C C 50 175.481 175.821 -0.340 1
1 553 . 19 1 1 A 50 50 ASP CA C 50 53.681 55.264 -1.583 1
1 554 . 19 1 1 A 50 50 ASP CB C 50 39.333 41.243 -1.910 1
1 555 . 19 1 1 A 50 50 ASP N N 50 116.997 117.233 -0.236 1
1 556 . 19 1 1 A 51 51 ASN H H 51 8.535 7.664 0.871 1
1 557 . 19 1 1 A 51 51 ASN HA H 51 4.628 4.842 -0.214 1
1 562 . 19 1 1 A 51 51 ASN C C 51 174.077 175.195 -1.118 1
1 563 . 19 1 1 A 51 51 ASN CA C 51 52.315 51.208 1.107 1
1 564 . 19 1 1 A 51 51 ASN CB C 51 41.928 40.252 1.676 1
1 565 . 19 1 1 A 51 51 ASN N N 51 118.626 114.782 3.844 1
1 567 . 19 1 1 A 52 52 TRP H H 52 8.555 8.253 0.302 1
1 574 . 19 1 1 A 52 52 TRP C C 52 173.269 176.401 -3.132 1
1 575 . 19 1 1 A 52 52 TRP CA C 52 55.031 57.119 -2.088 1
1 576 . 19 1 1 A 52 52 TRP CB C 52 26.801 29.962 -3.161 1
1 582 . 19 1 1 A 52 52 TRP N N 52 120.693 121.258 -0.565 1
1 584 . 19 1 1 A 53 53 LEU H H 53 7.847 9.006 -1.159 1
1 585 . 19 1 1 A 53 53 LEU HA H 53 4.859 5.230 -0.371 1
1 595 . 19 1 1 A 53 53 LEU C C 53 177.397 175.118 2.279 1
1 596 . 19 1 1 A 53 53 LEU CA C 53 53.619 53.184 0.435 1
1 597 . 19 1 1 A 53 53 LEU CB C 53 41.812 46.117 -4.305 1
1 601 . 19 1 1 A 53 53 LEU N N 53 124.741 120.595 4.146 1
1 602 . 19 1 1 A 54 54 THR H H 54 8.850 8.573 0.277 1
1 603 . 19 1 1 A 54 54 THR HA H 54 4.598 4.697 -0.099 1
1 608 . 19 1 1 A 54 54 THR CA C 54 60.531 58.556 1.975 1
1 609 . 19 1 1 A 54 54 THR CB C 54 67.183 70.322 -3.139 1
1 611 . 19 1 1 A 54 54 THR N N 54 113.407 109.232 4.175 1
1 612 . 19 1 1 A 55 55 PRO HA H 55 4.511 4.268 0.243 1
1 619 . 19 1 1 A 55 55 PRO C C 55 179.383 178.551 0.832 1
1 620 . 19 1 1 A 55 55 PRO CA C 55 67.159 64.690 2.469 1
1 621 . 19 1 1 A 55 55 PRO CB C 55 32.095 31.858 0.237 1
1 622 . 19 1 1 A 56 56 THR H H 56 8.575 7.709 0.866 1
1 623 . 19 1 1 A 56 56 THR HA H 56 4.229 4.077 0.152 1
1 628 . 19 1 1 A 56 56 THR C C 56 176.668 176.336 0.332 1
1 629 . 19 1 1 A 56 56 THR CA C 56 66.943 65.956 0.987 1
1 630 . 19 1 1 A 56 56 THR CB C 56 68.129 68.007 0.122 1
1 632 . 19 1 1 A 56 56 THR N N 56 114.855 112.002 2.853 1
1 633 . 19 1 1 A 57 57 ASP H H 57 8.730 8.179 0.551 1
1 634 . 19 1 1 A 57 57 ASP HA H 57 4.425 4.637 -0.212 1
1 637 . 19 1 1 A 57 57 ASP C C 57 178.351 179.285 -0.934 1
1 638 . 19 1 1 A 57 57 ASP CA C 57 57.963 57.694 0.269 1
1 639 . 19 1 1 A 57 57 ASP CB C 57 40.134 40.774 -0.640 1
1 640 . 19 1 1 A 57 57 ASP N N 57 126.239 120.675 5.564 1
1 641 . 19 1 1 A 58 58 TRP H H 58 8.244 8.269 -0.025 1
1 642 . 19 1 1 A 58 58 TRP HA H 58 4.030 4.497 -0.467 1
1 650 . 19 1 1 A 58 58 TRP C C 58 177.432 178.947 -1.515 1
1 651 . 19 1 1 A 58 58 TRP CA C 58 62.731 60.141 2.590 1
1 652 . 19 1 1 A 58 58 TRP CB C 58 29.122 29.261 -0.139 1
1 657 . 19 1 1 A 58 58 TRP N N 58 119.241 120.536 -1.295 1
1 659 . 19 1 1 A 59 59 ASN H H 59 8.098 8.743 -0.645 1
1 660 . 19 1 1 A 59 59 ASN HA H 59 4.424 4.489 -0.065 1
1 663 . 19 1 1 A 59 59 ASN C C 59 176.952 178.030 -1.078 1
1 664 . 19 1 1 A 59 59 ASN CA C 59 58.135 56.515 1.620 1
1 665 . 19 1 1 A 59 59 ASN CB C 59 40.168 39.744 0.424 1
1 666 . 19 1 1 A 59 59 ASN N N 59 115.747 117.712 -1.965 1
1 667 . 19 1 1 A 60 60 THR H H 60 8.712 7.792 0.920 1
1 668 . 19 1 1 A 60 60 THR HA H 60 3.717 3.925 -0.208 1
1 673 . 19 1 1 A 60 60 THR C C 60 176.044 176.616 -0.572 1
1 674 . 19 1 1 A 60 60 THR CA C 60 66.576 67.095 -0.519 1
1 675 . 19 1 1 A 60 60 THR CB C 60 69.251 67.360 1.891 1
1 677 . 19 1 1 A 60 60 THR N N 60 114.896 116.294 -1.398 1
1 678 . 19 1 1 A 61 61 LEU H H 61 8.485 8.411 0.074 1
1 679 . 19 1 1 A 61 61 LEU HA H 61 3.391 4.028 -0.637 1
1 689 . 19 1 1 A 61 61 LEU C C 61 177.433 178.639 -1.206 1
1 690 . 19 1 1 A 61 61 LEU CA C 61 58.354 58.630 -0.276 1
1 691 . 19 1 1 A 61 61 LEU CB C 61 41.761 42.330 -0.569 1
1 695 . 19 1 1 A 61 61 LEU N N 61 123.433 121.966 1.467 1
1 696 . 19 1 1 A 62 62 VAL H H 62 8.073 8.408 -0.335 1
1 697 . 19 1 1 A 62 62 VAL HA H 62 3.207 3.827 -0.620 1
1 705 . 19 1 1 A 62 62 VAL C C 62 177.585 178.112 -0.527 1
1 706 . 19 1 1 A 62 62 VAL CA C 62 67.345 65.273 2.072 1
1 707 . 19 1 1 A 62 62 VAL CB C 62 30.905 30.484 0.421 1
1 710 . 19 1 1 A 62 62 VAL N N 62 116.018 118.307 -2.289 1
1 711 . 19 1 1 A 63 63 ARG H H 63 7.765 7.874 -0.109 1
1 712 . 19 1 1 A 63 63 ARG HA H 63 3.602 3.845 -0.243 1
1 719 . 19 1 1 A 63 63 ARG C C 63 177.818 178.130 -0.312 1
1 720 . 19 1 1 A 63 63 ARG CA C 63 58.049 59.486 -1.437 1
1 721 . 19 1 1 A 63 63 ARG CB C 63 29.955 30.070 -0.115 1
1 724 . 19 1 1 A 63 63 ARG N N 63 116.700 121.746 -5.046 1
1 725 . 19 1 1 A 64 64 ALA H H 64 7.574 7.649 -0.075 1
1 726 . 19 1 1 A 64 64 ALA HA H 64 4.158 4.359 -0.201 1
1 730 . 19 1 1 A 64 64 ALA C C 64 179.886 179.579 0.307 1
1 731 . 19 1 1 A 64 64 ALA CA C 64 54.007 53.759 0.248 1
1 732 . 19 1 1 A 64 64 ALA CB C 64 19.147 19.883 -0.736 1
1 733 . 19 1 1 A 64 64 ALA N N 64 117.555 121.106 -3.551 1
1 734 . 19 1 1 A 65 65 VAL H H 65 7.554 8.021 -0.467 1
1 735 . 19 1 1 A 65 65 VAL HA H 65 4.253 3.814 0.439 1
1 743 . 19 1 1 A 65 65 VAL C C 65 174.180 176.249 -2.069 1
1 744 . 19 1 1 A 65 65 VAL CA C 65 62.683 65.454 -2.771 1
1 745 . 19 1 1 A 65 65 VAL CB C 65 33.458 31.318 2.140 1
1 748 . 19 1 1 A 65 65 VAL N N 65 110.013 115.350 -5.337 1
1 749 . 19 1 1 A 66 66 LEU H H 66 7.792 7.100 0.692 1
1 750 . 19 1 1 A 66 66 LEU HA H 66 4.790 4.861 -0.071 1
1 760 . 19 1 1 A 66 66 LEU C C 66 177.537 175.690 1.847 1
1 761 . 19 1 1 A 66 66 LEU CA C 66 52.823 52.535 0.288 1
1 762 . 19 1 1 A 66 66 LEU CB C 66 44.071 44.654 -0.583 1
1 766 . 19 1 1 A 66 66 LEU N N 66 118.967 121.311 -2.344 1
1 767 . 19 1 1 A 67 67 SER H H 67 9.208 8.607 0.601 1
1 768 . 19 1 1 A 67 67 SER HA H 67 4.414 4.841 -0.427 1
1 771 . 19 1 1 A 67 67 SER CA C 67 57.943 57.461 0.482 1
1 772 . 19 1 1 A 67 67 SER CB C 67 64.743 65.203 -0.460 1
1 773 . 19 1 1 A 67 67 SER N N 67 116.378 116.538 -0.160 1
1 774 . 19 1 1 A 69 69 GLY HA2 H 69 3.916 3.697 0.219 1
1 775 . 19 1 1 A 69 69 GLY HA3 H 69 3.867 3.732 0.135 1
1 776 . 19 1 1 A 69 69 GLY C C 69 176.783 175.370 1.413 1
1 777 . 19 1 1 A 69 69 GLY CA C 69 46.977 46.693 0.284 1
1 778 . 19 1 1 A 70 70 ASP H H 70 7.674 8.042 -0.368 1
1 779 . 19 1 1 A 70 70 ASP HA H 70 4.511 3.283 1.228 1
1 782 . 19 1 1 A 70 70 ASP C C 70 178.096 178.006 0.090 1
1 783 . 19 1 1 A 70 70 ASP CA C 70 57.262 56.492 0.770 1
1 784 . 19 1 1 A 70 70 ASP CB C 70 40.594 39.758 0.836 1
1 785 . 19 1 1 A 70 70 ASP N N 70 123.930 121.623 2.307 1
1 786 . 19 1 1 A 71 71 HIS H H 71 8.729 7.993 0.736 1
1 787 . 19 1 1 A 71 71 HIS HA H 71 4.235 4.132 0.103 1
1 790 . 19 1 1 A 71 71 HIS C C 71 176.769 176.891 -0.122 1
1 791 . 19 1 1 A 71 71 HIS CA C 71 60.041 59.684 0.357 1
1 792 . 19 1 1 A 71 71 HIS CB C 71 30.682 29.604 1.078 1
1 793 . 19 1 1 A 71 71 HIS N N 71 121.003 119.205 1.798 1
1 794 . 19 1 1 A 72 72 LEU H H 72 7.620 7.900 -0.280 1
1 795 . 19 1 1 A 72 72 LEU HA H 72 3.769 3.845 -0.076 1
1 805 . 19 1 1 A 72 72 LEU C C 72 180.275 179.319 0.956 1
1 806 . 19 1 1 A 72 72 LEU CA C 72 58.192 57.953 0.239 1
1 807 . 19 1 1 A 72 72 LEU CB C 72 41.381 41.196 0.185 1
1 811 . 19 1 1 A 72 72 LEU N N 72 118.569 118.941 -0.372 1
1 812 . 19 1 1 A 73 73 LEU H H 73 7.542 7.835 -0.293 1
1 813 . 19 1 1 A 73 73 LEU HA H 73 4.107 4.095 0.012 1
1 823 . 19 1 1 A 73 73 LEU C C 73 179.436 179.091 0.345 1
1 824 . 19 1 1 A 73 73 LEU CA C 73 58.026 57.569 0.457 1
1 825 . 19 1 1 A 73 73 LEU CB C 73 41.638 41.938 -0.300 1
1 829 . 19 1 1 A 73 73 LEU N N 73 121.418 120.898 0.520 1
1 830 . 19 1 1 A 74 74 TRP H H 74 8.786 7.975 0.811 1
1 831 . 19 1 1 A 74 74 TRP HA H 74 3.589 5.319 -1.730 1
1 840 . 19 1 1 A 74 74 TRP C C 74 176.816 178.744 -1.928 1
1 841 . 19 1 1 A 74 74 TRP CA C 74 63.046 60.074 2.972 1
1 842 . 19 1 1 A 74 74 TRP CB C 74 28.065 29.179 -1.114 1
1 848 . 19 1 1 A 74 74 TRP N N 74 121.111 118.353 2.758 1
1 850 . 19 1 1 A 75 75 LYS H H 75 8.939 7.635 1.304 1
1 851 . 19 1 1 A 75 75 LYS HA H 75 3.055 4.198 -1.143 1
1 860 . 19 1 1 A 75 75 LYS C C 75 177.967 179.482 -1.515 1
1 861 . 19 1 1 A 75 75 LYS CA C 75 60.029 58.720 1.309 1
1 862 . 19 1 1 A 75 75 LYS CB C 75 32.533 32.712 -0.179 1
1 866 . 19 1 1 A 75 75 LYS N N 75 119.783 118.624 1.159 1
1 867 . 19 1 1 A 76 76 SER H H 76 7.832 7.705 0.127 1
1 868 . 19 1 1 A 76 76 SER HA H 76 4.040 4.376 -0.336 1
1 871 . 19 1 1 A 76 76 SER C C 76 177.816 177.430 0.386 1
1 872 . 19 1 1 A 76 76 SER CA C 76 62.105 61.441 0.664 1
1 873 . 19 1 1 A 76 76 SER CB C 76 62.679 63.158 -0.479 1
1 874 . 19 1 1 A 76 76 SER N N 76 113.395 115.002 -1.607 1
1 875 . 19 1 1 A 77 77 GLU H H 77 7.590 7.583 0.007 1
1 876 . 19 1 1 A 77 77 GLU HA H 77 4.042 4.134 -0.092 1
1 881 . 19 1 1 A 77 77 GLU C C 77 177.809 178.729 -0.920 1
1 882 . 19 1 1 A 77 77 GLU CA C 77 58.270 59.058 -0.788 1
1 883 . 19 1 1 A 77 77 GLU CB C 77 29.208 29.524 -0.316 1
1 885 . 19 1 1 A 77 77 GLU N N 77 121.574 121.951 -0.377 1
1 886 . 19 1 1 A 78 78 PHE H H 78 9.081 7.917 1.164 1
1 887 . 19 1 1 A 78 78 PHE HA H 78 3.778 4.190 -0.412 1
1 895 . 19 1 1 A 78 78 PHE C C 78 178.114 177.483 0.631 1
1 896 . 19 1 1 A 78 78 PHE CA C 78 60.629 61.392 -0.763 1
1 897 . 19 1 1 A 78 78 PHE CB C 78 38.295 38.746 -0.451 1
1 902 . 19 1 1 A 78 78 PHE N N 78 122.682 121.575 1.107 1
1 903 . 19 1 1 A 79 79 PHE H H 79 8.890 8.068 0.822 1
1 904 . 19 1 1 A 79 79 PHE HA H 79 3.800 4.089 -0.289 1
1 912 . 19 1 1 A 79 79 PHE C C 79 178.354 178.651 -0.297 1
1 913 . 19 1 1 A 79 79 PHE CA C 79 60.704 62.169 -1.465 1
1 914 . 19 1 1 A 79 79 PHE CB C 79 37.184 38.308 -1.124 1
1 920 . 19 1 1 A 79 79 PHE N N 79 121.056 118.386 2.670 1
1 921 . 19 1 1 A 80 80 GLU H H 80 7.793 8.116 -0.323 1
1 922 . 19 1 1 A 80 80 GLU HA H 80 4.082 4.145 -0.063 1
1 927 . 19 1 1 A 80 80 GLU C C 80 179.068 178.766 0.302 1
1 928 . 19 1 1 A 80 80 GLU CA C 80 59.735 59.282 0.453 1
1 929 . 19 1 1 A 80 80 GLU CB C 80 28.722 29.220 -0.498 1
1 931 . 19 1 1 A 80 80 GLU N N 80 120.312 117.145 3.167 1
1 932 . 19 1 1 A 81 81 ASN H H 81 8.624 8.542 0.082 1
1 933 . 19 1 1 A 81 81 ASN HA H 81 4.521 4.491 0.030 1
1 938 . 19 1 1 A 81 81 ASN C C 81 179.262 177.890 1.372 1
1 939 . 19 1 1 A 81 81 ASN CA C 81 55.504 56.356 -0.852 1
1 940 . 19 1 1 A 81 81 ASN CB C 81 37.517 38.525 -1.008 1
1 941 . 19 1 1 A 81 81 ASN N N 81 119.338 118.193 1.145 1
1 943 . 19 1 1 A 82 82 CYS H H 82 8.554 8.406 0.148 1
1 944 . 19 1 1 A 82 82 CYS HA H 82 3.792 4.080 -0.288 1
1 947 . 19 1 1 A 82 82 CYS C C 82 176.478 177.066 -0.588 1
1 948 . 19 1 1 A 82 82 CYS CA C 82 65.232 62.208 3.024 1
1 949 . 19 1 1 A 82 82 CYS CB C 82 26.762 26.784 -0.022 1
1 950 . 19 1 1 A 82 82 CYS N N 82 120.576 118.507 2.069 1
1 951 . 19 1 1 A 83 83 ARG H H 83 8.522 7.918 0.604 1
1 952 . 19 1 1 A 83 83 ARG HA H 83 3.932 4.206 -0.274 1
1 960 . 19 1 1 A 83 83 ARG C C 83 179.138 178.717 0.421 1
1 961 . 19 1 1 A 83 83 ARG CA C 83 60.443 58.928 1.515 1
1 962 . 19 1 1 A 83 83 ARG CB C 83 29.550 30.078 -0.528 1
1 965 . 19 1 1 A 83 83 ARG N N 83 123.035 120.133 2.902 1
1 967 . 19 1 1 A 84 84 ASP H H 84 7.791 8.149 -0.358 1
1 968 . 19 1 1 A 84 84 ASP HA H 84 4.353 4.434 -0.081 1
1 971 . 19 1 1 A 84 84 ASP C C 84 178.649 178.358 0.291 1
1 972 . 19 1 1 A 84 84 ASP CA C 84 57.767 57.555 0.212 1
1 973 . 19 1 1 A 84 84 ASP CB C 84 41.305 41.425 -0.120 1
1 974 . 19 1 1 A 84 84 ASP N N 84 120.332 119.710 0.622 1
1 975 . 19 1 1 A 85 85 THR H H 85 8.370 7.879 0.491 1
1 976 . 19 1 1 A 85 85 THR HA H 85 3.730 4.012 -0.282 1
1 981 . 19 1 1 A 85 85 THR C C 85 175.198 176.655 -1.457 1
1 982 . 19 1 1 A 85 85 THR CA C 85 66.830 65.123 1.707 1
1 983 . 19 1 1 A 85 85 THR CB C 85 68.533 68.900 -0.367 1
1 985 . 19 1 1 A 85 85 THR N N 85 117.360 113.521 3.839 1
1 986 . 19 1 1 A 86 86 ALA H H 86 8.845 8.416 0.429 1
1 987 . 19 1 1 A 86 86 ALA HA H 86 3.991 4.083 -0.092 1
1 991 . 19 1 1 A 86 86 ALA C C 86 179.980 179.622 0.358 1
1 992 . 19 1 1 A 86 86 ALA CA C 86 55.769 55.708 0.061 1
1 993 . 19 1 1 A 86 86 ALA CB C 86 17.881 18.325 -0.444 1
1 994 . 19 1 1 A 86 86 ALA N N 86 123.613 123.194 0.419 1
1 995 . 19 1 1 A 87 87 LYS H H 87 7.686 7.779 -0.093 1
1 996 . 19 1 1 A 87 87 LYS HA H 87 4.099 4.034 0.065 1
1 1005 . 19 1 1 A 87 87 LYS C C 87 179.592 178.712 0.880 1
1 1006 . 19 1 1 A 87 87 LYS CA C 87 59.708 59.095 0.613 1
1 1007 . 19 1 1 A 87 87 LYS CB C 87 32.054 31.893 0.161 1
1 1011 . 19 1 1 A 87 87 LYS N N 87 119.623 116.656 2.967 1
1 1012 . 19 1 1 A 88 88 ARG H H 88 7.683 7.660 0.023 1
1 1013 . 19 1 1 A 88 88 ARG HA H 88 4.051 4.148 -0.097 1
1 1020 . 19 1 1 A 88 88 ARG C C 88 180.053 178.543 1.510 1
1 1021 . 19 1 1 A 88 88 ARG CA C 88 59.558 59.105 0.453 1
1 1022 . 19 1 1 A 88 88 ARG CB C 88 29.684 30.014 -0.330 1
1 1025 . 19 1 1 A 88 88 ARG N N 88 120.788 119.233 1.555 1
1 1026 . 19 1 1 A 89 89 ASN H H 89 8.973 8.359 0.614 1
1 1027 . 19 1 1 A 89 89 ASN HA H 89 4.354 4.625 -0.271 1
1 1032 . 19 1 1 A 89 89 ASN C C 89 178.382 178.450 -0.068 1
1 1033 . 19 1 1 A 89 89 ASN CA C 89 55.334 55.727 -0.393 1
1 1034 . 19 1 1 A 89 89 ASN CB C 89 37.864 38.204 -0.340 1
1 1035 . 19 1 1 A 89 89 ASN N N 89 121.012 117.681 3.331 1
1 1037 . 19 1 1 A 90 90 GLN H H 90 8.152 8.310 -0.158 1
1 1038 . 19 1 1 A 90 90 GLN HA H 90 4.020 4.061 -0.041 1
1 1045 . 19 1 1 A 90 90 GLN C C 90 179.075 178.957 0.118 1
1 1046 . 19 1 1 A 90 90 GLN CA C 90 59.318 58.916 0.402 1
1 1047 . 19 1 1 A 90 90 GLN CB C 90 28.049 28.352 -0.303 1
1 1049 . 19 1 1 A 90 90 GLN N N 90 122.122 120.629 1.493 1
1 1051 . 19 1 1 A 91 91 GLN H H 91 7.514 8.315 -0.801 1
1 1052 . 19 1 1 A 91 91 GLN HA H 91 4.053 4.153 -0.100 1
1 1059 . 19 1 1 A 91 91 GLN C C 91 177.081 176.667 0.414 1
1 1060 . 19 1 1 A 91 91 GLN CA C 91 58.031 57.553 0.478 1
1 1061 . 19 1 1 A 91 91 GLN CB C 91 28.365 27.105 1.260 1
1 1063 . 19 1 1 A 91 91 GLN N N 91 118.124 117.904 0.220 1
1 1065 . 19 1 1 A 92 92 ALA H H 92 7.704 7.758 -0.054 1
1 1066 . 19 1 1 A 92 92 ALA HA H 92 4.246 4.415 -0.169 1
1 1070 . 19 1 1 A 92 92 ALA C C 92 178.450 178.124 0.326 1
1 1071 . 19 1 1 A 92 92 ALA CA C 92 52.671 51.894 0.777 1
1 1072 . 19 1 1 A 92 92 ALA CB C 92 19.316 19.740 -0.424 1
1 1073 . 19 1 1 A 92 92 ALA N N 92 119.880 121.691 -1.811 1
1 1074 . 19 1 1 A 93 93 GLY H H 93 7.693 8.114 -0.421 1
1 1075 . 19 1 1 A 93 93 GLY HA2 H 93 3.941 3.841 0.100 1
1 1076 . 19 1 1 A 93 93 GLY HA3 H 93 3.744 3.846 -0.102 1
1 1077 . 19 1 1 A 93 93 GLY C C 93 174.344 175.063 -0.719 1
1 1078 . 19 1 1 A 93 93 GLY CA C 93 45.949 46.876 -0.927 1
1 1079 . 19 1 1 A 93 93 GLY N N 93 105.347 107.156 -1.809 1
1 1080 . 19 1 1 A 94 94 ASN H H 94 7.076 8.874 -1.798 1
1 1081 . 19 1 1 A 94 94 ASN HA H 94 4.115 4.367 -0.252 1
1 1085 . 19 1 1 A 94 94 ASN C C 94 175.410 175.720 -0.310 1
1 1086 . 19 1 1 A 94 94 ASN CA C 94 52.651 52.485 0.166 1
1 1087 . 19 1 1 A 94 94 ASN CB C 94 38.330 39.019 -0.689 1
1 1088 . 19 1 1 A 94 94 ASN N N 94 115.747 117.064 -1.317 1
1 1090 . 19 1 1 A 95 95 GLY H H 95 8.236 8.314 -0.078 1
1 1091 . 19 1 1 A 95 95 GLY HA2 H 95 3.633 3.721 -0.088 1
1 1092 . 19 1 1 A 95 95 GLY HA3 H 95 3.633 3.928 -0.295 1
1 1093 . 19 1 1 A 95 95 GLY C C 95 174.450 173.971 0.479 1
1 1094 . 19 1 1 A 95 95 GLY CA C 95 45.522 46.200 -0.678 1
1 1095 . 19 1 1 A 95 95 GLY N N 95 109.166 108.742 0.424 1
1 1096 . 19 1 1 A 96 96 TRP H H 96 7.899 7.711 0.188 1
1 1097 . 19 1 1 A 96 96 TRP HA H 96 5.241 5.072 0.169 1
1 1106 . 19 1 1 A 96 96 TRP C C 96 175.661 175.782 -0.121 1
1 1107 . 19 1 1 A 96 96 TRP CA C 96 55.090 56.601 -1.511 1
1 1108 . 19 1 1 A 96 96 TRP CB C 96 27.138 31.852 -4.714 1
1 1114 . 19 1 1 A 96 96 TRP N N 96 122.840 120.386 2.454 1
1 1116 . 19 1 1 A 97 97 ASP H H 97 7.344 9.050 -1.706 1
1 1117 . 19 1 1 A 97 97 ASP HA H 97 4.829 4.375 0.454 1
1 1120 . 19 1 1 A 97 97 ASP C C 97 175.019 176.213 -1.194 1
1 1121 . 19 1 1 A 97 97 ASP CA C 97 52.149 56.360 -4.211 1
1 1122 . 19 1 1 A 97 97 ASP CB C 97 42.697 38.576 4.121 1
1 1123 . 19 1 1 A 97 97 ASP N N 97 126.861 117.247 9.614 1
1 1124 . 19 1 1 A 98 98 PHE H H 98 8.566 8.762 -0.196 1
1 1125 . 19 1 1 A 98 98 PHE HA H 98 3.727 4.228 -0.501 1
1 1133 . 19 1 1 A 98 98 PHE C C 98 177.443 176.592 0.851 1
1 1134 . 19 1 1 A 98 98 PHE CA C 98 62.471 61.146 1.325 1
1 1135 . 19 1 1 A 98 98 PHE CB C 98 39.919 39.839 0.080 1
1 1141 . 19 1 1 A 98 98 PHE N N 98 117.781 121.263 -3.482 1
1 1142 . 19 1 1 A 99 99 ASP H H 99 8.259 8.376 -0.117 1
1 1143 . 19 1 1 A 99 99 ASP HA H 99 3.960 4.316 -0.356 1
1 1146 . 19 1 1 A 99 99 ASP C C 99 178.132 178.468 -0.336 1
1 1147 . 19 1 1 A 99 99 ASP CA C 99 57.658 57.147 0.511 1
1 1148 . 19 1 1 A 99 99 ASP CB C 99 38.572 40.622 -2.050 1
1 1149 . 19 1 1 A 99 99 ASP N N 99 121.709 118.842 2.867 1
1 1150 . 19 1 1 A 100 100 MET H H 100 8.008 8.223 -0.215 1
1 1151 . 19 1 1 A 100 100 MET HA H 100 3.644 4.220 -0.576 1
1 1156 . 19 1 1 A 100 100 MET C C 100 180.008 177.599 2.409 1
1 1157 . 19 1 1 A 100 100 MET CA C 100 58.598 58.377 0.221 1
1 1158 . 19 1 1 A 100 100 MET CB C 100 33.423 33.575 -0.152 1
1 1160 . 19 1 1 A 100 100 MET N N 100 119.668 117.870 1.798 1
1 1161 . 19 1 1 A 101 101 LEU H H 101 7.961 7.981 -0.020 1
1 1162 . 19 1 1 A 101 101 LEU HA H 101 3.523 4.418 -0.895 1
1 1172 . 19 1 1 A 101 101 LEU C C 101 173.873 176.357 -2.484 1
1 1173 . 19 1 1 A 101 101 LEU CA C 101 58.743 54.374 4.369 1
1 1174 . 19 1 1 A 101 101 LEU CB C 101 42.632 41.204 1.428 1
1 1178 . 19 1 1 A 101 101 LEU N N 101 119.752 119.402 0.350 1
1 1179 . 19 1 1 A 102 102 THR H H 102 6.955 8.328 -1.373 1
1 1180 . 19 1 1 A 102 102 THR HA H 102 4.134 4.620 -0.486 1
1 1185 . 19 1 1 A 102 102 THR C C 102 176.513 175.240 1.273 1
1 1186 . 19 1 1 A 102 102 THR CA C 102 61.125 62.529 -1.404 1
1 1187 . 19 1 1 A 102 102 THR CB C 102 71.415 70.396 1.019 1
1 1189 . 19 1 1 A 102 102 THR N N 102 124.665 116.901 7.764 1
1 1190 . 19 1 1 A 103 103 GLY H H 103 7.816 7.783 0.033 1
1 1191 . 19 1 1 A 103 103 GLY HA2 H 103 3.824 3.958 -0.134 1
1 1192 . 19 1 1 A 103 103 GLY HA3 H 103 3.824 4.004 -0.180 1
1 1193 . 19 1 1 A 103 103 GLY C C 103 174.126 173.878 0.248 1
1 1194 . 19 1 1 A 103 103 GLY CA C 103 47.805 46.652 1.153 1
1 1195 . 19 1 1 A 103 103 GLY N N 103 114.191 111.560 2.631 1
1 1196 . 19 1 1 A 104 104 SER H H 104 8.860 7.648 1.212 1
1 1197 . 19 1 1 A 104 104 SER HA H 104 4.758 4.968 -0.210 1
1 1200 . 19 1 1 A 104 104 SER C C 104 174.591 172.908 1.683 1
1 1201 . 19 1 1 A 104 104 SER CA C 104 56.755 57.706 -0.951 1
1 1202 . 19 1 1 A 104 104 SER CB C 104 65.050 65.596 -0.546 1
1 1203 . 19 1 1 A 104 104 SER N N 104 114.771 114.630 0.141 1
1 1204 . 19 1 1 A 105 105 GLY H H 105 8.788 8.257 0.531 1
1 1205 . 19 1 1 A 105 105 GLY HA2 H 105 3.733 3.999 -0.266 1
1 1206 . 19 1 1 A 105 105 GLY HA3 H 105 3.733 4.132 -0.399 1
1 1207 . 19 1 1 A 105 105 GLY CA C 105 47.247 45.292 1.955 1
1 1208 . 19 1 1 A 105 105 GLY N N 105 110.394 111.287 -0.893 1
1 1209 . 19 1 1 A 106 106 ASN HA H 106 4.454 4.876 -0.422 1
1 1212 . 19 1 1 A 106 106 ASN C C 106 175.180 176.081 -0.901 1
1 1213 . 19 1 1 A 106 106 ASN CA C 106 54.492 53.987 0.505 1
1 1214 . 19 1 1 A 106 106 ASN CB C 106 37.282 40.987 -3.705 1
1 1215 . 19 1 1 A 107 107 TYR H H 107 8.241 7.272 0.969 1
1 1216 . 19 1 1 A 107 107 TYR HA H 107 4.335 4.771 -0.436 1
1 1223 . 19 1 1 A 107 107 TYR C C 107 173.954 176.147 -2.193 1
1 1224 . 19 1 1 A 107 107 TYR CA C 107 57.727 57.696 0.031 1
1 1225 . 19 1 1 A 107 107 TYR CB C 107 37.063 39.312 -2.249 1
1 1230 . 19 1 1 A 107 107 TYR N N 107 120.708 116.491 4.217 1
1 1231 . 19 1 1 A 108 108 SER H H 108 7.117 7.841 -0.724 1
1 1232 . 19 1 1 A 108 108 SER HA H 108 4.221 4.524 -0.303 1
1 1235 . 19 1 1 A 108 108 SER C C 108 174.834 175.098 -0.264 1
1 1236 . 19 1 1 A 108 108 SER CA C 108 59.859 61.161 -1.302 1
1 1237 . 19 1 1 A 108 108 SER CB C 108 63.846 64.192 -0.346 1
1 1238 . 19 1 1 A 108 108 SER N N 108 113.362 115.342 -1.980 1
1 1239 . 19 1 1 A 109 109 SER H H 109 8.053 8.031 0.022 1
1 1240 . 19 1 1 A 109 109 SER HA H 109 4.560 4.425 0.135 1
1 1243 . 19 1 1 A 109 109 SER CA C 109 57.141 59.241 -2.100 1
1 1244 . 19 1 1 A 109 109 SER CB C 109 64.874 62.874 2.000 1
1 1245 . 19 1 1 A 109 109 SER N N 109 116.657 115.771 0.886 1
1 1246 . 19 1 1 A 110 110 THR HA H 110 3.541 3.997 -0.456 1
1 1251 . 19 1 1 A 110 110 THR C C 110 175.477 176.190 -0.713 1
1 1252 . 19 1 1 A 110 110 THR CA C 110 66.443 65.805 0.638 1
1 1253 . 19 1 1 A 110 110 THR CB C 110 68.091 68.530 -0.439 1
1 1255 . 19 1 1 A 111 111 ASP H H 111 8.224 8.073 0.151 1
1 1256 . 19 1 1 A 111 111 ASP HA H 111 4.237 4.351 -0.114 1
1 1259 . 19 1 1 A 111 111 ASP C C 111 177.520 178.300 -0.780 1
1 1260 . 19 1 1 A 111 111 ASP CA C 111 57.559 57.274 0.285 1
1 1261 . 19 1 1 A 111 111 ASP CB C 111 40.292 41.140 -0.848 1
1 1262 . 19 1 1 A 111 111 ASP N N 111 119.490 121.875 -2.385 1
1 1263 . 19 1 1 A 112 112 ALA H H 112 7.431 8.309 -0.878 1
1 1264 . 19 1 1 A 112 112 ALA HA H 112 4.191 4.079 0.112 1
1 1268 . 19 1 1 A 112 112 ALA C C 112 180.646 179.647 0.999 1
1 1269 . 19 1 1 A 112 112 ALA CA C 112 54.534 54.369 0.165 1
1 1270 . 19 1 1 A 112 112 ALA CB C 112 18.992 18.415 0.577 1
1 1271 . 19 1 1 A 112 112 ALA N N 112 119.710 121.573 -1.863 1
1 1272 . 19 1 1 A 113 113 GLN H H 113 7.576 7.754 -0.178 1
1 1273 . 19 1 1 A 113 113 GLN HA H 113 3.562 4.199 -0.637 1
1 1278 . 19 1 1 A 113 113 GLN C C 113 176.756 177.561 -0.805 1
1 1279 . 19 1 1 A 113 113 GLN CA C 113 57.736 58.373 -0.637 1
1 1280 . 19 1 1 A 113 113 GLN CB C 113 29.110 28.924 0.186 1
1 1281 . 19 1 1 A 113 113 GLN N N 113 117.518 118.310 -0.792 1
1 1283 . 19 1 1 A 114 114 MET H H 114 8.192 7.957 0.235 1
1 1284 . 19 1 1 A 114 114 MET HA H 114 4.231 4.346 -0.115 1
1 1289 . 19 1 1 A 114 114 MET C C 114 175.648 176.949 -1.301 1
1 1290 . 19 1 1 A 114 114 MET CA C 114 57.446 57.615 -0.169 1
1 1291 . 19 1 1 A 114 114 MET CB C 114 33.570 32.934 0.636 1
1 1293 . 19 1 1 A 114 114 MET N N 114 111.509 119.354 -7.845 1
1 1294 . 19 1 1 A 115 115 GLN H H 115 6.940 7.747 -0.807 1
1 1295 . 19 1 1 A 115 115 GLN HA H 115 4.307 3.990 0.317 1
1 1302 . 19 1 1 A 115 115 GLN C C 115 176.270 174.239 2.031 1
1 1303 . 19 1 1 A 115 115 GLN CA C 115 54.680 54.638 0.042 1
1 1304 . 19 1 1 A 115 115 GLN CB C 115 28.233 28.975 -0.742 1
1 1306 . 19 1 1 A 115 115 GLN N N 115 114.300 116.459 -2.159 1
1 1308 . 19 1 1 A 116 116 TYR H H 116 6.677 6.991 -0.314 1
1 1309 . 19 1 1 A 116 116 TYR HA H 116 4.193 4.545 -0.352 1
1 1312 . 19 1 1 A 116 116 TYR C C 116 175.268 174.526 0.742 1
1 1313 . 19 1 1 A 116 116 TYR CA C 116 54.357 57.766 -3.409 1
1 1314 . 19 1 1 A 116 116 TYR CB C 116 35.498 39.143 -3.645 1
1 1315 . 19 1 1 A 116 116 TYR N N 116 117.919 119.025 -1.106 1
1 1316 . 19 1 1 A 117 117 ASP H H 117 8.081 8.412 -0.331 1
1 1317 . 19 1 1 A 117 117 ASP HA H 117 4.665 5.035 -0.370 1
1 1320 . 19 1 1 A 117 117 ASP CA C 117 52.422 50.662 1.760 1
1 1321 . 19 1 1 A 117 117 ASP CB C 117 42.416 42.640 -0.224 1
1 1322 . 19 1 1 A 117 117 ASP N N 117 120.887 122.426 -1.539 1
1 1323 . 19 1 1 A 118 118 PRO C C 118 179.180 178.341 0.839 1
1 1324 . 19 1 1 A 118 118 PRO CA C 118 65.942 64.359 1.583 1
1 1325 . 19 1 1 A 118 118 PRO CB C 118 32.197 31.851 0.346 1
1 1326 . 19 1 1 A 119 119 GLY H H 119 9.742 8.584 1.158 1
1 1327 . 19 1 1 A 119 119 GLY C C 119 175.622 175.358 0.264 1
1 1328 . 19 1 1 A 119 119 GLY CA C 119 46.785 46.694 0.091 1
1 1329 . 19 1 1 A 119 119 GLY N N 119 106.412 106.762 -0.350 1
1 1330 . 19 1 1 A 120 120 LEU H H 120 6.666 7.337 -0.671 1
1 1331 . 19 1 1 A 120 120 LEU HA H 120 3.365 3.623 -0.258 1
1 1341 . 19 1 1 A 120 120 LEU C C 120 179.262 178.619 0.643 1
1 1342 . 19 1 1 A 120 120 LEU CA C 120 56.605 57.800 -1.195 1
1 1343 . 19 1 1 A 120 120 LEU CB C 120 39.262 41.370 -2.108 1
1 1347 . 19 1 1 A 120 120 LEU N N 120 126.226 122.431 3.795 1
1 1348 . 19 1 1 A 121 121 PHE H H 121 7.356 8.932 -1.576 1
1 1349 . 19 1 1 A 121 121 PHE HA H 121 4.459 3.890 0.569 1
1 1352 . 19 1 1 A 121 121 PHE C C 121 179.716 177.834 1.882 1
1 1353 . 19 1 1 A 121 121 PHE CA C 121 62.838 62.056 0.782 1
1 1354 . 19 1 1 A 121 121 PHE CB C 121 37.603 38.988 -1.385 1
1 1355 . 19 1 1 A 121 121 PHE N N 121 117.437 119.371 -1.934 1
1 1356 . 19 1 1 A 122 122 ALA H H 122 7.926 7.993 -0.067 1
1 1357 . 19 1 1 A 122 122 ALA HA H 122 4.523 3.772 0.751 1
1 1361 . 19 1 1 A 122 122 ALA C C 122 180.435 179.795 0.640 1
1 1362 . 19 1 1 A 122 122 ALA CA C 122 55.527 55.013 0.514 1
1 1363 . 19 1 1 A 122 122 ALA CB C 122 17.814 18.200 -0.386 1
1 1364 . 19 1 1 A 122 122 ALA N N 122 121.068 121.378 -0.310 1
1 1365 . 19 1 1 A 123 123 GLN H H 123 7.507 7.942 -0.435 1
1 1366 . 19 1 1 A 123 123 GLN HA H 123 4.153 4.009 0.144 1
1 1371 . 19 1 1 A 123 123 GLN C C 123 180.561 178.249 2.312 1
1 1372 . 19 1 1 A 123 123 GLN CA C 123 59.948 58.853 1.095 1
1 1373 . 19 1 1 A 123 123 GLN CB C 123 29.135 28.373 0.762 1
1 1375 . 19 1 1 A 123 123 GLN N N 123 120.324 117.553 2.771 1
1 1376 . 19 1 1 A 124 124 ILE H H 124 8.318 8.224 0.094 1
1 1377 . 19 1 1 A 124 124 ILE HA H 124 3.635 3.931 -0.296 1
1 1387 . 19 1 1 A 124 124 ILE C C 124 176.481 178.163 -1.682 1
1 1388 . 19 1 1 A 124 124 ILE CA C 124 66.432 64.626 1.806 1
1 1389 . 19 1 1 A 124 124 ILE CB C 124 39.168 37.879 1.289 1
1 1393 . 19 1 1 A 124 124 ILE N N 124 123.747 119.216 4.531 1
1 1394 . 19 1 1 A 125 125 GLN H H 125 8.474 7.942 0.532 1
1 1395 . 19 1 1 A 125 125 GLN HA H 125 4.264 3.968 0.296 1
1 1402 . 19 1 1 A 125 125 GLN C C 125 178.947 177.780 1.167 1
1 1403 . 19 1 1 A 125 125 GLN CA C 125 59.651 58.466 1.185 1
1 1404 . 19 1 1 A 125 125 GLN CB C 125 28.880 28.576 0.304 1
1 1406 . 19 1 1 A 125 125 GLN N N 125 120.368 121.167 -0.799 1
1 1408 . 19 1 1 A 126 126 ALA H H 126 8.002 7.845 0.157 1
1 1409 . 19 1 1 A 126 126 ALA HA H 126 4.144 3.969 0.175 1
1 1413 . 19 1 1 A 126 126 ALA C C 126 179.316 179.889 -0.573 1
1 1414 . 19 1 1 A 126 126 ALA CA C 126 55.036 55.051 -0.015 1
1 1415 . 19 1 1 A 126 126 ALA CB C 126 18.087 18.128 -0.041 1
1 1416 . 19 1 1 A 126 126 ALA N N 126 121.661 121.224 0.437 1
1 1417 . 19 1 1 A 127 127 ALA H H 127 7.823 8.351 -0.528 1
1 1418 . 19 1 1 A 127 127 ALA HA H 127 4.162 4.059 0.103 1
1 1422 . 19 1 1 A 127 127 ALA C C 127 180.707 179.581 1.126 1
1 1423 . 19 1 1 A 127 127 ALA CA C 127 55.080 54.952 0.128 1
1 1424 . 19 1 1 A 127 127 ALA CB C 127 19.354 18.246 1.108 1
1 1425 . 19 1 1 A 127 127 ALA N N 127 119.853 119.959 -0.106 1
1 1426 . 19 1 1 A 128 128 ALA H H 128 8.936 7.758 1.178 1
1 1427 . 19 1 1 A 128 128 ALA HA H 128 3.928 3.714 0.214 1
1 1431 . 19 1 1 A 128 128 ALA C C 128 181.031 179.146 1.885 1
1 1432 . 19 1 1 A 128 128 ALA CA C 128 55.502 54.669 0.833 1
1 1433 . 19 1 1 A 128 128 ALA CB C 128 16.609 17.761 -1.152 1
1 1434 . 19 1 1 A 128 128 ALA N N 128 121.355 120.281 1.074 1
1 1435 . 19 1 1 A 129 129 THR H H 129 8.543 7.588 0.955 1
1 1436 . 19 1 1 A 129 129 THR HA H 129 4.015 3.691 0.324 1
1 1441 . 19 1 1 A 129 129 THR C C 129 177.332 176.074 1.258 1
1 1442 . 19 1 1 A 129 129 THR CA C 129 65.893 65.067 0.826 1
1 1443 . 19 1 1 A 129 129 THR CB C 129 68.566 68.476 0.090 1
1 1445 . 19 1 1 A 129 129 THR N N 129 112.709 112.233 0.476 1
1 1446 . 19 1 1 A 130 130 LYS H H 130 8.126 7.670 0.456 1
1 1447 . 19 1 1 A 130 130 LYS HA H 130 4.000 4.013 -0.013 1
1 1456 . 19 1 1 A 130 130 LYS C C 130 179.082 178.563 0.519 1
1 1457 . 19 1 1 A 130 130 LYS CA C 130 60.299 58.701 1.598 1
1 1458 . 19 1 1 A 130 130 LYS CB C 130 32.767 32.257 0.510 1
1 1462 . 19 1 1 A 130 130 LYS N N 130 123.879 120.710 3.169 1
1 1463 . 19 1 1 A 131 131 ALA H H 131 7.184 7.776 -0.592 1
1 1464 . 19 1 1 A 131 131 ALA HA H 131 4.005 4.252 -0.247 1
1 1468 . 19 1 1 A 131 131 ALA C C 131 178.482 179.565 -1.083 1
1 1469 . 19 1 1 A 131 131 ALA CA C 131 55.027 55.126 -0.099 1
1 1470 . 19 1 1 A 131 131 ALA CB C 131 18.669 19.642 -0.973 1
1 1471 . 19 1 1 A 131 131 ALA N N 131 118.590 120.934 -2.344 1
1 1472 . 19 1 1 A 132 132 TRP H H 132 7.977 8.676 -0.699 1
1 1473 . 19 1 1 A 132 132 TRP HA H 132 4.001 4.130 -0.129 1
1 1480 . 19 1 1 A 132 132 TRP C C 132 177.332 175.903 1.429 1
1 1481 . 19 1 1 A 132 132 TRP CA C 132 60.431 57.677 2.754 1
1 1482 . 19 1 1 A 132 132 TRP CB C 132 27.786 27.618 0.168 1
1 1486 . 19 1 1 A 132 132 TRP N N 132 119.168 117.253 1.915 1
1 1488 . 19 1 1 A 133 133 ARG H H 133 8.006 8.039 -0.033 1
1 1489 . 19 1 1 A 133 133 ARG HA H 133 4.027 4.354 -0.327 1
1 1497 . 19 1 1 A 133 133 ARG C C 133 176.664 177.589 -0.925 1
1 1498 . 19 1 1 A 133 133 ARG CA C 133 59.355 56.993 2.362 1
1 1499 . 19 1 1 A 133 133 ARG CB C 133 30.451 32.270 -1.819 1
1 1502 . 19 1 1 A 133 133 ARG N N 133 113.062 120.612 -7.550 1
1 1504 . 19 1 1 A 134 134 LYS H H 134 7.322 7.934 -0.612 1
1 1505 . 19 1 1 A 134 134 LYS HA H 134 4.313 4.412 -0.099 1
1 1514 . 19 1 1 A 134 134 LYS C C 134 176.282 176.346 -0.064 1
1 1515 . 19 1 1 A 134 134 LYS CA C 134 54.922 55.557 -0.635 1
1 1516 . 19 1 1 A 134 134 LYS CB C 134 32.633 30.294 2.339 1
1 1520 . 19 1 1 A 134 134 LYS N N 134 118.170 119.466 -1.296 1
1 1521 . 19 1 1 A 135 135 LEU H H 135 7.440 8.036 -0.596 1
1 1522 . 19 1 1 A 135 135 LEU HA H 135 4.174 4.631 -0.457 1
1 1532 . 19 1 1 A 135 135 LEU CA C 135 54.408 51.433 2.975 1
1 1533 . 19 1 1 A 135 135 LEU CB C 135 40.407 41.792 -1.385 1
1 1537 . 19 1 1 A 135 135 LEU N N 135 123.358 121.153 2.205 1
1 1538 . 19 1 1 A 136 136 PRO HA H 136 4.437 4.511 -0.074 1
1 1545 . 19 1 1 A 136 136 PRO C C 136 177.106 175.824 1.282 1
1 1546 . 19 1 1 A 136 136 PRO CA C 136 62.889 64.911 -2.022 1
1 1547 . 19 1 1 A 136 136 PRO CB C 136 32.192 32.273 -0.081 1
1 1550 . 19 1 1 A 137 137 VAL H H 137 8.219 7.440 0.779 1
1 1551 . 19 1 1 A 137 137 VAL HA H 137 4.077 4.714 -0.637 1
1 1559 . 19 1 1 A 137 137 VAL C C 137 176.305 175.074 1.231 1
1 1560 . 19 1 1 A 137 137 VAL CA C 137 61.958 59.237 2.721 1
1 1561 . 19 1 1 A 137 137 VAL CB C 137 32.755 35.274 -2.519 1
1 1564 . 19 1 1 A 137 137 VAL N N 137 120.079 111.400 8.679 1
1 1565 . 19 1 1 A 138 138 LYS H H 138 8.444 8.652 -0.208 1
1 1566 . 19 1 1 A 138 138 LYS HA H 138 4.316 4.531 -0.215 1
1 1575 . 19 1 1 A 138 138 LYS C C 138 176.790 176.747 0.043 1
1 1576 . 19 1 1 A 138 138 LYS CA C 138 56.792 55.471 1.321 1
1 1577 . 19 1 1 A 138 138 LYS CB C 138 33.205 32.927 0.278 1
1 1581 . 19 1 1 A 138 138 LYS N N 138 126.449 123.800 2.649 1
1 1582 . 19 1 1 A 139 139 GLY H H 139 8.518 8.595 -0.077 1
1 1583 . 19 1 1 A 139 139 GLY HA2 H 139 4.070 4.017 0.053 1
1 1584 . 19 1 1 A 139 139 GLY HA3 H 139 3.897 4.018 -0.121 1
1 1585 . 19 1 1 A 139 139 GLY C C 139 172.874 172.782 0.092 1
1 1586 . 19 1 1 A 139 139 GLY CA C 139 45.157 45.356 -0.199 1
1 1587 . 19 1 1 A 139 139 GLY N N 139 112.617 107.015 5.602 1
1 6 . 20 1 1 A 2 2 VAL H H 2 8.992 8.857 0.135 1
1 7 . 20 1 1 A 2 2 VAL HA H 2 5.370 4.877 0.493 1
1 15 . 20 1 1 A 2 2 VAL C C 2 174.325 174.755 -0.430 1
1 16 . 20 1 1 A 2 2 VAL CA C 2 61.267 60.769 0.498 1
1 17 . 20 1 1 A 2 2 VAL CB C 2 33.890 33.965 -0.075 1
1 20 . 20 1 1 A 2 2 VAL N N 2 126.939 119.708 7.231 1
1 21 . 20 1 1 A 3 3 THR H H 3 8.912 9.363 -0.451 1
1 22 . 20 1 1 A 3 3 THR HA H 3 4.505 5.027 -0.522 1
1 27 . 20 1 1 A 3 3 THR C C 3 172.710 172.080 0.630 1
1 28 . 20 1 1 A 3 3 THR CA C 3 59.689 59.525 0.164 1
1 29 . 20 1 1 A 3 3 THR CB C 3 72.398 72.042 0.356 1
1 31 . 20 1 1 A 3 3 THR N N 3 118.091 122.929 -4.838 1
1 32 . 20 1 1 A 4 4 GLU H H 4 8.631 8.727 -0.096 1
1 33 . 20 1 1 A 4 4 GLU HA H 4 5.788 5.295 0.493 1
1 38 . 20 1 1 A 4 4 GLU C C 4 175.758 174.433 1.325 1
1 39 . 20 1 1 A 4 4 GLU CA C 4 54.902 54.824 0.078 1
1 40 . 20 1 1 A 4 4 GLU CB C 4 35.097 32.722 2.375 1
1 42 . 20 1 1 A 4 4 GLU N N 4 120.966 127.466 -6.500 1
1 43 . 20 1 1 A 5 5 THR H H 5 9.188 9.297 -0.109 1
1 44 . 20 1 1 A 5 5 THR HA H 5 4.739 5.016 -0.277 1
1 49 . 20 1 1 A 5 5 THR C C 5 172.757 172.863 -0.106 1
1 50 . 20 1 1 A 5 5 THR CA C 5 60.382 60.342 0.040 1
1 51 . 20 1 1 A 5 5 THR CB C 5 71.558 71.284 0.274 1
1 53 . 20 1 1 A 5 5 THR N N 5 119.366 120.888 -1.522 1
1 54 . 20 1 1 A 6 6 VAL H H 6 8.476 8.806 -0.330 1
1 55 . 20 1 1 A 6 6 VAL HA H 6 5.026 4.888 0.138 1
1 63 . 20 1 1 A 6 6 VAL C C 6 176.674 174.745 1.929 1
1 64 . 20 1 1 A 6 6 VAL CA C 6 61.008 61.124 -0.116 1
1 65 . 20 1 1 A 6 6 VAL CB C 6 33.861 33.013 0.848 1
1 68 . 20 1 1 A 6 6 VAL N N 6 121.384 124.514 -3.130 1
1 69 . 20 1 1 A 7 7 ASP H H 7 8.848 8.710 0.138 1
1 70 . 20 1 1 A 7 7 ASP HA H 7 4.797 4.681 0.116 1
1 73 . 20 1 1 A 7 7 ASP CA C 7 52.834 54.919 -2.085 1
1 74 . 20 1 1 A 7 7 ASP CB C 7 42.219 42.813 -0.594 1
1 75 . 20 1 1 A 7 7 ASP N N 7 127.061 127.636 -0.575 1
1 76 . 20 1 1 A 8 8 GLY C C 8 175.143 174.677 0.466 1
1 77 . 20 1 1 A 8 8 GLY CA C 8 46.553 46.469 0.084 1
1 78 . 20 1 1 A 9 9 GLN H H 9 8.408 8.220 0.188 1
1 79 . 20 1 1 A 9 9 GLN HA H 9 4.541 4.560 -0.019 1
1 86 . 20 1 1 A 9 9 GLN C C 9 176.463 176.501 -0.038 1
1 87 . 20 1 1 A 9 9 GLN CA C 9 55.167 55.094 0.073 1
1 88 . 20 1 1 A 9 9 GLN CB C 9 29.376 30.502 -1.126 1
1 90 . 20 1 1 A 9 9 GLN N N 9 118.300 117.956 0.344 1
1 92 . 20 1 1 A 10 10 GLY H H 10 8.162 8.272 -0.110 1
1 93 . 20 1 1 A 10 10 GLY HA2 H 10 4.174 3.972 0.202 1
1 94 . 20 1 1 A 10 10 GLY HA3 H 10 3.521 3.974 -0.453 1
1 95 . 20 1 1 A 10 10 GLY C C 10 174.092 174.375 -0.283 1
1 96 . 20 1 1 A 10 10 GLY CA C 10 45.558 45.069 0.489 1
1 97 . 20 1 1 A 10 10 GLY N N 10 108.747 107.616 1.131 1
1 98 . 20 1 1 A 11 11 GLN H H 11 8.507 7.894 0.613 1
1 99 . 20 1 1 A 11 11 GLN HA H 11 4.202 4.302 -0.100 1
1 106 . 20 1 1 A 11 11 GLN C C 11 173.992 174.860 -0.868 1
1 107 . 20 1 1 A 11 11 GLN CA C 11 55.098 55.655 -0.557 1
1 108 . 20 1 1 A 11 11 GLN CB C 11 29.097 29.750 -0.653 1
1 110 . 20 1 1 A 11 11 GLN N N 11 122.979 120.460 2.519 1
1 112 . 20 1 1 A 12 12 ALA H H 12 8.259 8.482 -0.223 1
1 113 . 20 1 1 A 12 12 ALA HA H 12 5.156 5.350 -0.194 1
1 117 . 20 1 1 A 12 12 ALA C C 12 177.284 176.422 0.862 1
1 118 . 20 1 1 A 12 12 ALA CA C 12 51.087 50.182 0.905 1
1 119 . 20 1 1 A 12 12 ALA CB C 12 20.500 21.305 -0.805 1
1 120 . 20 1 1 A 12 12 ALA N N 12 127.100 124.395 2.705 1
1 121 . 20 1 1 A 13 13 TRP H H 13 9.245 9.374 -0.129 1
1 122 . 20 1 1 A 13 13 TRP HA H 13 4.717 5.352 -0.635 1
1 131 . 20 1 1 A 13 13 TRP C C 13 175.108 175.904 -0.796 1
1 132 . 20 1 1 A 13 13 TRP CA C 13 55.966 55.820 0.146 1
1 133 . 20 1 1 A 13 13 TRP CB C 13 31.912 34.080 -2.168 1
1 139 . 20 1 1 A 13 13 TRP N N 13 123.088 120.791 2.297 1
1 141 . 20 1 1 A 14 14 ARG H H 14 8.575 8.984 -0.409 1
1 142 . 20 1 1 A 14 14 ARG HA H 14 5.335 5.406 -0.071 1
1 150 . 20 1 1 A 14 14 ARG C C 14 175.191 175.091 0.100 1
1 151 . 20 1 1 A 14 14 ARG CA C 14 53.106 55.001 -1.895 1
1 152 . 20 1 1 A 14 14 ARG CB C 14 32.749 33.691 -0.942 1
1 154 . 20 1 1 A 14 14 ARG N N 14 121.163 121.012 0.151 1
1 156 . 20 1 1 A 15 15 HIS H H 15 8.595 9.850 -1.255 1
1 157 . 20 1 1 A 15 15 HIS HA H 15 4.790 5.291 -0.501 1
1 161 . 20 1 1 A 15 15 HIS C C 15 173.770 174.838 -1.068 1
1 162 . 20 1 1 A 15 15 HIS CA C 15 55.289 53.865 1.424 1
1 163 . 20 1 1 A 15 15 HIS CB C 15 33.208 33.001 0.207 1
1 165 . 20 1 1 A 15 15 HIS N N 15 117.643 121.294 -3.651 1
1 166 . 20 1 1 A 16 16 HIS H H 16 8.993 9.250 -0.257 1
1 167 . 20 1 1 A 16 16 HIS HA H 16 5.158 4.944 0.214 1
1 171 . 20 1 1 A 16 16 HIS C C 16 173.608 175.442 -1.834 1
1 172 . 20 1 1 A 16 16 HIS CA C 16 56.450 55.838 0.612 1
1 173 . 20 1 1 A 16 16 HIS CB C 16 34.171 30.975 3.196 1
1 175 . 20 1 1 A 16 16 HIS N N 16 123.520 120.327 3.193 1
1 176 . 20 1 1 A 17 17 ASN H H 17 7.829 9.417 -1.588 1
1 177 . 20 1 1 A 17 17 ASN HA H 17 4.713 5.416 -0.703 1
1 182 . 20 1 1 A 17 17 ASN C C 17 173.682 175.781 -2.099 1
1 183 . 20 1 1 A 17 17 ASN CA C 17 51.822 51.844 -0.022 1
1 184 . 20 1 1 A 17 17 ASN CB C 17 43.176 41.802 1.374 1
1 185 . 20 1 1 A 17 17 ASN N N 17 122.213 120.878 1.335 1
1 187 . 20 1 1 A 18 18 GLY H H 18 8.423 8.578 -0.155 1
1 188 . 20 1 1 A 18 18 GLY HA2 H 18 3.931 3.706 0.225 1
1 189 . 20 1 1 A 18 18 GLY HA3 H 18 3.707 3.882 -0.175 1
1 190 . 20 1 1 A 18 18 GLY C C 18 173.985 172.927 1.058 1
1 191 . 20 1 1 A 18 18 GLY CA C 18 43.949 44.331 -0.382 1
1 192 . 20 1 1 A 18 18 GLY N N 18 106.991 108.710 -1.719 1
1 193 . 20 1 1 A 19 19 PHE H H 19 8.338 7.490 0.848 1
1 194 . 20 1 1 A 19 19 PHE HA H 19 4.068 4.557 -0.489 1
1 197 . 20 1 1 A 19 19 PHE C C 19 176.568 175.523 1.045 1
1 198 . 20 1 1 A 19 19 PHE CA C 19 59.338 59.346 -0.008 1
1 199 . 20 1 1 A 19 19 PHE CB C 19 40.201 39.375 0.826 1
1 200 . 20 1 1 A 19 19 PHE N N 19 116.857 118.720 -1.863 1
1 201 . 20 1 1 A 20 20 ASP H H 20 8.794 8.742 0.052 1
1 202 . 20 1 1 A 20 20 ASP HA H 20 4.485 4.849 -0.364 1
1 205 . 20 1 1 A 20 20 ASP C C 20 177.379 177.312 0.067 1
1 206 . 20 1 1 A 20 20 ASP CA C 20 54.140 54.357 -0.217 1
1 207 . 20 1 1 A 20 20 ASP CB C 20 41.915 42.233 -0.318 1
1 208 . 20 1 1 A 20 20 ASP N N 20 123.025 125.003 -1.978 1
1 209 . 20 1 1 A 21 21 PHE H H 21 8.862 9.156 -0.294 1
1 210 . 20 1 1 A 21 21 PHE HA H 21 4.087 4.141 -0.054 1
1 218 . 20 1 1 A 21 21 PHE C C 21 176.952 177.289 -0.337 1
1 219 . 20 1 1 A 21 21 PHE CA C 21 61.095 62.374 -1.279 1
1 220 . 20 1 1 A 21 21 PHE CB C 21 38.678 39.216 -0.538 1
1 226 . 20 1 1 A 21 21 PHE N N 21 127.163 127.683 -0.520 1
1 227 . 20 1 1 A 22 22 ALA H H 22 8.561 8.063 0.498 1
1 228 . 20 1 1 A 22 22 ALA HA H 22 3.878 3.928 -0.050 1
1 232 . 20 1 1 A 22 22 ALA C C 22 180.710 180.218 0.492 1
1 233 . 20 1 1 A 22 22 ALA CA C 22 55.211 55.086 0.125 1
1 234 . 20 1 1 A 22 22 ALA CB C 22 18.321 18.123 0.198 1
1 235 . 20 1 1 A 22 22 ALA N N 22 120.293 121.293 -1.000 1
1 236 . 20 1 1 A 23 23 VAL H H 23 7.241 7.935 -0.694 1
1 237 . 20 1 1 A 23 23 VAL HA H 23 3.684 3.488 0.196 1
1 245 . 20 1 1 A 23 23 VAL C C 23 177.101 177.783 -0.682 1
1 246 . 20 1 1 A 23 23 VAL CA C 23 65.237 66.841 -1.604 1
1 247 . 20 1 1 A 23 23 VAL CB C 23 31.780 31.561 0.219 1
1 250 . 20 1 1 A 23 23 VAL N N 23 118.775 118.028 0.747 1
1 251 . 20 1 1 A 24 24 ILE H H 24 6.761 8.090 -1.329 1
1 252 . 20 1 1 A 24 24 ILE HA H 24 3.196 3.519 -0.323 1
1 262 . 20 1 1 A 24 24 ILE C C 24 177.287 177.565 -0.278 1
1 263 . 20 1 1 A 24 24 ILE CA C 24 63.404 65.842 -2.438 1
1 264 . 20 1 1 A 24 24 ILE CB C 24 36.294 37.753 -1.459 1
1 268 . 20 1 1 A 24 24 ILE N N 24 119.036 119.146 -0.110 1
1 269 . 20 1 1 A 25 25 LYS H H 25 8.032 8.193 -0.161 1
1 270 . 20 1 1 A 25 25 LYS HA H 25 3.809 3.530 0.279 1
1 279 . 20 1 1 A 25 25 LYS C C 25 179.450 178.720 0.730 1
1 280 . 20 1 1 A 25 25 LYS CA C 25 59.621 59.445 0.176 1
1 281 . 20 1 1 A 25 25 LYS CB C 25 32.259 32.066 0.193 1
1 285 . 20 1 1 A 25 25 LYS N N 25 118.368 120.246 -1.878 1
1 286 . 20 1 1 A 26 26 GLU H H 26 7.845 8.083 -0.238 1
1 287 . 20 1 1 A 26 26 GLU HA H 26 4.021 4.133 -0.112 1
1 292 . 20 1 1 A 26 26 GLU C C 26 179.191 178.942 0.249 1
1 293 . 20 1 1 A 26 26 GLU CA C 26 59.530 59.261 0.269 1
1 294 . 20 1 1 A 26 26 GLU CB C 26 29.449 29.114 0.335 1
1 296 . 20 1 1 A 26 26 GLU N N 26 120.522 117.457 3.065 1
1 297 . 20 1 1 A 27 27 LEU H H 27 8.165 8.048 0.117 1
1 298 . 20 1 1 A 27 27 LEU HA H 27 4.163 4.178 -0.015 1
1 308 . 20 1 1 A 27 27 LEU C C 27 177.256 178.387 -1.131 1
1 309 . 20 1 1 A 27 27 LEU CA C 27 58.049 57.708 0.341 1
1 310 . 20 1 1 A 27 27 LEU CB C 27 41.365 41.706 -0.341 1
1 314 . 20 1 1 A 27 27 LEU N N 27 120.879 123.006 -2.127 1
1 315 . 20 1 1 A 28 28 LYS H H 28 8.902 8.095 0.807 1
1 316 . 20 1 1 A 28 28 LYS HA H 28 4.199 4.326 -0.127 1
1 317 . 20 1 1 A 28 28 LYS C C 28 179.707 179.192 0.515 1
1 318 . 20 1 1 A 28 28 LYS CA C 28 60.097 59.264 0.833 1
1 319 . 20 1 1 A 28 28 LYS CB C 28 33.420 31.839 1.581 1
1 320 . 20 1 1 A 28 28 LYS N N 28 120.050 119.502 0.548 1
1 321 . 20 1 1 A 29 29 THR H H 29 8.294 7.822 0.472 1
1 322 . 20 1 1 A 29 29 THR HA H 29 3.892 3.918 -0.026 1
1 327 . 20 1 1 A 29 29 THR C C 29 175.711 176.058 -0.347 1
1 328 . 20 1 1 A 29 29 THR CA C 29 66.846 66.711 0.135 1
1 329 . 20 1 1 A 29 29 THR CB C 29 68.794 68.688 0.106 1
1 331 . 20 1 1 A 29 29 THR N N 29 115.933 116.408 -0.475 1
1 332 . 20 1 1 A 30 30 ALA H H 30 8.244 8.945 -0.701 1
1 333 . 20 1 1 A 30 30 ALA HA H 30 4.241 4.224 0.017 1
1 337 . 20 1 1 A 30 30 ALA C C 30 179.128 179.759 -0.631 1
1 338 . 20 1 1 A 30 30 ALA CA C 30 55.714 55.650 0.064 1
1 339 . 20 1 1 A 30 30 ALA CB C 30 18.955 18.508 0.447 1
1 340 . 20 1 1 A 30 30 ALA N N 30 124.617 122.995 1.622 1
1 341 . 20 1 1 A 31 31 ALA H H 31 8.968 8.602 0.366 1
1 342 . 20 1 1 A 31 31 ALA HA H 31 3.890 4.061 -0.171 1
1 346 . 20 1 1 A 31 31 ALA C C 31 180.352 179.789 0.563 1
1 347 . 20 1 1 A 31 31 ALA CA C 31 55.454 55.585 -0.131 1
1 348 . 20 1 1 A 31 31 ALA CB C 31 17.124 18.625 -1.501 1
1 349 . 20 1 1 A 31 31 ALA N N 31 119.327 120.008 -0.681 1
1 350 . 20 1 1 A 32 32 SER H H 32 7.995 8.116 -0.121 1
1 351 . 20 1 1 A 32 32 SER HA H 32 4.238 4.243 -0.005 1
1 354 . 20 1 1 A 32 32 SER C C 32 175.612 176.415 -0.803 1
1 355 . 20 1 1 A 32 32 SER CA C 32 61.203 61.266 -0.063 1
1 356 . 20 1 1 A 32 32 SER CB C 32 63.406 62.666 0.740 1
1 357 . 20 1 1 A 32 32 SER N N 32 111.962 113.090 -1.128 1
1 358 . 20 1 1 A 33 33 GLN H H 33 8.333 7.799 0.534 1
1 359 . 20 1 1 A 33 33 GLN HA H 33 3.992 4.374 -0.382 1
1 366 . 20 1 1 A 33 33 GLN C C 33 177.486 177.234 0.252 1
1 367 . 20 1 1 A 33 33 GLN CA C 33 58.277 57.712 0.565 1
1 368 . 20 1 1 A 33 33 GLN CB C 33 29.140 30.099 -0.959 1
1 370 . 20 1 1 A 33 33 GLN N N 33 119.527 120.688 -1.161 1
1 372 . 20 1 1 A 34 34 TYR H H 34 8.587 8.304 0.283 1
1 373 . 20 1 1 A 34 34 TYR HA H 34 4.792 4.679 0.113 1
1 380 . 20 1 1 A 34 34 TYR C C 34 176.499 176.661 -0.162 1
1 381 . 20 1 1 A 34 34 TYR CA C 34 57.711 58.601 -0.890 1
1 382 . 20 1 1 A 34 34 TYR CB C 34 39.561 39.907 -0.346 1
1 387 . 20 1 1 A 34 34 TYR N N 34 114.610 114.240 0.370 1
1 388 . 20 1 1 A 35 35 GLY H H 35 7.346 8.300 -0.954 1
1 389 . 20 1 1 A 35 35 GLY HA2 H 35 4.785 4.114 0.671 1
1 390 . 20 1 1 A 35 35 GLY HA3 H 35 4.007 4.115 -0.108 1
1 391 . 20 1 1 A 35 35 GLY C C 35 175.796 173.221 2.575 1
1 392 . 20 1 1 A 35 35 GLY CA C 35 44.355 44.772 -0.417 1
1 393 . 20 1 1 A 35 35 GLY N N 35 108.501 106.320 2.181 1
1 394 . 20 1 1 A 36 36 ALA H H 36 9.363 7.819 1.544 1
1 395 . 20 1 1 A 36 36 ALA HA H 36 4.217 4.621 -0.404 1
1 399 . 20 1 1 A 36 36 ALA C C 36 178.039 177.304 0.735 1
1 400 . 20 1 1 A 36 36 ALA CA C 36 56.114 51.532 4.582 1
1 401 . 20 1 1 A 36 36 ALA CB C 36 19.179 18.498 0.681 1
1 402 . 20 1 1 A 36 36 ALA N N 36 125.811 122.887 2.924 1
1 403 . 20 1 1 A 37 37 THR H H 37 8.070 7.823 0.247 1
1 404 . 20 1 1 A 37 37 THR HA H 37 4.570 4.531 0.039 1
1 409 . 20 1 1 A 37 37 THR C C 37 173.685 174.094 -0.409 1
1 410 . 20 1 1 A 37 37 THR CA C 37 59.822 62.411 -2.589 1
1 411 . 20 1 1 A 37 37 THR CB C 37 68.267 72.172 -3.905 1
1 413 . 20 1 1 A 37 37 THR N N 37 129.410 118.523 10.887 1
1 414 . 20 1 1 A 38 38 ALA H H 38 6.853 7.515 -0.662 1
1 415 . 20 1 1 A 38 38 ALA HA H 38 4.601 4.628 -0.027 1
1 419 . 20 1 1 A 38 38 ALA CA C 38 50.758 50.001 0.757 1
1 420 . 20 1 1 A 38 38 ALA CB C 38 18.325 19.718 -1.393 1
1 421 . 20 1 1 A 38 38 ALA N N 38 124.674 124.924 -0.250 1
1 422 . 20 1 1 A 40 40 TYR HA H 40 4.032 3.975 0.057 1
1 429 . 20 1 1 A 40 40 TYR C C 40 176.456 177.058 -0.602 1
1 430 . 20 1 1 A 40 40 TYR CA C 40 61.010 61.661 -0.651 1
1 431 . 20 1 1 A 40 40 TYR CB C 40 39.286 38.407 0.879 1
1 436 . 20 1 1 A 41 41 THR H H 41 6.874 8.215 -1.341 1
1 437 . 20 1 1 A 41 41 THR HA H 41 3.616 3.873 -0.257 1
1 442 . 20 1 1 A 41 41 THR C C 41 176.930 177.370 -0.440 1
1 443 . 20 1 1 A 41 41 THR CA C 41 65.557 66.742 -1.185 1
1 444 . 20 1 1 A 41 41 THR CB C 41 68.228 68.388 -0.160 1
1 446 . 20 1 1 A 41 41 THR N N 41 115.143 113.934 1.209 1
1 447 . 20 1 1 A 42 42 LEU H H 42 8.623 7.389 1.234 1
1 448 . 20 1 1 A 42 42 LEU HA H 42 3.708 4.052 -0.344 1
1 458 . 20 1 1 A 42 42 LEU C C 42 178.206 179.105 -0.899 1
1 459 . 20 1 1 A 42 42 LEU CA C 42 57.417 57.751 -0.334 1
1 460 . 20 1 1 A 42 42 LEU CB C 42 41.342 41.203 0.139 1
1 464 . 20 1 1 A 42 42 LEU N N 42 120.418 117.713 2.705 1
1 465 . 20 1 1 A 43 43 ALA H H 43 7.735 7.766 -0.031 1
1 466 . 20 1 1 A 43 43 ALA HA H 43 4.020 4.001 0.019 1
1 470 . 20 1 1 A 43 43 ALA C C 43 180.826 180.423 0.403 1
1 471 . 20 1 1 A 43 43 ALA CA C 43 54.925 54.840 0.085 1
1 472 . 20 1 1 A 43 43 ALA CB C 43 17.506 18.241 -0.735 1
1 473 . 20 1 1 A 43 43 ALA N N 43 120.203 121.884 -1.681 1
1 474 . 20 1 1 A 44 44 ILE H H 44 7.149 7.366 -0.217 1
1 475 . 20 1 1 A 44 44 ILE HA H 44 3.603 3.695 -0.092 1
1 485 . 20 1 1 A 44 44 ILE C C 44 178.594 178.268 0.326 1
1 486 . 20 1 1 A 44 44 ILE CA C 44 64.782 64.599 0.183 1
1 487 . 20 1 1 A 44 44 ILE CB C 44 37.472 37.795 -0.323 1
1 491 . 20 1 1 A 44 44 ILE N N 44 118.881 119.659 -0.778 1
1 492 . 20 1 1 A 45 45 VAL H H 45 7.968 7.535 0.433 1
1 493 . 20 1 1 A 45 45 VAL HA H 45 2.925 3.366 -0.441 1
1 501 . 20 1 1 A 45 45 VAL C C 45 177.023 177.256 -0.233 1
1 502 . 20 1 1 A 45 45 VAL CA C 45 67.081 66.866 0.215 1
1 503 . 20 1 1 A 45 45 VAL CB C 45 30.854 31.058 -0.204 1
1 506 . 20 1 1 A 45 45 VAL N N 45 120.764 119.366 1.398 1
1 507 . 20 1 1 A 46 46 GLU H H 46 8.399 8.327 0.072 1
1 508 . 20 1 1 A 46 46 GLU HA H 46 3.848 3.892 -0.044 1
1 513 . 20 1 1 A 46 46 GLU C C 46 178.656 178.824 -0.168 1
1 514 . 20 1 1 A 46 46 GLU CA C 46 59.491 59.663 -0.172 1
1 515 . 20 1 1 A 46 46 GLU CB C 46 28.991 29.608 -0.617 1
1 517 . 20 1 1 A 46 46 GLU N N 46 116.599 119.759 -3.160 1
1 518 . 20 1 1 A 47 47 SER H H 47 7.273 8.209 -0.936 1
1 519 . 20 1 1 A 47 47 SER HA H 47 4.287 4.203 0.084 1
1 521 . 20 1 1 A 47 47 SER CA C 47 61.047 61.296 -0.249 1
1 522 . 20 1 1 A 47 47 SER CB C 47 63.016 62.485 0.531 1
1 523 . 20 1 1 A 47 47 SER N N 47 113.609 115.228 -1.619 1
1 524 . 20 1 1 A 48 48 VAL H H 48 8.006 8.089 -0.083 1
1 525 . 20 1 1 A 48 48 VAL HA H 48 3.556 3.625 -0.069 1
1 533 . 20 1 1 A 48 48 VAL C C 48 177.257 177.525 -0.268 1
1 534 . 20 1 1 A 48 48 VAL CA C 48 65.025 66.430 -1.405 1
1 535 . 20 1 1 A 48 48 VAL CB C 48 31.841 31.446 0.395 1
1 538 . 20 1 1 A 48 48 VAL N N 48 122.327 122.555 -0.228 1
1 539 . 20 1 1 A 49 49 ALA H H 49 8.369 7.822 0.547 1
1 540 . 20 1 1 A 49 49 ALA HA H 49 4.115 4.328 -0.213 1
1 544 . 20 1 1 A 49 49 ALA C C 49 177.307 178.072 -0.765 1
1 545 . 20 1 1 A 49 49 ALA CA C 49 53.253 53.270 -0.017 1
1 546 . 20 1 1 A 49 49 ALA CB C 49 20.131 18.289 1.842 1
1 547 . 20 1 1 A 49 49 ALA N N 49 118.050 120.928 -2.878 1
1 548 . 20 1 1 A 50 50 ASP H H 50 7.052 7.920 -0.868 1
1 549 . 20 1 1 A 50 50 ASP HA H 50 4.788 4.699 0.089 1
1 552 . 20 1 1 A 50 50 ASP C C 50 175.481 176.296 -0.815 1
1 553 . 20 1 1 A 50 50 ASP CA C 50 53.681 55.047 -1.366 1
1 554 . 20 1 1 A 50 50 ASP CB C 50 39.333 41.060 -1.727 1
1 555 . 20 1 1 A 50 50 ASP N N 50 116.997 117.623 -0.626 1
1 556 . 20 1 1 A 51 51 ASN H H 51 8.535 7.556 0.979 1
1 557 . 20 1 1 A 51 51 ASN HA H 51 4.628 5.149 -0.521 1
1 562 . 20 1 1 A 51 51 ASN C C 51 174.077 175.087 -1.010 1
1 563 . 20 1 1 A 51 51 ASN CA C 51 52.315 51.922 0.393 1
1 564 . 20 1 1 A 51 51 ASN CB C 51 41.928 41.109 0.819 1
1 565 . 20 1 1 A 51 51 ASN N N 51 118.626 117.529 1.097 1
1 567 . 20 1 1 A 52 52 TRP H H 52 8.555 8.762 -0.207 1
1 574 . 20 1 1 A 52 52 TRP C C 52 173.269 176.322 -3.053 1
1 575 . 20 1 1 A 52 52 TRP CA C 52 55.031 56.438 -1.407 1
1 576 . 20 1 1 A 52 52 TRP CB C 52 26.801 29.979 -3.178 1
1 582 . 20 1 1 A 52 52 TRP N N 52 120.693 120.028 0.665 1
1 584 . 20 1 1 A 53 53 LEU H H 53 7.847 8.897 -1.050 1
1 585 . 20 1 1 A 53 53 LEU HA H 53 4.859 5.093 -0.234 1
1 595 . 20 1 1 A 53 53 LEU C C 53 177.397 174.793 2.604 1
1 596 . 20 1 1 A 53 53 LEU CA C 53 53.619 53.385 0.234 1
1 597 . 20 1 1 A 53 53 LEU CB C 53 41.812 46.080 -4.268 1
1 601 . 20 1 1 A 53 53 LEU N N 53 124.741 121.167 3.574 1
1 602 . 20 1 1 A 54 54 THR H H 54 8.850 8.732 0.118 1
1 603 . 20 1 1 A 54 54 THR HA H 54 4.598 4.475 0.123 1
1 608 . 20 1 1 A 54 54 THR CA C 54 60.531 60.656 -0.125 1
1 609 . 20 1 1 A 54 54 THR CB C 54 67.183 68.592 -1.409 1
1 611 . 20 1 1 A 54 54 THR N N 54 113.407 115.936 -2.529 1
1 612 . 20 1 1 A 55 55 PRO HA H 55 4.511 4.349 0.162 1
1 619 . 20 1 1 A 55 55 PRO C C 55 179.383 178.953 0.430 1
1 620 . 20 1 1 A 55 55 PRO CA C 55 67.159 65.683 1.476 1
1 621 . 20 1 1 A 55 55 PRO CB C 55 32.095 31.903 0.192 1
1 622 . 20 1 1 A 56 56 THR H H 56 8.575 7.920 0.655 1
1 623 . 20 1 1 A 56 56 THR HA H 56 4.229 4.130 0.099 1
1 628 . 20 1 1 A 56 56 THR C C 56 176.668 176.136 0.532 1
1 629 . 20 1 1 A 56 56 THR CA C 56 66.943 65.933 1.010 1
1 630 . 20 1 1 A 56 56 THR CB C 56 68.129 68.195 -0.066 1
1 632 . 20 1 1 A 56 56 THR N N 56 114.855 110.690 4.165 1
1 633 . 20 1 1 A 57 57 ASP H H 57 8.730 8.054 0.676 1
1 634 . 20 1 1 A 57 57 ASP HA H 57 4.425 4.829 -0.404 1
1 637 . 20 1 1 A 57 57 ASP C C 57 178.351 178.724 -0.373 1
1 638 . 20 1 1 A 57 57 ASP CA C 57 57.963 57.377 0.586 1
1 639 . 20 1 1 A 57 57 ASP CB C 57 40.134 41.298 -1.164 1
1 640 . 20 1 1 A 57 57 ASP N N 57 126.239 121.091 5.148 1
1 641 . 20 1 1 A 58 58 TRP H H 58 8.244 8.590 -0.346 1
1 642 . 20 1 1 A 58 58 TRP HA H 58 4.030 4.589 -0.559 1
1 650 . 20 1 1 A 58 58 TRP C C 58 177.432 179.431 -1.999 1
1 651 . 20 1 1 A 58 58 TRP CA C 58 62.731 60.286 2.445 1
1 652 . 20 1 1 A 58 58 TRP CB C 58 29.122 29.323 -0.201 1
1 657 . 20 1 1 A 58 58 TRP N N 58 119.241 121.319 -2.078 1
1 659 . 20 1 1 A 59 59 ASN H H 59 8.098 9.180 -1.082 1
1 660 . 20 1 1 A 59 59 ASN HA H 59 4.424 4.420 0.004 1
1 663 . 20 1 1 A 59 59 ASN C C 59 176.952 178.035 -1.083 1
1 664 . 20 1 1 A 59 59 ASN CA C 59 58.135 56.497 1.638 1
1 665 . 20 1 1 A 59 59 ASN CB C 59 40.168 38.466 1.702 1
1 666 . 20 1 1 A 59 59 ASN N N 59 115.747 117.984 -2.237 1
1 667 . 20 1 1 A 60 60 THR H H 60 8.712 7.603 1.109 1
1 668 . 20 1 1 A 60 60 THR HA H 60 3.717 3.986 -0.269 1
1 673 . 20 1 1 A 60 60 THR C C 60 176.044 176.480 -0.436 1
1 674 . 20 1 1 A 60 60 THR CA C 60 66.576 66.758 -0.182 1
1 675 . 20 1 1 A 60 60 THR CB C 60 69.251 67.943 1.308 1
1 677 . 20 1 1 A 60 60 THR N N 60 114.896 118.020 -3.124 1
1 678 . 20 1 1 A 61 61 LEU H H 61 8.485 8.270 0.215 1
1 679 . 20 1 1 A 61 61 LEU HA H 61 3.391 4.041 -0.650 1
1 689 . 20 1 1 A 61 61 LEU C C 61 177.433 178.764 -1.331 1
1 690 . 20 1 1 A 61 61 LEU CA C 61 58.354 58.567 -0.213 1
1 691 . 20 1 1 A 61 61 LEU CB C 61 41.761 42.194 -0.433 1
1 695 . 20 1 1 A 61 61 LEU N N 61 123.433 122.215 1.218 1
1 696 . 20 1 1 A 62 62 VAL H H 62 8.073 8.428 -0.355 1
1 697 . 20 1 1 A 62 62 VAL HA H 62 3.207 3.809 -0.602 1
1 705 . 20 1 1 A 62 62 VAL C C 62 177.585 177.595 -0.010 1
1 706 . 20 1 1 A 62 62 VAL CA C 62 67.345 65.424 1.921 1
1 707 . 20 1 1 A 62 62 VAL CB C 62 30.905 30.770 0.135 1
1 710 . 20 1 1 A 62 62 VAL N N 62 116.018 118.571 -2.553 1
1 711 . 20 1 1 A 63 63 ARG H H 63 7.765 8.016 -0.251 1
1 712 . 20 1 1 A 63 63 ARG HA H 63 3.602 4.001 -0.399 1
1 719 . 20 1 1 A 63 63 ARG C C 63 177.818 178.031 -0.213 1
1 720 . 20 1 1 A 63 63 ARG CA C 63 58.049 57.898 0.151 1
1 721 . 20 1 1 A 63 63 ARG CB C 63 29.955 29.064 0.891 1
1 724 . 20 1 1 A 63 63 ARG N N 63 116.700 120.725 -4.025 1
1 725 . 20 1 1 A 64 64 ALA H H 64 7.574 7.415 0.159 1
1 726 . 20 1 1 A 64 64 ALA HA H 64 4.158 4.369 -0.211 1
1 730 . 20 1 1 A 64 64 ALA C C 64 179.886 179.262 0.624 1
1 731 . 20 1 1 A 64 64 ALA CA C 64 54.007 53.755 0.252 1
1 732 . 20 1 1 A 64 64 ALA CB C 64 19.147 19.888 -0.741 1
1 733 . 20 1 1 A 64 64 ALA N N 64 117.555 122.201 -4.646 1
1 734 . 20 1 1 A 65 65 VAL H H 65 7.554 7.937 -0.383 1
1 735 . 20 1 1 A 65 65 VAL HA H 65 4.253 3.750 0.503 1
1 743 . 20 1 1 A 65 65 VAL C C 65 174.180 176.259 -2.079 1
1 744 . 20 1 1 A 65 65 VAL CA C 65 62.683 65.316 -2.633 1
1 745 . 20 1 1 A 65 65 VAL CB C 65 33.458 31.449 2.009 1
1 748 . 20 1 1 A 65 65 VAL N N 65 110.013 115.506 -5.493 1
1 749 . 20 1 1 A 66 66 LEU H H 66 7.792 7.051 0.741 1
1 750 . 20 1 1 A 66 66 LEU HA H 66 4.790 4.758 0.032 1
1 760 . 20 1 1 A 66 66 LEU C C 66 177.537 175.295 2.242 1
1 761 . 20 1 1 A 66 66 LEU CA C 66 52.823 52.696 0.127 1
1 762 . 20 1 1 A 66 66 LEU CB C 66 44.071 45.383 -1.312 1
1 766 . 20 1 1 A 66 66 LEU N N 66 118.967 121.628 -2.661 1
1 767 . 20 1 1 A 67 67 SER H H 67 9.208 8.636 0.572 1
1 768 . 20 1 1 A 67 67 SER HA H 67 4.414 4.671 -0.257 1
1 771 . 20 1 1 A 67 67 SER CA C 67 57.943 56.970 0.973 1
1 772 . 20 1 1 A 67 67 SER CB C 67 64.743 65.423 -0.680 1
1 773 . 20 1 1 A 67 67 SER N N 67 116.378 116.348 0.030 1
1 774 . 20 1 1 A 69 69 GLY HA2 H 69 3.916 3.695 0.221 1
1 775 . 20 1 1 A 69 69 GLY HA3 H 69 3.867 3.737 0.130 1
1 776 . 20 1 1 A 69 69 GLY C C 69 176.783 175.348 1.435 1
1 777 . 20 1 1 A 69 69 GLY CA C 69 46.977 46.943 0.034 1
1 778 . 20 1 1 A 70 70 ASP H H 70 7.674 8.078 -0.404 1
1 779 . 20 1 1 A 70 70 ASP HA H 70 4.511 3.675 0.836 1
1 782 . 20 1 1 A 70 70 ASP C C 70 178.096 178.093 0.003 1
1 783 . 20 1 1 A 70 70 ASP CA C 70 57.262 56.421 0.841 1
1 784 . 20 1 1 A 70 70 ASP CB C 70 40.594 39.678 0.916 1
1 785 . 20 1 1 A 70 70 ASP N N 70 123.930 122.216 1.714 1
1 786 . 20 1 1 A 71 71 HIS H H 71 8.729 7.848 0.881 1
1 787 . 20 1 1 A 71 71 HIS HA H 71 4.235 4.070 0.165 1
1 790 . 20 1 1 A 71 71 HIS C C 71 176.769 176.542 0.227 1
1 791 . 20 1 1 A 71 71 HIS CA C 71 60.041 59.890 0.151 1
1 792 . 20 1 1 A 71 71 HIS CB C 71 30.682 29.894 0.788 1
1 793 . 20 1 1 A 71 71 HIS N N 71 121.003 119.577 1.426 1
1 794 . 20 1 1 A 72 72 LEU H H 72 7.620 7.939 -0.319 1
1 795 . 20 1 1 A 72 72 LEU HA H 72 3.769 3.882 -0.113 1
1 805 . 20 1 1 A 72 72 LEU C C 72 180.275 179.261 1.014 1
1 806 . 20 1 1 A 72 72 LEU CA C 72 58.192 57.986 0.206 1
1 807 . 20 1 1 A 72 72 LEU CB C 72 41.381 41.214 0.167 1
1 811 . 20 1 1 A 72 72 LEU N N 72 118.569 118.336 0.233 1
1 812 . 20 1 1 A 73 73 LEU H H 73 7.542 7.552 -0.010 1
1 813 . 20 1 1 A 73 73 LEU HA H 73 4.107 4.109 -0.002 1
1 823 . 20 1 1 A 73 73 LEU C C 73 179.436 179.129 0.307 1
1 824 . 20 1 1 A 73 73 LEU CA C 73 58.026 57.262 0.764 1
1 825 . 20 1 1 A 73 73 LEU CB C 73 41.638 41.990 -0.352 1
1 829 . 20 1 1 A 73 73 LEU N N 73 121.418 120.825 0.593 1
1 830 . 20 1 1 A 74 74 TRP H H 74 8.786 7.915 0.871 1
1 831 . 20 1 1 A 74 74 TRP HA H 74 3.589 5.176 -1.587 1
1 840 . 20 1 1 A 74 74 TRP C C 74 176.816 178.640 -1.824 1
1 841 . 20 1 1 A 74 74 TRP CA C 74 63.046 59.637 3.409 1
1 842 . 20 1 1 A 74 74 TRP CB C 74 28.065 28.895 -0.830 1
1 848 . 20 1 1 A 74 74 TRP N N 74 121.111 118.070 3.041 1
1 850 . 20 1 1 A 75 75 LYS H H 75 8.939 7.403 1.536 1
1 851 . 20 1 1 A 75 75 LYS HA H 75 3.055 3.878 -0.823 1
1 860 . 20 1 1 A 75 75 LYS C C 75 177.967 178.608 -0.641 1
1 861 . 20 1 1 A 75 75 LYS CA C 75 60.029 58.087 1.942 1
1 862 . 20 1 1 A 75 75 LYS CB C 75 32.533 32.668 -0.135 1
1 866 . 20 1 1 A 75 75 LYS N N 75 119.783 118.337 1.446 1
1 867 . 20 1 1 A 76 76 SER H H 76 7.832 7.928 -0.096 1
1 868 . 20 1 1 A 76 76 SER HA H 76 4.040 3.827 0.213 1
1 871 . 20 1 1 A 76 76 SER C C 76 177.816 176.874 0.942 1
1 872 . 20 1 1 A 76 76 SER CA C 76 62.105 61.416 0.689 1
1 873 . 20 1 1 A 76 76 SER CB C 76 62.679 62.899 -0.220 1
1 874 . 20 1 1 A 76 76 SER N N 76 113.395 116.464 -3.069 1
1 875 . 20 1 1 A 77 77 GLU H H 77 7.590 7.352 0.238 1
1 876 . 20 1 1 A 77 77 GLU HA H 77 4.042 4.105 -0.063 1
1 881 . 20 1 1 A 77 77 GLU C C 77 177.809 178.701 -0.892 1
1 882 . 20 1 1 A 77 77 GLU CA C 77 58.270 58.848 -0.578 1
1 883 . 20 1 1 A 77 77 GLU CB C 77 29.208 29.471 -0.263 1
1 885 . 20 1 1 A 77 77 GLU N N 77 121.574 122.547 -0.973 1
1 886 . 20 1 1 A 78 78 PHE H H 78 9.081 7.722 1.359 1
1 887 . 20 1 1 A 78 78 PHE HA H 78 3.778 4.218 -0.440 1
1 895 . 20 1 1 A 78 78 PHE C C 78 178.114 177.555 0.559 1
1 896 . 20 1 1 A 78 78 PHE CA C 78 60.629 61.358 -0.729 1
1 897 . 20 1 1 A 78 78 PHE CB C 78 38.295 38.785 -0.490 1
1 902 . 20 1 1 A 78 78 PHE N N 78 122.682 121.752 0.930 1
1 903 . 20 1 1 A 79 79 PHE H H 79 8.890 8.145 0.745 1
1 904 . 20 1 1 A 79 79 PHE HA H 79 3.800 4.193 -0.393 1
1 912 . 20 1 1 A 79 79 PHE C C 79 178.354 178.543 -0.189 1
1 913 . 20 1 1 A 79 79 PHE CA C 79 60.704 61.693 -0.989 1
1 914 . 20 1 1 A 79 79 PHE CB C 79 37.184 38.952 -1.768 1
1 920 . 20 1 1 A 79 79 PHE N N 79 121.056 118.192 2.864 1
1 921 . 20 1 1 A 80 80 GLU H H 80 7.793 8.185 -0.392 1
1 922 . 20 1 1 A 80 80 GLU HA H 80 4.082 4.097 -0.015 1
1 927 . 20 1 1 A 80 80 GLU C C 80 179.068 179.054 0.014 1
1 928 . 20 1 1 A 80 80 GLU CA C 80 59.735 59.380 0.355 1
1 929 . 20 1 1 A 80 80 GLU CB C 80 28.722 29.348 -0.626 1
1 931 . 20 1 1 A 80 80 GLU N N 80 120.312 117.913 2.399 1
1 932 . 20 1 1 A 81 81 ASN H H 81 8.624 8.668 -0.044 1
1 933 . 20 1 1 A 81 81 ASN HA H 81 4.521 4.492 0.029 1
1 938 . 20 1 1 A 81 81 ASN C C 81 179.262 177.817 1.445 1
1 939 . 20 1 1 A 81 81 ASN CA C 81 55.504 56.321 -0.817 1
1 940 . 20 1 1 A 81 81 ASN CB C 81 37.517 37.616 -0.099 1
1 941 . 20 1 1 A 81 81 ASN N N 81 119.338 118.452 0.886 1
1 943 . 20 1 1 A 82 82 CYS H H 82 8.554 8.424 0.130 1
1 944 . 20 1 1 A 82 82 CYS HA H 82 3.792 3.995 -0.203 1
1 947 . 20 1 1 A 82 82 CYS C C 82 176.478 176.941 -0.463 1
1 948 . 20 1 1 A 82 82 CYS CA C 82 65.232 62.231 3.001 1
1 949 . 20 1 1 A 82 82 CYS CB C 82 26.762 26.871 -0.109 1
1 950 . 20 1 1 A 82 82 CYS N N 82 120.576 118.753 1.823 1
1 951 . 20 1 1 A 83 83 ARG H H 83 8.522 7.860 0.662 1
1 952 . 20 1 1 A 83 83 ARG HA H 83 3.932 4.183 -0.251 1
1 960 . 20 1 1 A 83 83 ARG C C 83 179.138 178.732 0.406 1
1 961 . 20 1 1 A 83 83 ARG CA C 83 60.443 59.036 1.407 1
1 962 . 20 1 1 A 83 83 ARG CB C 83 29.550 30.123 -0.573 1
1 965 . 20 1 1 A 83 83 ARG N N 83 123.035 120.308 2.727 1
1 967 . 20 1 1 A 84 84 ASP H H 84 7.791 8.270 -0.479 1
1 968 . 20 1 1 A 84 84 ASP HA H 84 4.353 4.415 -0.062 1
1 971 . 20 1 1 A 84 84 ASP C C 84 178.649 178.574 0.075 1
1 972 . 20 1 1 A 84 84 ASP CA C 84 57.767 57.578 0.189 1
1 973 . 20 1 1 A 84 84 ASP CB C 84 41.305 41.577 -0.272 1
1 974 . 20 1 1 A 84 84 ASP N N 84 120.332 119.641 0.691 1
1 975 . 20 1 1 A 85 85 THR H H 85 8.370 8.047 0.323 1
1 976 . 20 1 1 A 85 85 THR HA H 85 3.730 3.901 -0.171 1
1 981 . 20 1 1 A 85 85 THR C C 85 175.198 176.467 -1.269 1
1 982 . 20 1 1 A 85 85 THR CA C 85 66.830 66.127 0.703 1
1 983 . 20 1 1 A 85 85 THR CB C 85 68.533 68.420 0.113 1
1 985 . 20 1 1 A 85 85 THR N N 85 117.360 115.719 1.641 1
1 986 . 20 1 1 A 86 86 ALA H H 86 8.845 8.297 0.548 1
1 987 . 20 1 1 A 86 86 ALA HA H 86 3.991 4.113 -0.122 1
1 991 . 20 1 1 A 86 86 ALA C C 86 179.980 179.927 0.053 1
1 992 . 20 1 1 A 86 86 ALA CA C 86 55.769 55.692 0.077 1
1 993 . 20 1 1 A 86 86 ALA CB C 86 17.881 18.804 -0.923 1
1 994 . 20 1 1 A 86 86 ALA N N 86 123.613 123.434 0.179 1
1 995 . 20 1 1 A 87 87 LYS H H 87 7.686 8.196 -0.510 1
1 996 . 20 1 1 A 87 87 LYS HA H 87 4.099 3.970 0.129 1
1 1005 . 20 1 1 A 87 87 LYS C C 87 179.592 179.489 0.103 1
1 1006 . 20 1 1 A 87 87 LYS CA C 87 59.708 59.812 -0.104 1
1 1007 . 20 1 1 A 87 87 LYS CB C 87 32.054 32.384 -0.330 1
1 1011 . 20 1 1 A 87 87 LYS N N 87 119.623 117.356 2.267 1
1 1012 . 20 1 1 A 88 88 ARG H H 88 7.683 7.647 0.036 1
1 1013 . 20 1 1 A 88 88 ARG HA H 88 4.051 4.151 -0.100 1
1 1020 . 20 1 1 A 88 88 ARG C C 88 180.053 178.763 1.290 1
1 1021 . 20 1 1 A 88 88 ARG CA C 88 59.558 58.792 0.766 1
1 1022 . 20 1 1 A 88 88 ARG CB C 88 29.684 29.688 -0.004 1
1 1025 . 20 1 1 A 88 88 ARG N N 88 120.788 119.035 1.753 1
1 1026 . 20 1 1 A 89 89 ASN H H 89 8.973 8.117 0.856 1
1 1027 . 20 1 1 A 89 89 ASN HA H 89 4.354 4.552 -0.198 1
1 1032 . 20 1 1 A 89 89 ASN C C 89 178.382 178.006 0.376 1
1 1033 . 20 1 1 A 89 89 ASN CA C 89 55.334 56.127 -0.793 1
1 1034 . 20 1 1 A 89 89 ASN CB C 89 37.864 38.435 -0.571 1
1 1035 . 20 1 1 A 89 89 ASN N N 89 121.012 117.810 3.202 1
1 1037 . 20 1 1 A 90 90 GLN H H 90 8.152 8.361 -0.209 1
1 1038 . 20 1 1 A 90 90 GLN HA H 90 4.020 4.066 -0.046 1
1 1045 . 20 1 1 A 90 90 GLN C C 90 179.075 178.616 0.459 1
1 1046 . 20 1 1 A 90 90 GLN CA C 90 59.318 58.890 0.428 1
1 1047 . 20 1 1 A 90 90 GLN CB C 90 28.049 28.211 -0.162 1
1 1049 . 20 1 1 A 90 90 GLN N N 90 122.122 118.701 3.421 1
1 1051 . 20 1 1 A 91 91 GLN H H 91 7.514 8.091 -0.577 1
1 1052 . 20 1 1 A 91 91 GLN HA H 91 4.053 4.163 -0.110 1
1 1059 . 20 1 1 A 91 91 GLN C C 91 177.081 177.829 -0.748 1
1 1060 . 20 1 1 A 91 91 GLN CA C 91 58.031 57.311 0.720 1
1 1061 . 20 1 1 A 91 91 GLN CB C 91 28.365 27.123 1.242 1
1 1063 . 20 1 1 A 91 91 GLN N N 91 118.124 118.167 -0.043 1
1 1065 . 20 1 1 A 92 92 ALA H H 92 7.704 7.678 0.026 1
1 1066 . 20 1 1 A 92 92 ALA HA H 92 4.246 4.315 -0.069 1
1 1070 . 20 1 1 A 92 92 ALA C C 92 178.450 178.108 0.342 1
1 1071 . 20 1 1 A 92 92 ALA CA C 92 52.671 52.806 -0.135 1
1 1072 . 20 1 1 A 92 92 ALA CB C 92 19.316 19.816 -0.500 1
1 1073 . 20 1 1 A 92 92 ALA N N 92 119.880 120.394 -0.514 1
1 1074 . 20 1 1 A 93 93 GLY H H 93 7.693 8.264 -0.571 1
1 1075 . 20 1 1 A 93 93 GLY HA2 H 93 3.941 3.958 -0.017 1
1 1076 . 20 1 1 A 93 93 GLY HA3 H 93 3.744 3.960 -0.216 1
1 1077 . 20 1 1 A 93 93 GLY C C 93 174.344 175.030 -0.686 1
1 1078 . 20 1 1 A 93 93 GLY CA C 93 45.949 46.291 -0.342 1
1 1079 . 20 1 1 A 93 93 GLY N N 93 105.347 106.267 -0.920 1
1 1080 . 20 1 1 A 94 94 ASN H H 94 7.076 8.065 -0.989 1
1 1081 . 20 1 1 A 94 94 ASN HA H 94 4.115 4.557 -0.442 1
1 1085 . 20 1 1 A 94 94 ASN C C 94 175.410 175.488 -0.078 1
1 1086 . 20 1 1 A 94 94 ASN CA C 94 52.651 52.746 -0.095 1
1 1087 . 20 1 1 A 94 94 ASN CB C 94 38.330 39.500 -1.170 1
1 1088 . 20 1 1 A 94 94 ASN N N 94 115.747 116.094 -0.347 1
1 1090 . 20 1 1 A 95 95 GLY H H 95 8.236 8.719 -0.483 1
1 1091 . 20 1 1 A 95 95 GLY HA2 H 95 3.633 3.584 0.049 1
1 1092 . 20 1 1 A 95 95 GLY HA3 H 95 3.633 3.771 -0.138 1
1 1093 . 20 1 1 A 95 95 GLY C C 95 174.450 173.405 1.045 1
1 1094 . 20 1 1 A 95 95 GLY CA C 95 45.522 45.583 -0.061 1
1 1095 . 20 1 1 A 95 95 GLY N N 95 109.166 106.866 2.300 1
1 1096 . 20 1 1 A 96 96 TRP H H 96 7.899 7.929 -0.030 1
1 1097 . 20 1 1 A 96 96 TRP HA H 96 5.241 5.101 0.140 1
1 1106 . 20 1 1 A 96 96 TRP C C 96 175.661 175.681 -0.020 1
1 1107 . 20 1 1 A 96 96 TRP CA C 96 55.090 56.108 -1.018 1
1 1108 . 20 1 1 A 96 96 TRP CB C 96 27.138 32.369 -5.231 1
1 1114 . 20 1 1 A 96 96 TRP N N 96 122.840 119.623 3.217 1
1 1116 . 20 1 1 A 97 97 ASP H H 97 7.344 9.007 -1.663 1
1 1117 . 20 1 1 A 97 97 ASP HA H 97 4.829 4.354 0.475 1
1 1120 . 20 1 1 A 97 97 ASP C C 97 175.019 176.141 -1.122 1
1 1121 . 20 1 1 A 97 97 ASP CA C 97 52.149 56.351 -4.202 1
1 1122 . 20 1 1 A 97 97 ASP CB C 97 42.697 38.599 4.098 1
1 1123 . 20 1 1 A 97 97 ASP N N 97 126.861 117.140 9.721 1
1 1124 . 20 1 1 A 98 98 PHE H H 98 8.566 8.455 0.111 1
1 1125 . 20 1 1 A 98 98 PHE HA H 98 3.727 4.239 -0.512 1
1 1133 . 20 1 1 A 98 98 PHE C C 98 177.443 177.314 0.129 1
1 1134 . 20 1 1 A 98 98 PHE CA C 98 62.471 60.982 1.489 1
1 1135 . 20 1 1 A 98 98 PHE CB C 98 39.919 39.907 0.012 1
1 1141 . 20 1 1 A 98 98 PHE N N 98 117.781 121.233 -3.452 1
1 1142 . 20 1 1 A 99 99 ASP H H 99 8.259 8.516 -0.257 1
1 1143 . 20 1 1 A 99 99 ASP HA H 99 3.960 4.356 -0.396 1
1 1146 . 20 1 1 A 99 99 ASP C C 99 178.132 178.322 -0.190 1
1 1147 . 20 1 1 A 99 99 ASP CA C 99 57.658 56.956 0.702 1
1 1148 . 20 1 1 A 99 99 ASP CB C 99 38.572 41.076 -2.504 1
1 1149 . 20 1 1 A 99 99 ASP N N 99 121.709 119.101 2.608 1
1 1150 . 20 1 1 A 100 100 MET H H 100 8.008 8.334 -0.326 1
1 1151 . 20 1 1 A 100 100 MET HA H 100 3.644 4.556 -0.912 1
1 1156 . 20 1 1 A 100 100 MET C C 100 180.008 177.007 3.001 1
1 1157 . 20 1 1 A 100 100 MET CA C 100 58.598 58.714 -0.116 1
1 1158 . 20 1 1 A 100 100 MET CB C 100 33.423 32.810 0.613 1
1 1160 . 20 1 1 A 100 100 MET N N 100 119.668 118.634 1.034 1
1 1161 . 20 1 1 A 101 101 LEU H H 101 7.961 8.096 -0.135 1
1 1162 . 20 1 1 A 101 101 LEU HA H 101 3.523 4.363 -0.840 1
1 1172 . 20 1 1 A 101 101 LEU C C 101 173.873 177.157 -3.284 1
1 1173 . 20 1 1 A 101 101 LEU CA C 101 58.743 54.488 4.255 1
1 1174 . 20 1 1 A 101 101 LEU CB C 101 42.632 42.691 -0.059 1
1 1178 . 20 1 1 A 101 101 LEU N N 101 119.752 119.113 0.639 1
1 1179 . 20 1 1 A 102 102 THR H H 102 6.955 8.697 -1.742 1
1 1180 . 20 1 1 A 102 102 THR HA H 102 4.134 4.111 0.023 1
1 1185 . 20 1 1 A 102 102 THR C C 102 176.513 174.831 1.682 1
1 1186 . 20 1 1 A 102 102 THR CA C 102 61.125 65.091 -3.966 1
1 1187 . 20 1 1 A 102 102 THR CB C 102 71.415 66.751 4.664 1
1 1189 . 20 1 1 A 102 102 THR N N 102 124.665 115.995 8.670 1
1 1190 . 20 1 1 A 103 103 GLY H H 103 7.816 8.128 -0.312 1
1 1191 . 20 1 1 A 103 103 GLY HA2 H 103 3.824 3.554 0.270 1
1 1192 . 20 1 1 A 103 103 GLY HA3 H 103 3.824 3.755 0.069 1
1 1193 . 20 1 1 A 103 103 GLY C C 103 174.126 173.895 0.231 1
1 1194 . 20 1 1 A 103 103 GLY CA C 103 47.805 46.361 1.444 1
1 1195 . 20 1 1 A 103 103 GLY N N 103 114.191 108.785 5.406 1
1 1196 . 20 1 1 A 104 104 SER H H 104 8.860 7.866 0.994 1
1 1197 . 20 1 1 A 104 104 SER HA H 104 4.758 4.687 0.071 1
1 1200 . 20 1 1 A 104 104 SER C C 104 174.591 174.464 0.127 1
1 1201 . 20 1 1 A 104 104 SER CA C 104 56.755 56.843 -0.088 1
1 1202 . 20 1 1 A 104 104 SER CB C 104 65.050 63.667 1.383 1
1 1203 . 20 1 1 A 104 104 SER N N 104 114.771 114.687 0.084 1
1 1204 . 20 1 1 A 105 105 GLY H H 105 8.788 8.518 0.270 1
1 1205 . 20 1 1 A 105 105 GLY HA2 H 105 3.733 3.831 -0.098 1
1 1206 . 20 1 1 A 105 105 GLY HA3 H 105 3.733 3.870 -0.137 1
1 1207 . 20 1 1 A 105 105 GLY CA C 105 47.247 47.117 0.130 1
1 1208 . 20 1 1 A 105 105 GLY N N 105 110.394 108.984 1.410 1
1 1209 . 20 1 1 A 106 106 ASN HA H 106 4.454 4.583 -0.129 1
1 1212 . 20 1 1 A 106 106 ASN C C 106 175.180 175.728 -0.548 1
1 1213 . 20 1 1 A 106 106 ASN CA C 106 54.492 55.218 -0.726 1
1 1214 . 20 1 1 A 106 106 ASN CB C 106 37.282 39.115 -1.833 1
1 1215 . 20 1 1 A 107 107 TYR H H 107 8.241 7.583 0.658 1
1 1216 . 20 1 1 A 107 107 TYR HA H 107 4.335 4.802 -0.467 1
1 1223 . 20 1 1 A 107 107 TYR C C 107 173.954 175.360 -1.406 1
1 1224 . 20 1 1 A 107 107 TYR CA C 107 57.727 56.355 1.372 1
1 1225 . 20 1 1 A 107 107 TYR CB C 107 37.063 40.464 -3.401 1
1 1230 . 20 1 1 A 107 107 TYR N N 107 120.708 116.807 3.901 1
1 1231 . 20 1 1 A 108 108 SER H H 108 7.117 9.460 -2.343 1
1 1232 . 20 1 1 A 108 108 SER HA H 108 4.221 4.508 -0.287 1
1 1235 . 20 1 1 A 108 108 SER C C 108 174.834 173.797 1.037 1
1 1236 . 20 1 1 A 108 108 SER CA C 108 59.859 60.059 -0.200 1
1 1237 . 20 1 1 A 108 108 SER CB C 108 63.846 63.433 0.413 1
1 1238 . 20 1 1 A 108 108 SER N N 108 113.362 115.971 -2.609 1
1 1239 . 20 1 1 A 109 109 SER H H 109 8.053 8.641 -0.588 1
1 1240 . 20 1 1 A 109 109 SER HA H 109 4.560 4.284 0.276 1
1 1243 . 20 1 1 A 109 109 SER CA C 109 57.141 60.826 -3.685 1
1 1244 . 20 1 1 A 109 109 SER CB C 109 64.874 61.908 2.966 1
1 1245 . 20 1 1 A 109 109 SER N N 109 116.657 115.215 1.442 1
1 1246 . 20 1 1 A 110 110 THR HA H 110 3.541 3.965 -0.424 1
1 1251 . 20 1 1 A 110 110 THR C C 110 175.477 176.064 -0.587 1
1 1252 . 20 1 1 A 110 110 THR CA C 110 66.443 66.433 0.010 1
1 1253 . 20 1 1 A 110 110 THR CB C 110 68.091 68.568 -0.477 1
1 1255 . 20 1 1 A 111 111 ASP H H 111 8.224 8.456 -0.232 1
1 1256 . 20 1 1 A 111 111 ASP HA H 111 4.237 4.256 -0.019 1
1 1259 . 20 1 1 A 111 111 ASP C C 111 177.520 178.109 -0.589 1
1 1260 . 20 1 1 A 111 111 ASP CA C 111 57.559 57.725 -0.166 1
1 1261 . 20 1 1 A 111 111 ASP CB C 111 40.292 41.695 -1.403 1
1 1262 . 20 1 1 A 111 111 ASP N N 111 119.490 121.133 -1.643 1
1 1263 . 20 1 1 A 112 112 ALA H H 112 7.431 7.928 -0.497 1
1 1264 . 20 1 1 A 112 112 ALA HA H 112 4.191 4.055 0.136 1
1 1268 . 20 1 1 A 112 112 ALA C C 112 180.646 179.976 0.670 1
1 1269 . 20 1 1 A 112 112 ALA CA C 112 54.534 54.965 -0.431 1
1 1270 . 20 1 1 A 112 112 ALA CB C 112 18.992 18.233 0.759 1
1 1271 . 20 1 1 A 112 112 ALA N N 112 119.710 121.826 -2.116 1
1 1272 . 20 1 1 A 113 113 GLN H H 113 7.576 7.975 -0.399 1
1 1273 . 20 1 1 A 113 113 GLN HA H 113 3.562 3.890 -0.328 1
1 1278 . 20 1 1 A 113 113 GLN C C 113 176.756 177.892 -1.136 1
1 1279 . 20 1 1 A 113 113 GLN CA C 113 57.736 58.207 -0.471 1
1 1280 . 20 1 1 A 113 113 GLN CB C 113 29.110 28.179 0.931 1
1 1281 . 20 1 1 A 113 113 GLN N N 113 117.518 115.421 2.097 1
1 1283 . 20 1 1 A 114 114 MET H H 114 8.192 8.143 0.049 1
1 1284 . 20 1 1 A 114 114 MET HA H 114 4.231 3.884 0.347 1
1 1289 . 20 1 1 A 114 114 MET C C 114 175.648 178.084 -2.436 1
1 1290 . 20 1 1 A 114 114 MET CA C 114 57.446 57.332 0.114 1
1 1291 . 20 1 1 A 114 114 MET CB C 114 33.570 32.390 1.180 1
1 1293 . 20 1 1 A 114 114 MET N N 114 111.509 119.678 -8.169 1
1 1294 . 20 1 1 A 115 115 GLN H H 115 6.940 7.253 -0.313 1
1 1295 . 20 1 1 A 115 115 GLN HA H 115 4.307 4.208 0.099 1
1 1302 . 20 1 1 A 115 115 GLN C C 115 176.270 175.182 1.088 1
1 1303 . 20 1 1 A 115 115 GLN CA C 115 54.680 57.118 -2.438 1
1 1304 . 20 1 1 A 115 115 GLN CB C 115 28.233 29.015 -0.782 1
1 1306 . 20 1 1 A 115 115 GLN N N 115 114.300 116.305 -2.005 1
1 1308 . 20 1 1 A 116 116 TYR H H 116 6.677 7.538 -0.861 1
1 1309 . 20 1 1 A 116 116 TYR HA H 116 4.193 3.805 0.388 1
1 1312 . 20 1 1 A 116 116 TYR C C 116 175.268 174.442 0.826 1
1 1313 . 20 1 1 A 116 116 TYR CA C 116 54.357 58.071 -3.714 1
1 1314 . 20 1 1 A 116 116 TYR CB C 116 35.498 35.275 0.223 1
1 1315 . 20 1 1 A 116 116 TYR N N 116 117.919 115.719 2.200 1
1 1316 . 20 1 1 A 117 117 ASP H H 117 8.081 8.070 0.011 1
1 1317 . 20 1 1 A 117 117 ASP HA H 117 4.665 4.722 -0.057 1
1 1320 . 20 1 1 A 117 117 ASP CA C 117 52.422 52.490 -0.068 1
1 1321 . 20 1 1 A 117 117 ASP CB C 117 42.416 40.132 2.284 1
1 1322 . 20 1 1 A 117 117 ASP N N 117 120.887 120.497 0.390 1
1 1323 . 20 1 1 A 118 118 PRO C C 118 179.180 178.145 1.035 1
1 1324 . 20 1 1 A 118 118 PRO CA C 118 65.942 64.575 1.367 1
1 1325 . 20 1 1 A 118 118 PRO CB C 118 32.197 31.776 0.421 1
1 1326 . 20 1 1 A 119 119 GLY H H 119 9.742 7.938 1.804 1
1 1327 . 20 1 1 A 119 119 GLY C C 119 175.622 175.262 0.360 1
1 1328 . 20 1 1 A 119 119 GLY CA C 119 46.785 46.310 0.475 1
1 1329 . 20 1 1 A 119 119 GLY N N 119 106.412 106.321 0.091 1
1 1330 . 20 1 1 A 120 120 LEU H H 120 6.666 7.065 -0.399 1
1 1331 . 20 1 1 A 120 120 LEU HA H 120 3.365 3.799 -0.434 1
1 1341 . 20 1 1 A 120 120 LEU C C 120 179.262 178.321 0.941 1
1 1342 . 20 1 1 A 120 120 LEU CA C 120 56.605 56.564 0.041 1
1 1343 . 20 1 1 A 120 120 LEU CB C 120 39.262 41.005 -1.743 1
1 1347 . 20 1 1 A 120 120 LEU N N 120 126.226 122.460 3.766 1
1 1348 . 20 1 1 A 121 121 PHE H H 121 7.356 8.665 -1.309 1
1 1349 . 20 1 1 A 121 121 PHE HA H 121 4.459 3.960 0.499 1
1 1352 . 20 1 1 A 121 121 PHE C C 121 179.716 177.454 2.262 1
1 1353 . 20 1 1 A 121 121 PHE CA C 121 62.838 62.029 0.809 1
1 1354 . 20 1 1 A 121 121 PHE CB C 121 37.603 39.226 -1.623 1
1 1355 . 20 1 1 A 121 121 PHE N N 121 117.437 119.147 -1.710 1
1 1356 . 20 1 1 A 122 122 ALA H H 122 7.926 7.862 0.064 1
1 1357 . 20 1 1 A 122 122 ALA HA H 122 4.523 3.930 0.593 1
1 1361 . 20 1 1 A 122 122 ALA C C 122 180.435 180.104 0.331 1
1 1362 . 20 1 1 A 122 122 ALA CA C 122 55.527 55.138 0.389 1
1 1363 . 20 1 1 A 122 122 ALA CB C 122 17.814 18.233 -0.419 1
1 1364 . 20 1 1 A 122 122 ALA N N 122 121.068 121.106 -0.038 1
1 1365 . 20 1 1 A 123 123 GLN H H 123 7.507 7.890 -0.383 1
1 1366 . 20 1 1 A 123 123 GLN HA H 123 4.153 4.091 0.062 1
1 1371 . 20 1 1 A 123 123 GLN C C 123 180.561 178.905 1.656 1
1 1372 . 20 1 1 A 123 123 GLN CA C 123 59.948 58.493 1.455 1
1 1373 . 20 1 1 A 123 123 GLN CB C 123 29.135 28.629 0.506 1
1 1375 . 20 1 1 A 123 123 GLN N N 123 120.324 116.489 3.835 1
1 1376 . 20 1 1 A 124 124 ILE H H 124 8.318 8.166 0.152 1
1 1377 . 20 1 1 A 124 124 ILE HA H 124 3.635 3.949 -0.314 1
1 1387 . 20 1 1 A 124 124 ILE C C 124 176.481 177.757 -1.276 1
1 1388 . 20 1 1 A 124 124 ILE CA C 124 66.432 64.519 1.913 1
1 1389 . 20 1 1 A 124 124 ILE CB C 124 39.168 37.797 1.371 1
1 1393 . 20 1 1 A 124 124 ILE N N 124 123.747 117.910 5.837 1
1 1394 . 20 1 1 A 125 125 GLN H H 125 8.474 7.738 0.736 1
1 1395 . 20 1 1 A 125 125 GLN HA H 125 4.264 4.100 0.164 1
1 1402 . 20 1 1 A 125 125 GLN C C 125 178.947 178.176 0.771 1
1 1403 . 20 1 1 A 125 125 GLN CA C 125 59.651 58.073 1.578 1
1 1404 . 20 1 1 A 125 125 GLN CB C 125 28.880 28.177 0.703 1
1 1406 . 20 1 1 A 125 125 GLN N N 125 120.368 121.155 -0.787 1
1 1408 . 20 1 1 A 126 126 ALA H H 126 8.002 7.514 0.488 1
1 1409 . 20 1 1 A 126 126 ALA HA H 126 4.144 4.036 0.108 1
1 1413 . 20 1 1 A 126 126 ALA C C 126 179.316 179.643 -0.327 1
1 1414 . 20 1 1 A 126 126 ALA CA C 126 55.036 54.833 0.203 1
1 1415 . 20 1 1 A 126 126 ALA CB C 126 18.087 18.262 -0.175 1
1 1416 . 20 1 1 A 126 126 ALA N N 126 121.661 123.094 -1.433 1
1 1417 . 20 1 1 A 127 127 ALA H H 127 7.823 8.149 -0.326 1
1 1418 . 20 1 1 A 127 127 ALA HA H 127 4.162 4.055 0.107 1
1 1422 . 20 1 1 A 127 127 ALA C C 127 180.707 179.586 1.121 1
1 1423 . 20 1 1 A 127 127 ALA CA C 127 55.080 54.822 0.258 1
1 1424 . 20 1 1 A 127 127 ALA CB C 127 19.354 18.413 0.941 1
1 1425 . 20 1 1 A 127 127 ALA N N 127 119.853 119.881 -0.028 1
1 1426 . 20 1 1 A 128 128 ALA H H 128 8.936 7.717 1.219 1
1 1427 . 20 1 1 A 128 128 ALA HA H 128 3.928 3.865 0.063 1
1 1431 . 20 1 1 A 128 128 ALA C C 128 181.031 179.419 1.612 1
1 1432 . 20 1 1 A 128 128 ALA CA C 128 55.502 54.717 0.785 1
1 1433 . 20 1 1 A 128 128 ALA CB C 128 16.609 17.839 -1.230 1
1 1434 . 20 1 1 A 128 128 ALA N N 128 121.355 120.391 0.964 1
1 1435 . 20 1 1 A 129 129 THR H H 129 8.543 7.477 1.066 1
1 1436 . 20 1 1 A 129 129 THR HA H 129 4.015 3.643 0.372 1
1 1441 . 20 1 1 A 129 129 THR C C 129 177.332 176.405 0.927 1
1 1442 . 20 1 1 A 129 129 THR CA C 129 65.893 65.166 0.727 1
1 1443 . 20 1 1 A 129 129 THR CB C 129 68.566 68.442 0.124 1
1 1445 . 20 1 1 A 129 129 THR N N 129 112.709 112.221 0.488 1
1 1446 . 20 1 1 A 130 130 LYS H H 130 8.126 7.364 0.762 1
1 1447 . 20 1 1 A 130 130 LYS HA H 130 4.000 4.035 -0.035 1
1 1456 . 20 1 1 A 130 130 LYS C C 130 179.082 178.435 0.647 1
1 1457 . 20 1 1 A 130 130 LYS CA C 130 60.299 58.575 1.724 1
1 1458 . 20 1 1 A 130 130 LYS CB C 130 32.767 32.091 0.676 1
1 1462 . 20 1 1 A 130 130 LYS N N 130 123.879 120.478 3.401 1
1 1463 . 20 1 1 A 131 131 ALA H H 131 7.184 7.813 -0.629 1
1 1464 . 20 1 1 A 131 131 ALA HA H 131 4.005 4.231 -0.226 1
1 1468 . 20 1 1 A 131 131 ALA C C 131 178.482 179.559 -1.077 1
1 1469 . 20 1 1 A 131 131 ALA CA C 131 55.027 55.089 -0.062 1
1 1470 . 20 1 1 A 131 131 ALA CB C 131 18.669 19.512 -0.843 1
1 1471 . 20 1 1 A 131 131 ALA N N 131 118.590 121.152 -2.562 1
1 1472 . 20 1 1 A 132 132 TRP H H 132 7.977 8.594 -0.617 1
1 1473 . 20 1 1 A 132 132 TRP HA H 132 4.001 4.346 -0.345 1
1 1480 . 20 1 1 A 132 132 TRP C C 132 177.332 175.608 1.724 1
1 1481 . 20 1 1 A 132 132 TRP CA C 132 60.431 57.467 2.964 1
1 1482 . 20 1 1 A 132 132 TRP CB C 132 27.786 27.653 0.133 1
1 1486 . 20 1 1 A 132 132 TRP N N 132 119.168 117.135 2.033 1
1 1488 . 20 1 1 A 133 133 ARG H H 133 8.006 8.060 -0.054 1
1 1489 . 20 1 1 A 133 133 ARG HA H 133 4.027 4.272 -0.245 1
1 1497 . 20 1 1 A 133 133 ARG C C 133 176.664 178.875 -2.211 1
1 1498 . 20 1 1 A 133 133 ARG CA C 133 59.355 57.468 1.887 1
1 1499 . 20 1 1 A 133 133 ARG CB C 133 30.451 31.904 -1.453 1
1 1502 . 20 1 1 A 133 133 ARG N N 133 113.062 121.005 -7.943 1
1 1504 . 20 1 1 A 134 134 LYS H H 134 7.322 7.707 -0.385 1
1 1505 . 20 1 1 A 134 134 LYS HA H 134 4.313 4.333 -0.020 1
1 1514 . 20 1 1 A 134 134 LYS C C 134 176.282 176.294 -0.012 1
1 1515 . 20 1 1 A 134 134 LYS CA C 134 54.922 57.916 -2.994 1
1 1516 . 20 1 1 A 134 134 LYS CB C 134 32.633 31.933 0.700 1
1 1520 . 20 1 1 A 134 134 LYS N N 134 118.170 118.850 -0.680 1
1 1521 . 20 1 1 A 135 135 LEU H H 135 7.440 7.478 -0.038 1
1 1522 . 20 1 1 A 135 135 LEU HA H 135 4.174 4.694 -0.520 1
1 1532 . 20 1 1 A 135 135 LEU CA C 135 54.408 51.313 3.095 1
1 1533 . 20 1 1 A 135 135 LEU CB C 135 40.407 43.910 -3.503 1
1 1537 . 20 1 1 A 135 135 LEU N N 135 123.358 115.182 8.176 1
1 1538 . 20 1 1 A 136 136 PRO HA H 136 4.437 4.477 -0.040 1
1 1545 . 20 1 1 A 136 136 PRO C C 136 177.106 176.380 0.726 1
1 1546 . 20 1 1 A 136 136 PRO CA C 136 62.889 64.659 -1.770 1
1 1547 . 20 1 1 A 136 136 PRO CB C 136 32.192 32.107 0.085 1
1 1550 . 20 1 1 A 137 137 VAL H H 137 8.219 7.632 0.587 1
1 1551 . 20 1 1 A 137 137 VAL HA H 137 4.077 4.052 0.025 1
1 1559 . 20 1 1 A 137 137 VAL C C 137 176.305 176.256 0.049 1
1 1560 . 20 1 1 A 137 137 VAL CA C 137 61.958 63.262 -1.304 1
1 1561 . 20 1 1 A 137 137 VAL CB C 137 32.755 32.141 0.614 1
1 1564 . 20 1 1 A 137 137 VAL N N 137 120.079 119.499 0.580 1
1 1565 . 20 1 1 A 138 138 LYS H H 138 8.444 8.740 -0.296 1
1 1566 . 20 1 1 A 138 138 LYS HA H 138 4.316 4.623 -0.307 1
1 1575 . 20 1 1 A 138 138 LYS C C 138 176.790 176.308 0.482 1
1 1576 . 20 1 1 A 138 138 LYS CA C 138 56.792 56.096 0.696 1
1 1577 . 20 1 1 A 138 138 LYS CB C 138 33.205 34.672 -1.467 1
1 1581 . 20 1 1 A 138 138 LYS N N 138 126.449 120.595 5.854 1
1 1582 . 20 1 1 A 139 139 GLY H H 139 8.518 7.534 0.984 1
1 1583 . 20 1 1 A 139 139 GLY HA2 H 139 4.070 3.977 0.093 1
1 1584 . 20 1 1 A 139 139 GLY HA3 H 139 3.897 3.991 -0.094 1
1 1585 . 20 1 1 A 139 139 GLY C C 139 172.874 171.582 1.292 1
1 1586 . 20 1 1 A 139 139 GLY CA C 139 45.157 46.092 -0.935 1
1 1587 . 20 1 1 A 139 139 GLY N N 139 112.617 106.995 5.622 1
1 6 . 21 1 1 A 2 2 VAL H H 2 8.992 8.361 0.631 1
1 7 . 21 1 1 A 2 2 VAL HA H 2 5.370 4.544 0.826 1
1 15 . 21 1 1 A 2 2 VAL C C 2 174.325 174.900 -0.575 1
1 16 . 21 1 1 A 2 2 VAL CA C 2 61.267 61.686 -0.419 1
1 17 . 21 1 1 A 2 2 VAL CB C 2 33.890 33.382 0.508 1
1 20 . 21 1 1 A 2 2 VAL N N 2 126.939 120.292 6.647 1
1 21 . 21 1 1 A 3 3 THR H H 3 8.912 8.779 0.133 1
1 22 . 21 1 1 A 3 3 THR HA H 3 4.505 5.362 -0.857 1
1 27 . 21 1 1 A 3 3 THR C C 3 172.710 173.029 -0.319 1
1 28 . 21 1 1 A 3 3 THR CA C 3 59.689 59.735 -0.046 1
1 29 . 21 1 1 A 3 3 THR CB C 3 72.398 71.985 0.413 1
1 31 . 21 1 1 A 3 3 THR N N 3 118.091 121.137 -3.046 1
1 32 . 21 1 1 A 4 4 GLU H H 4 8.631 9.133 -0.502 1
1 33 . 21 1 1 A 4 4 GLU HA H 4 5.788 5.075 0.713 1
1 38 . 21 1 1 A 4 4 GLU C C 4 175.758 174.137 1.621 1
1 39 . 21 1 1 A 4 4 GLU CA C 4 54.902 54.348 0.554 1
1 40 . 21 1 1 A 4 4 GLU CB C 4 35.097 33.247 1.850 1
1 42 . 21 1 1 A 4 4 GLU N N 4 120.966 125.647 -4.681 1
1 43 . 21 1 1 A 5 5 THR H H 5 9.188 8.484 0.704 1
1 44 . 21 1 1 A 5 5 THR HA H 5 4.739 4.780 -0.041 1
1 49 . 21 1 1 A 5 5 THR C C 5 172.757 171.818 0.939 1
1 50 . 21 1 1 A 5 5 THR CA C 5 60.382 60.544 -0.162 1
1 51 . 21 1 1 A 5 5 THR CB C 5 71.558 70.284 1.274 1
1 53 . 21 1 1 A 5 5 THR N N 5 119.366 115.122 4.244 1
1 54 . 21 1 1 A 6 6 VAL H H 6 8.476 8.410 0.066 1
1 55 . 21 1 1 A 6 6 VAL HA H 6 5.026 5.561 -0.535 1
1 63 . 21 1 1 A 6 6 VAL C C 6 176.674 175.018 1.656 1
1 64 . 21 1 1 A 6 6 VAL CA C 6 61.008 61.077 -0.069 1
1 65 . 21 1 1 A 6 6 VAL CB C 6 33.861 34.564 -0.703 1
1 68 . 21 1 1 A 6 6 VAL N N 6 121.384 123.384 -2.000 1
1 69 . 21 1 1 A 7 7 ASP H H 7 8.848 9.124 -0.276 1
1 70 . 21 1 1 A 7 7 ASP HA H 7 4.797 4.814 -0.017 1
1 73 . 21 1 1 A 7 7 ASP CA C 7 52.834 54.968 -2.134 1
1 74 . 21 1 1 A 7 7 ASP CB C 7 42.219 42.344 -0.125 1
1 75 . 21 1 1 A 7 7 ASP N N 7 127.061 127.455 -0.394 1
1 76 . 21 1 1 A 8 8 GLY C C 8 175.143 174.567 0.576 1
1 77 . 21 1 1 A 8 8 GLY CA C 8 46.553 47.085 -0.532 1
1 78 . 21 1 1 A 9 9 GLN H H 9 8.408 7.776 0.632 1
1 79 . 21 1 1 A 9 9 GLN HA H 9 4.541 4.242 0.299 1
1 86 . 21 1 1 A 9 9 GLN C C 9 176.463 177.166 -0.703 1
1 87 . 21 1 1 A 9 9 GLN CA C 9 55.167 55.220 -0.053 1
1 88 . 21 1 1 A 9 9 GLN CB C 9 29.376 27.743 1.633 1
1 90 . 21 1 1 A 9 9 GLN N N 9 118.300 116.578 1.722 1
1 92 . 21 1 1 A 10 10 GLY H H 10 8.162 8.573 -0.411 1
1 93 . 21 1 1 A 10 10 GLY HA2 H 10 4.174 3.938 0.236 1
1 94 . 21 1 1 A 10 10 GLY HA3 H 10 3.521 3.949 -0.428 1
1 95 . 21 1 1 A 10 10 GLY C C 10 174.092 173.689 0.403 1
1 96 . 21 1 1 A 10 10 GLY CA C 10 45.558 46.372 -0.814 1
1 97 . 21 1 1 A 10 10 GLY N N 10 108.747 110.550 -1.803 1
1 98 . 21 1 1 A 11 11 GLN H H 11 8.507 7.661 0.846 1
1 99 . 21 1 1 A 11 11 GLN HA H 11 4.202 4.909 -0.707 1
1 106 . 21 1 1 A 11 11 GLN C C 11 173.992 174.137 -0.145 1
1 107 . 21 1 1 A 11 11 GLN CA C 11 55.098 53.721 1.377 1
1 108 . 21 1 1 A 11 11 GLN CB C 11 29.097 32.244 -3.147 1
1 110 . 21 1 1 A 11 11 GLN N N 11 122.979 115.203 7.776 1
1 112 . 21 1 1 A 12 12 ALA H H 12 8.259 8.750 -0.491 1
1 113 . 21 1 1 A 12 12 ALA HA H 12 5.156 6.204 -1.048 1
1 117 . 21 1 1 A 12 12 ALA C C 12 177.284 176.364 0.920 1
1 118 . 21 1 1 A 12 12 ALA CA C 12 51.087 50.453 0.634 1
1 119 . 21 1 1 A 12 12 ALA CB C 12 20.500 21.259 -0.759 1
1 120 . 21 1 1 A 12 12 ALA N N 12 127.100 122.497 4.603 1
1 121 . 21 1 1 A 13 13 TRP H H 13 9.245 8.924 0.321 1
1 122 . 21 1 1 A 13 13 TRP HA H 13 4.717 5.361 -0.644 1
1 131 . 21 1 1 A 13 13 TRP C C 13 175.108 174.306 0.802 1
1 132 . 21 1 1 A 13 13 TRP CA C 13 55.966 55.531 0.435 1
1 133 . 21 1 1 A 13 13 TRP CB C 13 31.912 32.251 -0.339 1
1 139 . 21 1 1 A 13 13 TRP N N 13 123.088 119.645 3.443 1
1 141 . 21 1 1 A 14 14 ARG H H 14 8.575 8.649 -0.074 1
1 142 . 21 1 1 A 14 14 ARG HA H 14 5.335 4.328 1.007 1
1 150 . 21 1 1 A 14 14 ARG C C 14 175.191 174.185 1.006 1
1 151 . 21 1 1 A 14 14 ARG CA C 14 53.106 55.085 -1.979 1
1 152 . 21 1 1 A 14 14 ARG CB C 14 32.749 31.586 1.163 1
1 154 . 21 1 1 A 14 14 ARG N N 14 121.163 119.795 1.368 1
1 156 . 21 1 1 A 15 15 HIS H H 15 8.595 8.128 0.467 1
1 157 . 21 1 1 A 15 15 HIS HA H 15 4.790 5.068 -0.278 1
1 161 . 21 1 1 A 15 15 HIS C C 15 173.770 174.842 -1.072 1
1 162 . 21 1 1 A 15 15 HIS CA C 15 55.289 53.636 1.653 1
1 163 . 21 1 1 A 15 15 HIS CB C 15 33.208 32.894 0.314 1
1 165 . 21 1 1 A 15 15 HIS N N 15 117.643 119.453 -1.810 1
1 166 . 21 1 1 A 16 16 HIS H H 16 8.993 8.764 0.229 1
1 167 . 21 1 1 A 16 16 HIS HA H 16 5.158 4.753 0.405 1
1 171 . 21 1 1 A 16 16 HIS C C 16 173.608 174.835 -1.227 1
1 172 . 21 1 1 A 16 16 HIS CA C 16 56.450 56.946 -0.496 1
1 173 . 21 1 1 A 16 16 HIS CB C 16 34.171 30.576 3.595 1
1 175 . 21 1 1 A 16 16 HIS N N 16 123.520 121.375 2.145 1
1 176 . 21 1 1 A 17 17 ASN H H 17 7.829 8.879 -1.050 1
1 177 . 21 1 1 A 17 17 ASN HA H 17 4.713 5.199 -0.486 1
1 182 . 21 1 1 A 17 17 ASN C C 17 173.682 174.735 -1.053 1
1 183 . 21 1 1 A 17 17 ASN CA C 17 51.822 51.568 0.254 1
1 184 . 21 1 1 A 17 17 ASN CB C 17 43.176 42.291 0.885 1
1 185 . 21 1 1 A 17 17 ASN N N 17 122.213 120.056 2.157 1
1 187 . 21 1 1 A 18 18 GLY H H 18 8.423 8.296 0.127 1
1 188 . 21 1 1 A 18 18 GLY HA2 H 18 3.931 4.179 -0.248 1
1 189 . 21 1 1 A 18 18 GLY HA3 H 18 3.707 4.208 -0.501 1
1 190 . 21 1 1 A 18 18 GLY C C 18 173.985 173.169 0.816 1
1 191 . 21 1 1 A 18 18 GLY CA C 18 43.949 44.163 -0.214 1
1 192 . 21 1 1 A 18 18 GLY N N 18 106.991 110.070 -3.079 1
1 193 . 21 1 1 A 19 19 PHE H H 19 8.338 8.470 -0.132 1
1 194 . 21 1 1 A 19 19 PHE HA H 19 4.068 5.281 -1.213 1
1 197 . 21 1 1 A 19 19 PHE C C 19 176.568 175.246 1.322 1
1 198 . 21 1 1 A 19 19 PHE CA C 19 59.338 56.885 2.453 1
1 199 . 21 1 1 A 19 19 PHE CB C 19 40.201 43.428 -3.227 1
1 200 . 21 1 1 A 19 19 PHE N N 19 116.857 119.196 -2.339 1
1 201 . 21 1 1 A 20 20 ASP H H 20 8.794 8.979 -0.185 1
1 202 . 21 1 1 A 20 20 ASP HA H 20 4.485 4.778 -0.293 1
1 205 . 21 1 1 A 20 20 ASP C C 20 177.379 177.382 -0.003 1
1 206 . 21 1 1 A 20 20 ASP CA C 20 54.140 55.003 -0.863 1
1 207 . 21 1 1 A 20 20 ASP CB C 20 41.915 40.951 0.964 1
1 208 . 21 1 1 A 20 20 ASP N N 20 123.025 123.319 -0.294 1
1 209 . 21 1 1 A 21 21 PHE H H 21 8.862 9.186 -0.324 1
1 210 . 21 1 1 A 21 21 PHE HA H 21 4.087 4.113 -0.026 1
1 218 . 21 1 1 A 21 21 PHE C C 21 176.952 177.259 -0.307 1
1 219 . 21 1 1 A 21 21 PHE CA C 21 61.095 61.807 -0.712 1
1 220 . 21 1 1 A 21 21 PHE CB C 21 38.678 39.374 -0.696 1
1 226 . 21 1 1 A 21 21 PHE N N 21 127.163 125.439 1.724 1
1 227 . 21 1 1 A 22 22 ALA H H 22 8.561 8.362 0.199 1
1 228 . 21 1 1 A 22 22 ALA HA H 22 3.878 3.979 -0.101 1
1 232 . 21 1 1 A 22 22 ALA C C 22 180.710 180.198 0.512 1
1 233 . 21 1 1 A 22 22 ALA CA C 22 55.211 55.200 0.011 1
1 234 . 21 1 1 A 22 22 ALA CB C 22 18.321 18.286 0.035 1
1 235 . 21 1 1 A 22 22 ALA N N 22 120.293 121.321 -1.028 1
1 236 . 21 1 1 A 23 23 VAL H H 23 7.241 7.636 -0.395 1
1 237 . 21 1 1 A 23 23 VAL HA H 23 3.684 3.539 0.145 1
1 245 . 21 1 1 A 23 23 VAL C C 23 177.101 178.192 -1.091 1
1 246 . 21 1 1 A 23 23 VAL CA C 23 65.237 67.064 -1.827 1
1 247 . 21 1 1 A 23 23 VAL CB C 23 31.780 31.594 0.186 1
1 250 . 21 1 1 A 23 23 VAL N N 23 118.775 117.638 1.137 1
1 251 . 21 1 1 A 24 24 ILE H H 24 6.761 7.835 -1.074 1
1 252 . 21 1 1 A 24 24 ILE HA H 24 3.196 3.414 -0.218 1
1 262 . 21 1 1 A 24 24 ILE C C 24 177.287 178.005 -0.718 1
1 263 . 21 1 1 A 24 24 ILE CA C 24 63.404 65.731 -2.327 1
1 264 . 21 1 1 A 24 24 ILE CB C 24 36.294 37.654 -1.360 1
1 268 . 21 1 1 A 24 24 ILE N N 24 119.036 120.146 -1.110 1
1 269 . 21 1 1 A 25 25 LYS H H 25 8.032 8.092 -0.060 1
1 270 . 21 1 1 A 25 25 LYS HA H 25 3.809 3.667 0.142 1
1 279 . 21 1 1 A 25 25 LYS C C 25 179.450 178.721 0.729 1
1 280 . 21 1 1 A 25 25 LYS CA C 25 59.621 59.537 0.084 1
1 281 . 21 1 1 A 25 25 LYS CB C 25 32.259 32.053 0.206 1
1 285 . 21 1 1 A 25 25 LYS N N 25 118.368 120.308 -1.940 1
1 286 . 21 1 1 A 26 26 GLU H H 26 7.845 8.221 -0.376 1
1 287 . 21 1 1 A 26 26 GLU HA H 26 4.021 4.040 -0.019 1
1 292 . 21 1 1 A 26 26 GLU C C 26 179.191 178.717 0.474 1
1 293 . 21 1 1 A 26 26 GLU CA C 26 59.530 59.083 0.447 1
1 294 . 21 1 1 A 26 26 GLU CB C 26 29.449 29.569 -0.120 1
1 296 . 21 1 1 A 26 26 GLU N N 26 120.522 118.930 1.592 1
1 297 . 21 1 1 A 27 27 LEU H H 27 8.165 8.017 0.148 1
1 298 . 21 1 1 A 27 27 LEU HA H 27 4.163 4.108 0.055 1
1 308 . 21 1 1 A 27 27 LEU C C 27 177.256 178.294 -1.038 1
1 309 . 21 1 1 A 27 27 LEU CA C 27 58.049 57.797 0.252 1
1 310 . 21 1 1 A 27 27 LEU CB C 27 41.365 41.992 -0.627 1
1 314 . 21 1 1 A 27 27 LEU N N 27 120.879 121.328 -0.449 1
1 315 . 21 1 1 A 28 28 LYS H H 28 8.902 7.850 1.052 1
1 316 . 21 1 1 A 28 28 LYS HA H 28 4.199 4.260 -0.061 1
1 317 . 21 1 1 A 28 28 LYS C C 28 179.707 179.441 0.266 1
1 318 . 21 1 1 A 28 28 LYS CA C 28 60.097 59.075 1.022 1
1 319 . 21 1 1 A 28 28 LYS CB C 28 33.420 31.893 1.527 1
1 320 . 21 1 1 A 28 28 LYS N N 28 120.050 119.489 0.561 1
1 321 . 21 1 1 A 29 29 THR H H 29 8.294 8.350 -0.056 1
1 322 . 21 1 1 A 29 29 THR HA H 29 3.892 3.925 -0.033 1
1 327 . 21 1 1 A 29 29 THR C C 29 175.711 176.347 -0.636 1
1 328 . 21 1 1 A 29 29 THR CA C 29 66.846 66.477 0.369 1
1 329 . 21 1 1 A 29 29 THR CB C 29 68.794 68.542 0.252 1
1 331 . 21 1 1 A 29 29 THR N N 29 115.933 116.535 -0.602 1
1 332 . 21 1 1 A 30 30 ALA H H 30 8.244 8.684 -0.440 1
1 333 . 21 1 1 A 30 30 ALA HA H 30 4.241 4.183 0.058 1
1 337 . 21 1 1 A 30 30 ALA C C 30 179.128 179.502 -0.374 1
1 338 . 21 1 1 A 30 30 ALA CA C 30 55.714 55.327 0.387 1
1 339 . 21 1 1 A 30 30 ALA CB C 30 18.955 18.374 0.581 1
1 340 . 21 1 1 A 30 30 ALA N N 30 124.617 122.757 1.860 1
1 341 . 21 1 1 A 31 31 ALA H H 31 8.968 8.414 0.554 1
1 342 . 21 1 1 A 31 31 ALA HA H 31 3.890 4.066 -0.176 1
1 346 . 21 1 1 A 31 31 ALA C C 31 180.352 179.898 0.454 1
1 347 . 21 1 1 A 31 31 ALA CA C 31 55.454 55.448 0.006 1
1 348 . 21 1 1 A 31 31 ALA CB C 31 17.124 18.104 -0.980 1
1 349 . 21 1 1 A 31 31 ALA N N 31 119.327 120.878 -1.551 1
1 350 . 21 1 1 A 32 32 SER H H 32 7.995 7.718 0.277 1
1 351 . 21 1 1 A 32 32 SER HA H 32 4.238 4.336 -0.098 1
1 354 . 21 1 1 A 32 32 SER C C 32 175.612 175.715 -0.103 1
1 355 . 21 1 1 A 32 32 SER CA C 32 61.203 61.235 -0.032 1
1 356 . 21 1 1 A 32 32 SER CB C 32 63.406 63.194 0.212 1
1 357 . 21 1 1 A 32 32 SER N N 32 111.962 114.301 -2.339 1
1 358 . 21 1 1 A 33 33 GLN H H 33 8.333 8.131 0.202 1
1 359 . 21 1 1 A 33 33 GLN HA H 33 3.992 4.340 -0.348 1
1 366 . 21 1 1 A 33 33 GLN C C 33 177.486 177.227 0.259 1
1 367 . 21 1 1 A 33 33 GLN CA C 33 58.277 57.706 0.571 1
1 368 . 21 1 1 A 33 33 GLN CB C 33 29.140 30.186 -1.046 1
1 370 . 21 1 1 A 33 33 GLN N N 33 119.527 118.974 0.553 1
1 372 . 21 1 1 A 34 34 TYR H H 34 8.587 8.325 0.262 1
1 373 . 21 1 1 A 34 34 TYR HA H 34 4.792 4.651 0.141 1
1 380 . 21 1 1 A 34 34 TYR C C 34 176.499 176.811 -0.312 1
1 381 . 21 1 1 A 34 34 TYR CA C 34 57.711 58.613 -0.902 1
1 382 . 21 1 1 A 34 34 TYR CB C 34 39.561 39.761 -0.200 1
1 387 . 21 1 1 A 34 34 TYR N N 34 114.610 114.927 -0.317 1
1 388 . 21 1 1 A 35 35 GLY H H 35 7.346 8.289 -0.943 1
1 389 . 21 1 1 A 35 35 GLY HA2 H 35 4.785 4.080 0.705 1
1 390 . 21 1 1 A 35 35 GLY HA3 H 35 4.007 4.084 -0.077 1
1 391 . 21 1 1 A 35 35 GLY C C 35 175.796 173.326 2.470 1
1 392 . 21 1 1 A 35 35 GLY CA C 35 44.355 44.753 -0.398 1
1 393 . 21 1 1 A 35 35 GLY N N 35 108.501 106.348 2.153 1
1 394 . 21 1 1 A 36 36 ALA H H 36 9.363 8.034 1.329 1
1 395 . 21 1 1 A 36 36 ALA HA H 36 4.217 4.575 -0.358 1
1 399 . 21 1 1 A 36 36 ALA C C 36 178.039 177.627 0.412 1
1 400 . 21 1 1 A 36 36 ALA CA C 36 56.114 51.578 4.536 1
1 401 . 21 1 1 A 36 36 ALA CB C 36 19.179 18.163 1.016 1
1 402 . 21 1 1 A 36 36 ALA N N 36 125.811 123.342 2.469 1
1 403 . 21 1 1 A 37 37 THR H H 37 8.070 8.338 -0.268 1
1 404 . 21 1 1 A 37 37 THR HA H 37 4.570 4.531 0.039 1
1 409 . 21 1 1 A 37 37 THR C C 37 173.685 174.324 -0.639 1
1 410 . 21 1 1 A 37 37 THR CA C 37 59.822 62.589 -2.767 1
1 411 . 21 1 1 A 37 37 THR CB C 37 68.267 71.447 -3.180 1
1 413 . 21 1 1 A 37 37 THR N N 37 129.410 118.539 10.871 1
1 414 . 21 1 1 A 38 38 ALA H H 38 6.853 7.630 -0.777 1
1 415 . 21 1 1 A 38 38 ALA HA H 38 4.601 4.524 0.077 1
1 419 . 21 1 1 A 38 38 ALA CA C 38 50.758 50.773 -0.015 1
1 420 . 21 1 1 A 38 38 ALA CB C 38 18.325 19.446 -1.121 1
1 421 . 21 1 1 A 38 38 ALA N N 38 124.674 124.172 0.502 1
1 422 . 21 1 1 A 40 40 TYR HA H 40 4.032 4.037 -0.005 1
1 429 . 21 1 1 A 40 40 TYR C C 40 176.456 177.306 -0.850 1
1 430 . 21 1 1 A 40 40 TYR CA C 40 61.010 61.785 -0.775 1
1 431 . 21 1 1 A 40 40 TYR CB C 40 39.286 38.763 0.523 1
1 436 . 21 1 1 A 41 41 THR H H 41 6.874 7.997 -1.123 1
1 437 . 21 1 1 A 41 41 THR HA H 41 3.616 3.810 -0.194 1
1 442 . 21 1 1 A 41 41 THR C C 41 176.930 176.538 0.392 1
1 443 . 21 1 1 A 41 41 THR CA C 41 65.557 65.565 -0.008 1
1 444 . 21 1 1 A 41 41 THR CB C 41 68.228 68.987 -0.759 1
1 446 . 21 1 1 A 41 41 THR N N 41 115.143 113.796 1.347 1
1 447 . 21 1 1 A 42 42 LEU H H 42 8.623 7.338 1.285 1
1 448 . 21 1 1 A 42 42 LEU HA H 42 3.708 4.049 -0.341 1
1 458 . 21 1 1 A 42 42 LEU C C 42 178.206 178.953 -0.747 1
1 459 . 21 1 1 A 42 42 LEU CA C 42 57.417 57.767 -0.350 1
1 460 . 21 1 1 A 42 42 LEU CB C 42 41.342 41.251 0.091 1
1 464 . 21 1 1 A 42 42 LEU N N 42 120.418 118.703 1.715 1
1 465 . 21 1 1 A 43 43 ALA H H 43 7.735 7.752 -0.017 1
1 466 . 21 1 1 A 43 43 ALA HA H 43 4.020 3.970 0.050 1
1 470 . 21 1 1 A 43 43 ALA C C 43 180.826 180.425 0.401 1
1 471 . 21 1 1 A 43 43 ALA CA C 43 54.925 54.966 -0.041 1
1 472 . 21 1 1 A 43 43 ALA CB C 43 17.506 18.262 -0.756 1
1 473 . 21 1 1 A 43 43 ALA N N 43 120.203 121.799 -1.596 1
1 474 . 21 1 1 A 44 44 ILE H H 44 7.149 7.329 -0.180 1
1 475 . 21 1 1 A 44 44 ILE HA H 44 3.603 3.835 -0.232 1
1 485 . 21 1 1 A 44 44 ILE C C 44 178.594 178.349 0.245 1
1 486 . 21 1 1 A 44 44 ILE CA C 44 64.782 64.141 0.641 1
1 487 . 21 1 1 A 44 44 ILE CB C 44 37.472 36.656 0.816 1
1 491 . 21 1 1 A 44 44 ILE N N 44 118.881 119.395 -0.514 1
1 492 . 21 1 1 A 45 45 VAL H H 45 7.968 7.841 0.127 1
1 493 . 21 1 1 A 45 45 VAL HA H 45 2.925 3.364 -0.439 1
1 501 . 21 1 1 A 45 45 VAL C C 45 177.023 176.832 0.191 1
1 502 . 21 1 1 A 45 45 VAL CA C 45 67.081 67.128 -0.047 1
1 503 . 21 1 1 A 45 45 VAL CB C 45 30.854 30.878 -0.024 1
1 506 . 21 1 1 A 45 45 VAL N N 45 120.764 120.400 0.364 1
1 507 . 21 1 1 A 46 46 GLU H H 46 8.399 8.402 -0.003 1
1 508 . 21 1 1 A 46 46 GLU HA H 46 3.848 3.924 -0.076 1
1 513 . 21 1 1 A 46 46 GLU C C 46 178.656 178.646 0.010 1
1 514 . 21 1 1 A 46 46 GLU CA C 46 59.491 59.465 0.026 1
1 515 . 21 1 1 A 46 46 GLU CB C 46 28.991 29.246 -0.255 1
1 517 . 21 1 1 A 46 46 GLU N N 46 116.599 119.839 -3.240 1
1 518 . 21 1 1 A 47 47 SER H H 47 7.273 8.013 -0.740 1
1 519 . 21 1 1 A 47 47 SER HA H 47 4.287 4.268 0.019 1
1 521 . 21 1 1 A 47 47 SER CA C 47 61.047 61.099 -0.052 1
1 522 . 21 1 1 A 47 47 SER CB C 47 63.016 62.673 0.343 1
1 523 . 21 1 1 A 47 47 SER N N 47 113.609 115.518 -1.909 1
1 524 . 21 1 1 A 48 48 VAL H H 48 8.006 7.900 0.106 1
1 525 . 21 1 1 A 48 48 VAL HA H 48 3.556 3.630 -0.074 1
1 533 . 21 1 1 A 48 48 VAL C C 48 177.257 176.529 0.728 1
1 534 . 21 1 1 A 48 48 VAL CA C 48 65.025 66.028 -1.003 1
1 535 . 21 1 1 A 48 48 VAL CB C 48 31.841 31.511 0.330 1
1 538 . 21 1 1 A 48 48 VAL N N 48 122.327 122.672 -0.345 1
1 539 . 21 1 1 A 49 49 ALA H H 49 8.369 7.438 0.931 1
1 540 . 21 1 1 A 49 49 ALA HA H 49 4.115 4.508 -0.393 1
1 544 . 21 1 1 A 49 49 ALA C C 49 177.307 177.190 0.117 1
1 545 . 21 1 1 A 49 49 ALA CA C 49 53.253 51.596 1.657 1
1 546 . 21 1 1 A 49 49 ALA CB C 49 20.131 19.168 0.963 1
1 547 . 21 1 1 A 49 49 ALA N N 49 118.050 120.434 -2.384 1
1 548 . 21 1 1 A 50 50 ASP H H 50 7.052 7.855 -0.803 1
1 549 . 21 1 1 A 50 50 ASP HA H 50 4.788 4.679 0.109 1
1 552 . 21 1 1 A 50 50 ASP C C 50 175.481 175.615 -0.134 1
1 553 . 21 1 1 A 50 50 ASP CA C 50 53.681 54.101 -0.420 1
1 554 . 21 1 1 A 50 50 ASP CB C 50 39.333 41.518 -2.185 1
1 555 . 21 1 1 A 50 50 ASP N N 50 116.997 117.333 -0.336 1
1 556 . 21 1 1 A 51 51 ASN H H 51 8.535 7.724 0.811 1
1 557 . 21 1 1 A 51 51 ASN HA H 51 4.628 5.041 -0.413 1
1 562 . 21 1 1 A 51 51 ASN C C 51 174.077 174.933 -0.856 1
1 563 . 21 1 1 A 51 51 ASN CA C 51 52.315 51.565 0.750 1
1 564 . 21 1 1 A 51 51 ASN CB C 51 41.928 41.334 0.594 1
1 565 . 21 1 1 A 51 51 ASN N N 51 118.626 114.705 3.921 1
1 567 . 21 1 1 A 52 52 TRP H H 52 8.555 8.418 0.137 1
1 574 . 21 1 1 A 52 52 TRP C C 52 173.269 176.642 -3.373 1
1 575 . 21 1 1 A 52 52 TRP CA C 52 55.031 57.475 -2.444 1
1 576 . 21 1 1 A 52 52 TRP CB C 52 26.801 29.303 -2.502 1
1 582 . 21 1 1 A 52 52 TRP N N 52 120.693 121.907 -1.214 1
1 584 . 21 1 1 A 53 53 LEU H H 53 7.847 9.271 -1.424 1
1 585 . 21 1 1 A 53 53 LEU HA H 53 4.859 5.434 -0.575 1
1 595 . 21 1 1 A 53 53 LEU C C 53 177.397 175.668 1.729 1
1 596 . 21 1 1 A 53 53 LEU CA C 53 53.619 53.315 0.304 1
1 597 . 21 1 1 A 53 53 LEU CB C 53 41.812 46.388 -4.576 1
1 601 . 21 1 1 A 53 53 LEU N N 53 124.741 121.054 3.687 1
1 602 . 21 1 1 A 54 54 THR H H 54 8.850 8.765 0.085 1
1 603 . 21 1 1 A 54 54 THR HA H 54 4.598 4.796 -0.198 1
1 608 . 21 1 1 A 54 54 THR CA C 54 60.531 59.791 0.740 1
1 609 . 21 1 1 A 54 54 THR CB C 54 67.183 69.060 -1.877 1
1 611 . 21 1 1 A 54 54 THR N N 54 113.407 110.770 2.637 1
1 612 . 21 1 1 A 55 55 PRO HA H 55 4.511 4.243 0.268 1
1 619 . 21 1 1 A 55 55 PRO C C 55 179.383 178.952 0.431 1
1 620 . 21 1 1 A 55 55 PRO CA C 55 67.159 65.323 1.836 1
1 621 . 21 1 1 A 55 55 PRO CB C 55 32.095 31.770 0.325 1
1 622 . 21 1 1 A 56 56 THR H H 56 8.575 7.835 0.740 1
1 623 . 21 1 1 A 56 56 THR HA H 56 4.229 4.082 0.147 1
1 628 . 21 1 1 A 56 56 THR C C 56 176.668 175.625 1.043 1
1 629 . 21 1 1 A 56 56 THR CA C 56 66.943 65.780 1.163 1
1 630 . 21 1 1 A 56 56 THR CB C 56 68.129 68.144 -0.015 1
1 632 . 21 1 1 A 56 56 THR N N 56 114.855 112.797 2.058 1
1 633 . 21 1 1 A 57 57 ASP H H 57 8.730 7.992 0.738 1
1 634 . 21 1 1 A 57 57 ASP HA H 57 4.425 4.427 -0.002 1
1 637 . 21 1 1 A 57 57 ASP C C 57 178.351 178.347 0.004 1
1 638 . 21 1 1 A 57 57 ASP CA C 57 57.963 56.855 1.108 1
1 639 . 21 1 1 A 57 57 ASP CB C 57 40.134 40.552 -0.418 1
1 640 . 21 1 1 A 57 57 ASP N N 57 126.239 120.877 5.362 1
1 641 . 21 1 1 A 58 58 TRP H H 58 8.244 8.525 -0.281 1
1 642 . 21 1 1 A 58 58 TRP HA H 58 4.030 4.267 -0.237 1
1 650 . 21 1 1 A 58 58 TRP C C 58 177.432 178.806 -1.374 1
1 651 . 21 1 1 A 58 58 TRP CA C 58 62.731 62.039 0.692 1
1 652 . 21 1 1 A 58 58 TRP CB C 58 29.122 30.128 -1.006 1
1 657 . 21 1 1 A 58 58 TRP N N 58 119.241 121.479 -2.238 1
1 659 . 21 1 1 A 59 59 ASN H H 59 8.098 8.367 -0.269 1
1 660 . 21 1 1 A 59 59 ASN HA H 59 4.424 4.456 -0.032 1
1 663 . 21 1 1 A 59 59 ASN C C 59 176.952 177.969 -1.017 1
1 664 . 21 1 1 A 59 59 ASN CA C 59 58.135 56.303 1.832 1
1 665 . 21 1 1 A 59 59 ASN CB C 59 40.168 38.147 2.021 1
1 666 . 21 1 1 A 59 59 ASN N N 59 115.747 117.087 -1.340 1
1 667 . 21 1 1 A 60 60 THR H H 60 8.712 7.840 0.872 1
1 668 . 21 1 1 A 60 60 THR HA H 60 3.717 4.083 -0.366 1
1 673 . 21 1 1 A 60 60 THR C C 60 176.044 176.796 -0.752 1
1 674 . 21 1 1 A 60 60 THR CA C 60 66.576 66.271 0.305 1
1 675 . 21 1 1 A 60 60 THR CB C 60 69.251 68.391 0.860 1
1 677 . 21 1 1 A 60 60 THR N N 60 114.896 118.304 -3.408 1
1 678 . 21 1 1 A 61 61 LEU H H 61 8.485 8.206 0.279 1
1 679 . 21 1 1 A 61 61 LEU HA H 61 3.391 4.076 -0.685 1
1 689 . 21 1 1 A 61 61 LEU C C 61 177.433 178.260 -0.827 1
1 690 . 21 1 1 A 61 61 LEU CA C 61 58.354 58.349 0.005 1
1 691 . 21 1 1 A 61 61 LEU CB C 61 41.761 42.168 -0.407 1
1 695 . 21 1 1 A 61 61 LEU N N 61 123.433 122.490 0.943 1
1 696 . 21 1 1 A 62 62 VAL H H 62 8.073 8.095 -0.022 1
1 697 . 21 1 1 A 62 62 VAL HA H 62 3.207 3.783 -0.576 1
1 705 . 21 1 1 A 62 62 VAL C C 62 177.585 177.380 0.205 1
1 706 . 21 1 1 A 62 62 VAL CA C 62 67.345 65.046 2.299 1
1 707 . 21 1 1 A 62 62 VAL CB C 62 30.905 30.421 0.484 1
1 710 . 21 1 1 A 62 62 VAL N N 62 116.018 118.456 -2.438 1
1 711 . 21 1 1 A 63 63 ARG H H 63 7.765 8.005 -0.240 1
1 712 . 21 1 1 A 63 63 ARG HA H 63 3.602 4.000 -0.398 1
1 719 . 21 1 1 A 63 63 ARG C C 63 177.818 178.095 -0.277 1
1 720 . 21 1 1 A 63 63 ARG CA C 63 58.049 59.589 -1.540 1
1 721 . 21 1 1 A 63 63 ARG CB C 63 29.955 29.882 0.073 1
1 724 . 21 1 1 A 63 63 ARG N N 63 116.700 122.456 -5.756 1
1 725 . 21 1 1 A 64 64 ALA H H 64 7.574 7.744 -0.170 1
1 726 . 21 1 1 A 64 64 ALA HA H 64 4.158 4.285 -0.127 1
1 730 . 21 1 1 A 64 64 ALA C C 64 179.886 179.477 0.409 1
1 731 . 21 1 1 A 64 64 ALA CA C 64 54.007 54.384 -0.377 1
1 732 . 21 1 1 A 64 64 ALA CB C 64 19.147 19.557 -0.410 1
1 733 . 21 1 1 A 64 64 ALA N N 64 117.555 121.436 -3.881 1
1 734 . 21 1 1 A 65 65 VAL H H 65 7.554 8.121 -0.567 1
1 735 . 21 1 1 A 65 65 VAL HA H 65 4.253 3.800 0.453 1
1 743 . 21 1 1 A 65 65 VAL C C 65 174.180 176.352 -2.172 1
1 744 . 21 1 1 A 65 65 VAL CA C 65 62.683 65.506 -2.823 1
1 745 . 21 1 1 A 65 65 VAL CB C 65 33.458 31.264 2.194 1
1 748 . 21 1 1 A 65 65 VAL N N 65 110.013 115.362 -5.349 1
1 749 . 21 1 1 A 66 66 LEU H H 66 7.792 7.069 0.723 1
1 750 . 21 1 1 A 66 66 LEU HA H 66 4.790 4.779 0.011 1
1 760 . 21 1 1 A 66 66 LEU C C 66 177.537 175.530 2.007 1
1 761 . 21 1 1 A 66 66 LEU CA C 66 52.823 52.669 0.154 1
1 762 . 21 1 1 A 66 66 LEU CB C 66 44.071 45.468 -1.397 1
1 766 . 21 1 1 A 66 66 LEU N N 66 118.967 121.652 -2.685 1
1 767 . 21 1 1 A 67 67 SER H H 67 9.208 8.576 0.632 1
1 768 . 21 1 1 A 67 67 SER HA H 67 4.414 4.777 -0.363 1
1 771 . 21 1 1 A 67 67 SER CA C 67 57.943 56.998 0.945 1
1 772 . 21 1 1 A 67 67 SER CB C 67 64.743 66.697 -1.954 1
1 773 . 21 1 1 A 67 67 SER N N 67 116.378 116.372 0.006 1
1 774 . 21 1 1 A 69 69 GLY HA2 H 69 3.916 3.691 0.225 1
1 775 . 21 1 1 A 69 69 GLY HA3 H 69 3.867 3.733 0.134 1
1 776 . 21 1 1 A 69 69 GLY C C 69 176.783 175.507 1.276 1
1 777 . 21 1 1 A 69 69 GLY CA C 69 46.977 46.748 0.229 1
1 778 . 21 1 1 A 70 70 ASP H H 70 7.674 8.085 -0.411 1
1 779 . 21 1 1 A 70 70 ASP HA H 70 4.511 3.629 0.882 1
1 782 . 21 1 1 A 70 70 ASP C C 70 178.096 178.344 -0.248 1
1 783 . 21 1 1 A 70 70 ASP CA C 70 57.262 56.479 0.783 1
1 784 . 21 1 1 A 70 70 ASP CB C 70 40.594 39.783 0.811 1
1 785 . 21 1 1 A 70 70 ASP N N 70 123.930 121.972 1.958 1
1 786 . 21 1 1 A 71 71 HIS H H 71 8.729 7.718 1.011 1
1 787 . 21 1 1 A 71 71 HIS HA H 71 4.235 4.124 0.111 1
1 790 . 21 1 1 A 71 71 HIS C C 71 176.769 176.581 0.188 1
1 791 . 21 1 1 A 71 71 HIS CA C 71 60.041 59.854 0.187 1
1 792 . 21 1 1 A 71 71 HIS CB C 71 30.682 30.243 0.439 1
1 793 . 21 1 1 A 71 71 HIS N N 71 121.003 119.557 1.446 1
1 794 . 21 1 1 A 72 72 LEU H H 72 7.620 7.942 -0.322 1
1 795 . 21 1 1 A 72 72 LEU HA H 72 3.769 3.865 -0.096 1
1 805 . 21 1 1 A 72 72 LEU C C 72 180.275 179.133 1.142 1
1 806 . 21 1 1 A 72 72 LEU CA C 72 58.192 57.973 0.219 1
1 807 . 21 1 1 A 72 72 LEU CB C 72 41.381 41.216 0.165 1
1 811 . 21 1 1 A 72 72 LEU N N 72 118.569 118.465 0.104 1
1 812 . 21 1 1 A 73 73 LEU H H 73 7.542 7.428 0.114 1
1 813 . 21 1 1 A 73 73 LEU HA H 73 4.107 4.138 -0.031 1
1 823 . 21 1 1 A 73 73 LEU C C 73 179.436 179.133 0.303 1
1 824 . 21 1 1 A 73 73 LEU CA C 73 58.026 57.252 0.774 1
1 825 . 21 1 1 A 73 73 LEU CB C 73 41.638 41.994 -0.356 1
1 829 . 21 1 1 A 73 73 LEU N N 73 121.418 120.559 0.859 1
1 830 . 21 1 1 A 74 74 TRP H H 74 8.786 8.340 0.446 1
1 831 . 21 1 1 A 74 74 TRP HA H 74 3.589 5.271 -1.682 1
1 840 . 21 1 1 A 74 74 TRP C C 74 176.816 178.565 -1.749 1
1 841 . 21 1 1 A 74 74 TRP CA C 74 63.046 59.748 3.298 1
1 842 . 21 1 1 A 74 74 TRP CB C 74 28.065 28.926 -0.861 1
1 848 . 21 1 1 A 74 74 TRP N N 74 121.111 117.984 3.127 1
1 850 . 21 1 1 A 75 75 LYS H H 75 8.939 7.495 1.444 1
1 851 . 21 1 1 A 75 75 LYS HA H 75 3.055 3.819 -0.764 1
1 860 . 21 1 1 A 75 75 LYS C C 75 177.967 178.670 -0.703 1
1 861 . 21 1 1 A 75 75 LYS CA C 75 60.029 58.397 1.632 1
1 862 . 21 1 1 A 75 75 LYS CB C 75 32.533 32.339 0.194 1
1 866 . 21 1 1 A 75 75 LYS N N 75 119.783 118.343 1.440 1
1 867 . 21 1 1 A 76 76 SER H H 76 7.832 7.665 0.167 1
1 868 . 21 1 1 A 76 76 SER HA H 76 4.040 3.990 0.050 1
1 871 . 21 1 1 A 76 76 SER C C 76 177.816 176.378 1.438 1
1 872 . 21 1 1 A 76 76 SER CA C 76 62.105 61.848 0.257 1
1 873 . 21 1 1 A 76 76 SER CB C 76 62.679 62.965 -0.286 1
1 874 . 21 1 1 A 76 76 SER N N 76 113.395 117.048 -3.653 1
1 875 . 21 1 1 A 77 77 GLU H H 77 7.590 7.581 0.009 1
1 876 . 21 1 1 A 77 77 GLU HA H 77 4.042 4.303 -0.261 1
1 881 . 21 1 1 A 77 77 GLU C C 77 177.809 178.409 -0.600 1
1 882 . 21 1 1 A 77 77 GLU CA C 77 58.270 58.031 0.239 1
1 883 . 21 1 1 A 77 77 GLU CB C 77 29.208 29.655 -0.447 1
1 885 . 21 1 1 A 77 77 GLU N N 77 121.574 122.175 -0.601 1
1 886 . 21 1 1 A 78 78 PHE H H 78 9.081 7.628 1.453 1
1 887 . 21 1 1 A 78 78 PHE HA H 78 3.778 4.186 -0.408 1
1 895 . 21 1 1 A 78 78 PHE C C 78 178.114 177.371 0.743 1
1 896 . 21 1 1 A 78 78 PHE CA C 78 60.629 61.396 -0.767 1
1 897 . 21 1 1 A 78 78 PHE CB C 78 38.295 38.776 -0.481 1
1 902 . 21 1 1 A 78 78 PHE N N 78 122.682 122.689 -0.007 1
1 903 . 21 1 1 A 79 79 PHE H H 79 8.890 7.697 1.193 1
1 904 . 21 1 1 A 79 79 PHE HA H 79 3.800 4.071 -0.271 1
1 912 . 21 1 1 A 79 79 PHE C C 79 178.354 178.351 0.003 1
1 913 . 21 1 1 A 79 79 PHE CA C 79 60.704 61.796 -1.092 1
1 914 . 21 1 1 A 79 79 PHE CB C 79 37.184 38.499 -1.315 1
1 920 . 21 1 1 A 79 79 PHE N N 79 121.056 118.320 2.736 1
1 921 . 21 1 1 A 80 80 GLU H H 80 7.793 8.168 -0.375 1
1 922 . 21 1 1 A 80 80 GLU HA H 80 4.082 3.979 0.103 1
1 927 . 21 1 1 A 80 80 GLU C C 80 179.068 179.290 -0.222 1
1 928 . 21 1 1 A 80 80 GLU CA C 80 59.735 59.598 0.137 1
1 929 . 21 1 1 A 80 80 GLU CB C 80 28.722 29.117 -0.395 1
1 931 . 21 1 1 A 80 80 GLU N N 80 120.312 118.261 2.051 1
1 932 . 21 1 1 A 81 81 ASN H H 81 8.624 8.616 0.008 1
1 933 . 21 1 1 A 81 81 ASN HA H 81 4.521 4.539 -0.018 1
1 938 . 21 1 1 A 81 81 ASN C C 81 179.262 177.974 1.288 1
1 939 . 21 1 1 A 81 81 ASN CA C 81 55.504 56.461 -0.957 1
1 940 . 21 1 1 A 81 81 ASN CB C 81 37.517 38.291 -0.774 1
1 941 . 21 1 1 A 81 81 ASN N N 81 119.338 118.499 0.839 1
1 943 . 21 1 1 A 82 82 CYS H H 82 8.554 7.989 0.565 1
1 944 . 21 1 1 A 82 82 CYS HA H 82 3.792 4.047 -0.255 1
1 947 . 21 1 1 A 82 82 CYS C C 82 176.478 177.227 -0.749 1
1 948 . 21 1 1 A 82 82 CYS CA C 82 65.232 63.598 1.634 1
1 949 . 21 1 1 A 82 82 CYS CB C 82 26.762 26.621 0.141 1
1 950 . 21 1 1 A 82 82 CYS N N 82 120.576 117.808 2.768 1
1 951 . 21 1 1 A 83 83 ARG H H 83 8.522 7.683 0.839 1
1 952 . 21 1 1 A 83 83 ARG HA H 83 3.932 4.268 -0.336 1
1 960 . 21 1 1 A 83 83 ARG C C 83 179.138 178.607 0.531 1
1 961 . 21 1 1 A 83 83 ARG CA C 83 60.443 58.816 1.627 1
1 962 . 21 1 1 A 83 83 ARG CB C 83 29.550 29.891 -0.341 1
1 965 . 21 1 1 A 83 83 ARG N N 83 123.035 119.728 3.307 1
1 967 . 21 1 1 A 84 84 ASP H H 84 7.791 8.416 -0.625 1
1 968 . 21 1 1 A 84 84 ASP HA H 84 4.353 4.431 -0.078 1
1 971 . 21 1 1 A 84 84 ASP C C 84 178.649 178.691 -0.042 1
1 972 . 21 1 1 A 84 84 ASP CA C 84 57.767 57.579 0.188 1
1 973 . 21 1 1 A 84 84 ASP CB C 84 41.305 41.523 -0.218 1
1 974 . 21 1 1 A 84 84 ASP N N 84 120.332 119.706 0.626 1
1 975 . 21 1 1 A 85 85 THR H H 85 8.370 8.231 0.139 1
1 976 . 21 1 1 A 85 85 THR HA H 85 3.730 3.858 -0.128 1
1 981 . 21 1 1 A 85 85 THR C C 85 175.198 176.410 -1.212 1
1 982 . 21 1 1 A 85 85 THR CA C 85 66.830 65.975 0.855 1
1 983 . 21 1 1 A 85 85 THR CB C 85 68.533 68.411 0.122 1
1 985 . 21 1 1 A 85 85 THR N N 85 117.360 115.859 1.501 1
1 986 . 21 1 1 A 86 86 ALA H H 86 8.845 8.434 0.411 1
1 987 . 21 1 1 A 86 86 ALA HA H 86 3.991 4.195 -0.204 1
1 991 . 21 1 1 A 86 86 ALA C C 86 179.980 179.718 0.262 1
1 992 . 21 1 1 A 86 86 ALA CA C 86 55.769 55.619 0.150 1
1 993 . 21 1 1 A 86 86 ALA CB C 86 17.881 18.500 -0.619 1
1 994 . 21 1 1 A 86 86 ALA N N 86 123.613 123.073 0.540 1
1 995 . 21 1 1 A 87 87 LYS H H 87 7.686 8.242 -0.556 1
1 996 . 21 1 1 A 87 87 LYS HA H 87 4.099 3.994 0.105 1
1 1005 . 21 1 1 A 87 87 LYS C C 87 179.592 178.573 1.019 1
1 1006 . 21 1 1 A 87 87 LYS CA C 87 59.708 59.112 0.596 1
1 1007 . 21 1 1 A 87 87 LYS CB C 87 32.054 31.920 0.134 1
1 1011 . 21 1 1 A 87 87 LYS N N 87 119.623 117.081 2.542 1
1 1012 . 21 1 1 A 88 88 ARG H H 88 7.683 7.608 0.075 1
1 1013 . 21 1 1 A 88 88 ARG HA H 88 4.051 4.139 -0.088 1
1 1020 . 21 1 1 A 88 88 ARG C C 88 180.053 179.352 0.701 1
1 1021 . 21 1 1 A 88 88 ARG CA C 88 59.558 58.887 0.671 1
1 1022 . 21 1 1 A 88 88 ARG CB C 88 29.684 30.107 -0.423 1
1 1025 . 21 1 1 A 88 88 ARG N N 88 120.788 119.555 1.233 1
1 1026 . 21 1 1 A 89 89 ASN H H 89 8.973 8.177 0.796 1
1 1027 . 21 1 1 A 89 89 ASN HA H 89 4.354 4.558 -0.204 1
1 1032 . 21 1 1 A 89 89 ASN C C 89 178.382 177.935 0.447 1
1 1033 . 21 1 1 A 89 89 ASN CA C 89 55.334 55.932 -0.598 1
1 1034 . 21 1 1 A 89 89 ASN CB C 89 37.864 38.447 -0.583 1
1 1035 . 21 1 1 A 89 89 ASN N N 89 121.012 117.980 3.032 1
1 1037 . 21 1 1 A 90 90 GLN H H 90 8.152 8.281 -0.129 1
1 1038 . 21 1 1 A 90 90 GLN HA H 90 4.020 4.082 -0.062 1
1 1045 . 21 1 1 A 90 90 GLN C C 90 179.075 178.679 0.396 1
1 1046 . 21 1 1 A 90 90 GLN CA C 90 59.318 58.998 0.320 1
1 1047 . 21 1 1 A 90 90 GLN CB C 90 28.049 28.113 -0.064 1
1 1049 . 21 1 1 A 90 90 GLN N N 90 122.122 118.510 3.612 1
1 1051 . 21 1 1 A 91 91 GLN H H 91 7.514 7.941 -0.427 1
1 1052 . 21 1 1 A 91 91 GLN HA H 91 4.053 4.008 0.045 1
1 1059 . 21 1 1 A 91 91 GLN C C 91 177.081 178.651 -1.570 1
1 1060 . 21 1 1 A 91 91 GLN CA C 91 58.031 58.774 -0.743 1
1 1061 . 21 1 1 A 91 91 GLN CB C 91 28.365 28.384 -0.019 1
1 1063 . 21 1 1 A 91 91 GLN N N 91 118.124 119.742 -1.618 1
1 1065 . 21 1 1 A 92 92 ALA H H 92 7.704 7.034 0.670 1
1 1066 . 21 1 1 A 92 92 ALA HA H 92 4.246 4.274 -0.028 1
1 1070 . 21 1 1 A 92 92 ALA C C 92 178.450 178.124 0.326 1
1 1071 . 21 1 1 A 92 92 ALA CA C 92 52.671 52.654 0.017 1
1 1072 . 21 1 1 A 92 92 ALA CB C 92 19.316 19.797 -0.481 1
1 1073 . 21 1 1 A 92 92 ALA N N 92 119.880 119.124 0.756 1
1 1074 . 21 1 1 A 93 93 GLY H H 93 7.693 7.892 -0.199 1
1 1075 . 21 1 1 A 93 93 GLY HA2 H 93 3.941 3.943 -0.002 1
1 1076 . 21 1 1 A 93 93 GLY HA3 H 93 3.744 3.951 -0.207 1
1 1077 . 21 1 1 A 93 93 GLY C C 93 174.344 175.033 -0.689 1
1 1078 . 21 1 1 A 93 93 GLY CA C 93 45.949 46.394 -0.445 1
1 1079 . 21 1 1 A 93 93 GLY N N 93 105.347 106.508 -1.161 1
1 1080 . 21 1 1 A 94 94 ASN H H 94 7.076 8.147 -1.071 1
1 1081 . 21 1 1 A 94 94 ASN HA H 94 4.115 4.609 -0.494 1
1 1085 . 21 1 1 A 94 94 ASN C C 94 175.410 175.614 -0.204 1
1 1086 . 21 1 1 A 94 94 ASN CA C 94 52.651 52.954 -0.303 1
1 1087 . 21 1 1 A 94 94 ASN CB C 94 38.330 39.116 -0.786 1
1 1088 . 21 1 1 A 94 94 ASN N N 94 115.747 116.944 -1.197 1
1 1090 . 21 1 1 A 95 95 GLY H H 95 8.236 8.656 -0.420 1
1 1091 . 21 1 1 A 95 95 GLY HA2 H 95 3.633 3.670 -0.037 1
1 1092 . 21 1 1 A 95 95 GLY HA3 H 95 3.633 3.859 -0.226 1
1 1093 . 21 1 1 A 95 95 GLY C C 95 174.450 173.435 1.015 1
1 1094 . 21 1 1 A 95 95 GLY CA C 95 45.522 45.833 -0.311 1
1 1095 . 21 1 1 A 95 95 GLY N N 95 109.166 107.068 2.098 1
1 1096 . 21 1 1 A 96 96 TRP H H 96 7.899 7.940 -0.041 1
1 1097 . 21 1 1 A 96 96 TRP HA H 96 5.241 5.137 0.104 1
1 1106 . 21 1 1 A 96 96 TRP C C 96 175.661 175.696 -0.035 1
1 1107 . 21 1 1 A 96 96 TRP CA C 96 55.090 56.277 -1.187 1
1 1108 . 21 1 1 A 96 96 TRP CB C 96 27.138 32.458 -5.320 1
1 1114 . 21 1 1 A 96 96 TRP N N 96 122.840 119.863 2.977 1
1 1116 . 21 1 1 A 97 97 ASP H H 97 7.344 9.052 -1.708 1
1 1117 . 21 1 1 A 97 97 ASP HA H 97 4.829 4.358 0.471 1
1 1120 . 21 1 1 A 97 97 ASP C C 97 175.019 176.363 -1.344 1
1 1121 . 21 1 1 A 97 97 ASP CA C 97 52.149 56.382 -4.233 1
1 1122 . 21 1 1 A 97 97 ASP CB C 97 42.697 38.657 4.040 1
1 1123 . 21 1 1 A 97 97 ASP N N 97 126.861 117.170 9.691 1
1 1124 . 21 1 1 A 98 98 PHE H H 98 8.566 8.781 -0.215 1
1 1125 . 21 1 1 A 98 98 PHE HA H 98 3.727 4.146 -0.419 1
1 1133 . 21 1 1 A 98 98 PHE C C 98 177.443 177.662 -0.219 1
1 1134 . 21 1 1 A 98 98 PHE CA C 98 62.471 61.652 0.819 1
1 1135 . 21 1 1 A 98 98 PHE CB C 98 39.919 39.900 0.019 1
1 1141 . 21 1 1 A 98 98 PHE N N 98 117.781 121.400 -3.619 1
1 1142 . 21 1 1 A 99 99 ASP H H 99 8.259 8.306 -0.047 1
1 1143 . 21 1 1 A 99 99 ASP HA H 99 3.960 4.003 -0.043 1
1 1146 . 21 1 1 A 99 99 ASP C C 99 178.132 178.465 -0.333 1
1 1147 . 21 1 1 A 99 99 ASP CA C 99 57.658 56.235 1.423 1
1 1148 . 21 1 1 A 99 99 ASP CB C 99 38.572 40.175 -1.603 1
1 1149 . 21 1 1 A 99 99 ASP N N 99 121.709 119.147 2.562 1
1 1150 . 21 1 1 A 100 100 MET H H 100 8.008 7.925 0.083 1
1 1151 . 21 1 1 A 100 100 MET HA H 100 3.644 4.361 -0.717 1
1 1156 . 21 1 1 A 100 100 MET C C 100 180.008 177.471 2.537 1
1 1157 . 21 1 1 A 100 100 MET CA C 100 58.598 58.290 0.308 1
1 1158 . 21 1 1 A 100 100 MET CB C 100 33.423 33.816 -0.393 1
1 1160 . 21 1 1 A 100 100 MET N N 100 119.668 116.495 3.173 1
1 1161 . 21 1 1 A 101 101 LEU H H 101 7.961 8.003 -0.042 1
1 1162 . 21 1 1 A 101 101 LEU HA H 101 3.523 4.379 -0.856 1
1 1172 . 21 1 1 A 101 101 LEU C C 101 173.873 176.596 -2.723 1
1 1173 . 21 1 1 A 101 101 LEU CA C 101 58.743 54.563 4.180 1
1 1174 . 21 1 1 A 101 101 LEU CB C 101 42.632 41.409 1.223 1
1 1178 . 21 1 1 A 101 101 LEU N N 101 119.752 118.795 0.957 1
1 1179 . 21 1 1 A 102 102 THR H H 102 6.955 8.329 -1.374 1
1 1180 . 21 1 1 A 102 102 THR HA H 102 4.134 4.463 -0.329 1
1 1185 . 21 1 1 A 102 102 THR C C 102 176.513 175.412 1.101 1
1 1186 . 21 1 1 A 102 102 THR CA C 102 61.125 62.282 -1.157 1
1 1187 . 21 1 1 A 102 102 THR CB C 102 71.415 70.825 0.590 1
1 1189 . 21 1 1 A 102 102 THR N N 102 124.665 117.468 7.197 1
1 1190 . 21 1 1 A 103 103 GLY H H 103 7.816 7.822 -0.006 1
1 1191 . 21 1 1 A 103 103 GLY HA2 H 103 3.824 3.945 -0.121 1
1 1192 . 21 1 1 A 103 103 GLY HA3 H 103 3.824 4.076 -0.252 1
1 1193 . 21 1 1 A 103 103 GLY C C 103 174.126 174.685 -0.559 1
1 1194 . 21 1 1 A 103 103 GLY CA C 103 47.805 46.632 1.173 1
1 1195 . 21 1 1 A 103 103 GLY N N 103 114.191 112.674 1.517 1
1 1196 . 21 1 1 A 104 104 SER H H 104 8.860 7.778 1.082 1
1 1197 . 21 1 1 A 104 104 SER HA H 104 4.758 4.697 0.061 1
1 1200 . 21 1 1 A 104 104 SER C C 104 174.591 174.672 -0.081 1
1 1201 . 21 1 1 A 104 104 SER CA C 104 56.755 56.916 -0.161 1
1 1202 . 21 1 1 A 104 104 SER CB C 104 65.050 64.844 0.206 1
1 1203 . 21 1 1 A 104 104 SER N N 104 114.771 115.760 -0.989 1
1 1204 . 21 1 1 A 105 105 GLY H H 105 8.788 8.434 0.354 1
1 1205 . 21 1 1 A 105 105 GLY HA2 H 105 3.733 4.102 -0.369 1
1 1206 . 21 1 1 A 105 105 GLY HA3 H 105 3.733 4.132 -0.399 1
1 1207 . 21 1 1 A 105 105 GLY CA C 105 47.247 45.897 1.350 1
1 1208 . 21 1 1 A 105 105 GLY N N 105 110.394 112.340 -1.946 1
1 1209 . 21 1 1 A 106 106 ASN HA H 106 4.454 4.658 -0.204 1
1 1212 . 21 1 1 A 106 106 ASN C C 106 175.180 176.359 -1.179 1
1 1213 . 21 1 1 A 106 106 ASN CA C 106 54.492 54.825 -0.333 1
1 1214 . 21 1 1 A 106 106 ASN CB C 106 37.282 40.001 -2.719 1
1 1215 . 21 1 1 A 107 107 TYR H H 107 8.241 7.606 0.635 1
1 1216 . 21 1 1 A 107 107 TYR HA H 107 4.335 4.848 -0.513 1
1 1223 . 21 1 1 A 107 107 TYR C C 107 173.954 176.508 -2.554 1
1 1224 . 21 1 1 A 107 107 TYR CA C 107 57.727 56.979 0.748 1
1 1225 . 21 1 1 A 107 107 TYR CB C 107 37.063 40.075 -3.012 1
1 1230 . 21 1 1 A 107 107 TYR N N 107 120.708 112.050 8.658 1
1 1231 . 21 1 1 A 108 108 SER H H 108 7.117 7.588 -0.471 1
1 1232 . 21 1 1 A 108 108 SER HA H 108 4.221 4.642 -0.421 1
1 1235 . 21 1 1 A 108 108 SER C C 108 174.834 174.880 -0.046 1
1 1236 . 21 1 1 A 108 108 SER CA C 108 59.859 59.622 0.237 1
1 1237 . 21 1 1 A 108 108 SER CB C 108 63.846 63.978 -0.132 1
1 1238 . 21 1 1 A 108 108 SER N N 108 113.362 115.205 -1.843 1
1 1239 . 21 1 1 A 109 109 SER H H 109 8.053 7.971 0.082 1
1 1240 . 21 1 1 A 109 109 SER HA H 109 4.560 4.154 0.406 1
1 1243 . 21 1 1 A 109 109 SER CA C 109 57.141 60.626 -3.485 1
1 1244 . 21 1 1 A 109 109 SER CB C 109 64.874 61.777 3.097 1
1 1245 . 21 1 1 A 109 109 SER N N 109 116.657 115.970 0.687 1
1 1246 . 21 1 1 A 110 110 THR HA H 110 3.541 3.831 -0.290 1
1 1251 . 21 1 1 A 110 110 THR C C 110 175.477 176.008 -0.531 1
1 1252 . 21 1 1 A 110 110 THR CA C 110 66.443 66.376 0.067 1
1 1253 . 21 1 1 A 110 110 THR CB C 110 68.091 68.009 0.082 1
1 1255 . 21 1 1 A 111 111 ASP H H 111 8.224 8.154 0.070 1
1 1256 . 21 1 1 A 111 111 ASP HA H 111 4.237 4.345 -0.108 1
1 1259 . 21 1 1 A 111 111 ASP C C 111 177.520 178.266 -0.746 1
1 1260 . 21 1 1 A 111 111 ASP CA C 111 57.559 57.059 0.500 1
1 1261 . 21 1 1 A 111 111 ASP CB C 111 40.292 41.618 -1.326 1
1 1262 . 21 1 1 A 111 111 ASP N N 111 119.490 121.291 -1.801 1
1 1263 . 21 1 1 A 112 112 ALA H H 112 7.431 7.747 -0.316 1
1 1264 . 21 1 1 A 112 112 ALA HA H 112 4.191 3.986 0.205 1
1 1268 . 21 1 1 A 112 112 ALA C C 112 180.646 179.621 1.025 1
1 1269 . 21 1 1 A 112 112 ALA CA C 112 54.534 54.552 -0.018 1
1 1270 . 21 1 1 A 112 112 ALA CB C 112 18.992 18.194 0.798 1
1 1271 . 21 1 1 A 112 112 ALA N N 112 119.710 121.124 -1.414 1
1 1272 . 21 1 1 A 113 113 GLN H H 113 7.576 7.620 -0.044 1
1 1273 . 21 1 1 A 113 113 GLN HA H 113 3.562 3.363 0.199 1
1 1278 . 21 1 1 A 113 113 GLN C C 113 176.756 177.561 -0.805 1
1 1279 . 21 1 1 A 113 113 GLN CA C 113 57.736 58.214 -0.478 1
1 1280 . 21 1 1 A 113 113 GLN CB C 113 29.110 28.096 1.014 1
1 1281 . 21 1 1 A 113 113 GLN N N 113 117.518 118.122 -0.604 1
1 1283 . 21 1 1 A 114 114 MET H H 114 8.192 7.644 0.548 1
1 1284 . 21 1 1 A 114 114 MET HA H 114 4.231 4.295 -0.064 1
1 1289 . 21 1 1 A 114 114 MET C C 114 175.648 177.111 -1.463 1
1 1290 . 21 1 1 A 114 114 MET CA C 114 57.446 57.707 -0.261 1
1 1291 . 21 1 1 A 114 114 MET CB C 114 33.570 32.862 0.708 1
1 1293 . 21 1 1 A 114 114 MET N N 114 111.509 119.266 -7.757 1
1 1294 . 21 1 1 A 115 115 GLN H H 115 6.940 7.419 -0.479 1
1 1295 . 21 1 1 A 115 115 GLN HA H 115 4.307 4.782 -0.475 1
1 1302 . 21 1 1 A 115 115 GLN C C 115 176.270 175.880 0.390 1
1 1303 . 21 1 1 A 115 115 GLN CA C 115 54.680 54.899 -0.219 1
1 1304 . 21 1 1 A 115 115 GLN CB C 115 28.233 29.222 -0.989 1
1 1306 . 21 1 1 A 115 115 GLN N N 115 114.300 116.884 -2.584 1
1 1308 . 21 1 1 A 116 116 TYR H H 116 6.677 7.357 -0.680 1
1 1309 . 21 1 1 A 116 116 TYR HA H 116 4.193 4.236 -0.043 1
1 1312 . 21 1 1 A 116 116 TYR C C 116 175.268 175.583 -0.315 1
1 1313 . 21 1 1 A 116 116 TYR CA C 116 54.357 61.506 -7.149 1
1 1314 . 21 1 1 A 116 116 TYR CB C 116 35.498 38.928 -3.430 1
1 1315 . 21 1 1 A 116 116 TYR N N 116 117.919 120.874 -2.955 1
1 1316 . 21 1 1 A 117 117 ASP H H 117 8.081 7.999 0.082 1
1 1317 . 21 1 1 A 117 117 ASP HA H 117 4.665 4.699 -0.034 1
1 1320 . 21 1 1 A 117 117 ASP CA C 117 52.422 55.218 -2.796 1
1 1321 . 21 1 1 A 117 117 ASP CB C 117 42.416 39.738 2.678 1
1 1322 . 21 1 1 A 117 117 ASP N N 117 120.887 116.876 4.011 1
1 1323 . 21 1 1 A 118 118 PRO C C 118 179.180 178.395 0.785 1
1 1324 . 21 1 1 A 118 118 PRO CA C 118 65.942 65.162 0.780 1
1 1325 . 21 1 1 A 118 118 PRO CB C 118 32.197 32.054 0.143 1
1 1326 . 21 1 1 A 119 119 GLY H H 119 9.742 8.100 1.642 1
1 1327 . 21 1 1 A 119 119 GLY C C 119 175.622 175.291 0.331 1
1 1328 . 21 1 1 A 119 119 GLY CA C 119 46.785 46.142 0.643 1
1 1329 . 21 1 1 A 119 119 GLY N N 119 106.412 105.789 0.623 1
1 1330 . 21 1 1 A 120 120 LEU H H 120 6.666 7.579 -0.913 1
1 1331 . 21 1 1 A 120 120 LEU HA H 120 3.365 3.873 -0.508 1
1 1341 . 21 1 1 A 120 120 LEU C C 120 179.262 178.364 0.898 1
1 1342 . 21 1 1 A 120 120 LEU CA C 120 56.605 57.030 -0.425 1
1 1343 . 21 1 1 A 120 120 LEU CB C 120 39.262 41.486 -2.224 1
1 1347 . 21 1 1 A 120 120 LEU N N 120 126.226 123.057 3.169 1
1 1348 . 21 1 1 A 121 121 PHE H H 121 7.356 8.632 -1.276 1
1 1349 . 21 1 1 A 121 121 PHE HA H 121 4.459 3.950 0.509 1
1 1352 . 21 1 1 A 121 121 PHE C C 121 179.716 177.570 2.146 1
1 1353 . 21 1 1 A 121 121 PHE CA C 121 62.838 62.058 0.780 1
1 1354 . 21 1 1 A 121 121 PHE CB C 121 37.603 39.149 -1.546 1
1 1355 . 21 1 1 A 121 121 PHE N N 121 117.437 119.550 -2.113 1
1 1356 . 21 1 1 A 122 122 ALA H H 122 7.926 7.786 0.140 1
1 1357 . 21 1 1 A 122 122 ALA HA H 122 4.523 3.837 0.686 1
1 1361 . 21 1 1 A 122 122 ALA C C 122 180.435 179.999 0.436 1
1 1362 . 21 1 1 A 122 122 ALA CA C 122 55.527 55.238 0.289 1
1 1363 . 21 1 1 A 122 122 ALA CB C 122 17.814 17.937 -0.123 1
1 1364 . 21 1 1 A 122 122 ALA N N 122 121.068 121.090 -0.022 1
1 1365 . 21 1 1 A 123 123 GLN H H 123 7.507 8.048 -0.541 1
1 1366 . 21 1 1 A 123 123 GLN HA H 123 4.153 3.995 0.158 1
1 1371 . 21 1 1 A 123 123 GLN C C 123 180.561 178.916 1.645 1
1 1372 . 21 1 1 A 123 123 GLN CA C 123 59.948 58.909 1.039 1
1 1373 . 21 1 1 A 123 123 GLN CB C 123 29.135 28.731 0.404 1
1 1375 . 21 1 1 A 123 123 GLN N N 123 120.324 116.327 3.997 1
1 1376 . 21 1 1 A 124 124 ILE H H 124 8.318 8.441 -0.123 1
1 1377 . 21 1 1 A 124 124 ILE HA H 124 3.635 3.791 -0.156 1
1 1387 . 21 1 1 A 124 124 ILE C C 124 176.481 178.300 -1.819 1
1 1388 . 21 1 1 A 124 124 ILE CA C 124 66.432 65.322 1.110 1
1 1389 . 21 1 1 A 124 124 ILE CB C 124 39.168 37.905 1.263 1
1 1393 . 21 1 1 A 124 124 ILE N N 124 123.747 120.926 2.821 1
1 1394 . 21 1 1 A 125 125 GLN H H 125 8.474 7.827 0.647 1
1 1395 . 21 1 1 A 125 125 GLN HA H 125 4.264 3.939 0.325 1
1 1402 . 21 1 1 A 125 125 GLN C C 125 178.947 178.303 0.644 1
1 1403 . 21 1 1 A 125 125 GLN CA C 125 59.651 58.668 0.983 1
1 1404 . 21 1 1 A 125 125 GLN CB C 125 28.880 28.226 0.654 1
1 1406 . 21 1 1 A 125 125 GLN N N 125 120.368 118.759 1.609 1
1 1408 . 21 1 1 A 126 126 ALA H H 126 8.002 7.868 0.134 1
1 1409 . 21 1 1 A 126 126 ALA HA H 126 4.144 3.950 0.194 1
1 1413 . 21 1 1 A 126 126 ALA C C 126 179.316 180.187 -0.871 1
1 1414 . 21 1 1 A 126 126 ALA CA C 126 55.036 55.064 -0.028 1
1 1415 . 21 1 1 A 126 126 ALA CB C 126 18.087 18.415 -0.328 1
1 1416 . 21 1 1 A 126 126 ALA N N 126 121.661 122.726 -1.065 1
1 1417 . 21 1 1 A 127 127 ALA H H 127 7.823 8.150 -0.327 1
1 1418 . 21 1 1 A 127 127 ALA HA H 127 4.162 4.026 0.136 1
1 1422 . 21 1 1 A 127 127 ALA C C 127 180.707 179.600 1.107 1
1 1423 . 21 1 1 A 127 127 ALA CA C 127 55.080 54.967 0.113 1
1 1424 . 21 1 1 A 127 127 ALA CB C 127 19.354 18.455 0.899 1
1 1425 . 21 1 1 A 127 127 ALA N N 127 119.853 119.739 0.114 1
1 1426 . 21 1 1 A 128 128 ALA H H 128 8.936 7.663 1.273 1
1 1427 . 21 1 1 A 128 128 ALA HA H 128 3.928 3.835 0.093 1
1 1431 . 21 1 1 A 128 128 ALA C C 128 181.031 179.505 1.526 1
1 1432 . 21 1 1 A 128 128 ALA CA C 128 55.502 54.748 0.754 1
1 1433 . 21 1 1 A 128 128 ALA CB C 128 16.609 18.056 -1.447 1
1 1434 . 21 1 1 A 128 128 ALA N N 128 121.355 120.277 1.078 1
1 1435 . 21 1 1 A 129 129 THR H H 129 8.543 7.772 0.771 1
1 1436 . 21 1 1 A 129 129 THR HA H 129 4.015 3.680 0.335 1
1 1441 . 21 1 1 A 129 129 THR C C 129 177.332 176.453 0.879 1
1 1442 . 21 1 1 A 129 129 THR CA C 129 65.893 65.181 0.712 1
1 1443 . 21 1 1 A 129 129 THR CB C 129 68.566 68.551 0.015 1
1 1445 . 21 1 1 A 129 129 THR N N 129 112.709 112.299 0.410 1
1 1446 . 21 1 1 A 130 130 LYS H H 130 8.126 7.439 0.687 1
1 1447 . 21 1 1 A 130 130 LYS HA H 130 4.000 4.016 -0.016 1
1 1456 . 21 1 1 A 130 130 LYS C C 130 179.082 178.562 0.520 1
1 1457 . 21 1 1 A 130 130 LYS CA C 130 60.299 58.762 1.537 1
1 1458 . 21 1 1 A 130 130 LYS CB C 130 32.767 32.243 0.524 1
1 1462 . 21 1 1 A 130 130 LYS N N 130 123.879 120.480 3.399 1
1 1463 . 21 1 1 A 131 131 ALA H H 131 7.184 7.731 -0.547 1
1 1464 . 21 1 1 A 131 131 ALA HA H 131 4.005 4.176 -0.171 1
1 1468 . 21 1 1 A 131 131 ALA C C 131 178.482 179.454 -0.972 1
1 1469 . 21 1 1 A 131 131 ALA CA C 131 55.027 55.164 -0.137 1
1 1470 . 21 1 1 A 131 131 ALA CB C 131 18.669 19.437 -0.768 1
1 1471 . 21 1 1 A 131 131 ALA N N 131 118.590 121.078 -2.488 1
1 1472 . 21 1 1 A 132 132 TRP H H 132 7.977 8.699 -0.722 1
1 1473 . 21 1 1 A 132 132 TRP HA H 132 4.001 3.951 0.050 1
1 1480 . 21 1 1 A 132 132 TRP C C 132 177.332 175.478 1.854 1
1 1481 . 21 1 1 A 132 132 TRP CA C 132 60.431 57.627 2.804 1
1 1482 . 21 1 1 A 132 132 TRP CB C 132 27.786 27.522 0.264 1
1 1486 . 21 1 1 A 132 132 TRP N N 132 119.168 117.220 1.948 1
1 1488 . 21 1 1 A 133 133 ARG H H 133 8.006 8.007 -0.001 1
1 1489 . 21 1 1 A 133 133 ARG HA H 133 4.027 4.287 -0.260 1
1 1497 . 21 1 1 A 133 133 ARG C C 133 176.664 177.901 -1.237 1
1 1498 . 21 1 1 A 133 133 ARG CA C 133 59.355 57.495 1.860 1
1 1499 . 21 1 1 A 133 133 ARG CB C 133 30.451 31.777 -1.326 1
1 1502 . 21 1 1 A 133 133 ARG N N 133 113.062 120.639 -7.577 1
1 1504 . 21 1 1 A 134 134 LYS H H 134 7.322 7.808 -0.486 1
1 1505 . 21 1 1 A 134 134 LYS HA H 134 4.313 4.458 -0.145 1
1 1514 . 21 1 1 A 134 134 LYS C C 134 176.282 175.253 1.029 1
1 1515 . 21 1 1 A 134 134 LYS CA C 134 54.922 56.321 -1.399 1
1 1516 . 21 1 1 A 134 134 LYS CB C 134 32.633 31.674 0.959 1
1 1520 . 21 1 1 A 134 134 LYS N N 134 118.170 118.436 -0.266 1
1 1521 . 21 1 1 A 135 135 LEU H H 135 7.440 7.506 -0.066 1
1 1522 . 21 1 1 A 135 135 LEU HA H 135 4.174 4.812 -0.638 1
1 1532 . 21 1 1 A 135 135 LEU CA C 135 54.408 51.267 3.141 1
1 1533 . 21 1 1 A 135 135 LEU CB C 135 40.407 42.090 -1.683 1
1 1537 . 21 1 1 A 135 135 LEU N N 135 123.358 121.293 2.065 1
1 1538 . 21 1 1 A 136 136 PRO HA H 136 4.437 4.760 -0.323 1
1 1545 . 21 1 1 A 136 136 PRO C C 136 177.106 176.083 1.023 1
1 1546 . 21 1 1 A 136 136 PRO CA C 136 62.889 64.432 -1.543 1
1 1547 . 21 1 1 A 136 136 PRO CB C 136 32.192 32.086 0.106 1
1 1550 . 21 1 1 A 137 137 VAL H H 137 8.219 7.472 0.747 1
1 1551 . 21 1 1 A 137 137 VAL HA H 137 4.077 4.590 -0.513 1
1 1559 . 21 1 1 A 137 137 VAL C C 137 176.305 174.333 1.972 1
1 1560 . 21 1 1 A 137 137 VAL CA C 137 61.958 59.836 2.122 1
1 1561 . 21 1 1 A 137 137 VAL CB C 137 32.755 35.688 -2.933 1
1 1564 . 21 1 1 A 137 137 VAL N N 137 120.079 115.345 4.734 1
1 1565 . 21 1 1 A 138 138 LYS H H 138 8.444 8.577 -0.133 1
1 1566 . 21 1 1 A 138 138 LYS HA H 138 4.316 3.838 0.478 1
1 1575 . 21 1 1 A 138 138 LYS C C 138 176.790 177.395 -0.605 1
1 1576 . 21 1 1 A 138 138 LYS CA C 138 56.792 58.461 -1.669 1
1 1577 . 21 1 1 A 138 138 LYS CB C 138 33.205 31.966 1.239 1
1 1581 . 21 1 1 A 138 138 LYS N N 138 126.449 125.495 0.954 1
1 1582 . 21 1 1 A 139 139 GLY H H 139 8.518 8.561 -0.043 1
1 1583 . 21 1 1 A 139 139 GLY HA2 H 139 4.070 3.759 0.311 1
1 1584 . 21 1 1 A 139 139 GLY HA3 H 139 3.897 3.793 0.104 1
1 1585 . 21 1 1 A 139 139 GLY C C 139 172.874 172.559 0.315 1
1 1586 . 21 1 1 A 139 139 GLY CA C 139 45.157 46.898 -1.741 1
1 1587 . 21 1 1 A 139 139 GLY N N 139 112.617 114.509 -1.892 1
1 6 . 22 1 1 A 2 2 VAL H H 2 8.992 9.181 -0.189 1
1 7 . 22 1 1 A 2 2 VAL HA H 2 5.370 4.702 0.668 1
1 15 . 22 1 1 A 2 2 VAL C C 2 174.325 174.973 -0.648 1
1 16 . 22 1 1 A 2 2 VAL CA C 2 61.267 60.996 0.271 1
1 17 . 22 1 1 A 2 2 VAL CB C 2 33.890 33.924 -0.034 1
1 20 . 22 1 1 A 2 2 VAL N N 2 126.939 120.619 6.320 1
1 21 . 22 1 1 A 3 3 THR H H 3 8.912 9.362 -0.450 1
1 22 . 22 1 1 A 3 3 THR HA H 3 4.505 5.383 -0.878 1
1 27 . 22 1 1 A 3 3 THR C C 3 172.710 172.098 0.612 1
1 28 . 22 1 1 A 3 3 THR CA C 3 59.689 59.543 0.146 1
1 29 . 22 1 1 A 3 3 THR CB C 3 72.398 72.647 -0.249 1
1 31 . 22 1 1 A 3 3 THR N N 3 118.091 121.604 -3.513 1
1 32 . 22 1 1 A 4 4 GLU H H 4 8.631 8.899 -0.268 1
1 33 . 22 1 1 A 4 4 GLU HA H 4 5.788 5.286 0.502 1
1 38 . 22 1 1 A 4 4 GLU C C 4 175.758 174.172 1.586 1
1 39 . 22 1 1 A 4 4 GLU CA C 4 54.902 54.770 0.132 1
1 40 . 22 1 1 A 4 4 GLU CB C 4 35.097 32.944 2.153 1
1 42 . 22 1 1 A 4 4 GLU N N 4 120.966 127.136 -6.170 1
1 43 . 22 1 1 A 5 5 THR H H 5 9.188 8.894 0.294 1
1 44 . 22 1 1 A 5 5 THR HA H 5 4.739 5.077 -0.338 1
1 49 . 22 1 1 A 5 5 THR C C 5 172.757 173.261 -0.504 1
1 50 . 22 1 1 A 5 5 THR CA C 5 60.382 60.410 -0.028 1
1 51 . 22 1 1 A 5 5 THR CB C 5 71.558 71.078 0.480 1
1 53 . 22 1 1 A 5 5 THR N N 5 119.366 120.646 -1.280 1
1 54 . 22 1 1 A 6 6 VAL H H 6 8.476 9.028 -0.552 1
1 55 . 22 1 1 A 6 6 VAL HA H 6 5.026 5.088 -0.062 1
1 63 . 22 1 1 A 6 6 VAL C C 6 176.674 174.998 1.676 1
1 64 . 22 1 1 A 6 6 VAL CA C 6 61.008 59.642 1.366 1
1 65 . 22 1 1 A 6 6 VAL CB C 6 33.861 33.980 -0.119 1
1 68 . 22 1 1 A 6 6 VAL N N 6 121.384 123.651 -2.267 1
1 69 . 22 1 1 A 7 7 ASP H H 7 8.848 8.552 0.296 1
1 70 . 22 1 1 A 7 7 ASP HA H 7 4.797 5.158 -0.361 1
1 73 . 22 1 1 A 7 7 ASP CA C 7 52.834 52.455 0.379 1
1 74 . 22 1 1 A 7 7 ASP CB C 7 42.219 44.222 -2.003 1
1 75 . 22 1 1 A 7 7 ASP N N 7 127.061 121.466 5.595 1
1 76 . 22 1 1 A 8 8 GLY C C 8 175.143 174.668 0.475 1
1 77 . 22 1 1 A 8 8 GLY CA C 8 46.553 45.833 0.720 1
1 78 . 22 1 1 A 9 9 GLN H H 9 8.408 7.619 0.789 1
1 79 . 22 1 1 A 9 9 GLN HA H 9 4.541 4.427 0.114 1
1 86 . 22 1 1 A 9 9 GLN C C 9 176.463 176.032 0.431 1
1 87 . 22 1 1 A 9 9 GLN CA C 9 55.167 55.361 -0.194 1
1 88 . 22 1 1 A 9 9 GLN CB C 9 29.376 29.680 -0.304 1
1 90 . 22 1 1 A 9 9 GLN N N 9 118.300 117.682 0.618 1
1 92 . 22 1 1 A 10 10 GLY H H 10 8.162 7.993 0.169 1
1 93 . 22 1 1 A 10 10 GLY HA2 H 10 4.174 3.930 0.244 1
1 94 . 22 1 1 A 10 10 GLY HA3 H 10 3.521 3.937 -0.416 1
1 95 . 22 1 1 A 10 10 GLY C C 10 174.092 174.276 -0.184 1
1 96 . 22 1 1 A 10 10 GLY CA C 10 45.558 45.031 0.527 1
1 97 . 22 1 1 A 10 10 GLY N N 10 108.747 107.217 1.530 1
1 98 . 22 1 1 A 11 11 GLN H H 11 8.507 7.766 0.741 1
1 99 . 22 1 1 A 11 11 GLN HA H 11 4.202 4.225 -0.023 1
1 106 . 22 1 1 A 11 11 GLN C C 11 173.992 174.501 -0.509 1
1 107 . 22 1 1 A 11 11 GLN CA C 11 55.098 55.331 -0.233 1
1 108 . 22 1 1 A 11 11 GLN CB C 11 29.097 29.581 -0.484 1
1 110 . 22 1 1 A 11 11 GLN N N 11 122.979 120.183 2.796 1
1 112 . 22 1 1 A 12 12 ALA H H 12 8.259 8.255 0.004 1
1 113 . 22 1 1 A 12 12 ALA HA H 12 5.156 5.383 -0.227 1
1 117 . 22 1 1 A 12 12 ALA C C 12 177.284 176.070 1.214 1
1 118 . 22 1 1 A 12 12 ALA CA C 12 51.087 49.898 1.189 1
1 119 . 22 1 1 A 12 12 ALA CB C 12 20.500 22.804 -2.304 1
1 120 . 22 1 1 A 12 12 ALA N N 12 127.100 123.501 3.599 1
1 121 . 22 1 1 A 13 13 TRP H H 13 9.245 9.257 -0.012 1
1 122 . 22 1 1 A 13 13 TRP HA H 13 4.717 5.225 -0.508 1
1 131 . 22 1 1 A 13 13 TRP C C 13 175.108 174.714 0.394 1
1 132 . 22 1 1 A 13 13 TRP CA C 13 55.966 55.874 0.092 1
1 133 . 22 1 1 A 13 13 TRP CB C 13 31.912 34.153 -2.241 1
1 139 . 22 1 1 A 13 13 TRP N N 13 123.088 120.353 2.735 1
1 141 . 22 1 1 A 14 14 ARG H H 14 8.575 8.866 -0.291 1
1 142 . 22 1 1 A 14 14 ARG HA H 14 5.335 5.154 0.181 1
1 150 . 22 1 1 A 14 14 ARG C C 14 175.191 174.804 0.387 1
1 151 . 22 1 1 A 14 14 ARG CA C 14 53.106 54.496 -1.390 1
1 152 . 22 1 1 A 14 14 ARG CB C 14 32.749 33.628 -0.879 1
1 154 . 22 1 1 A 14 14 ARG N N 14 121.163 122.075 -0.912 1
1 156 . 22 1 1 A 15 15 HIS H H 15 8.595 9.411 -0.816 1
1 157 . 22 1 1 A 15 15 HIS HA H 15 4.790 4.753 0.037 1
1 161 . 22 1 1 A 15 15 HIS C C 15 173.770 174.393 -0.623 1
1 162 . 22 1 1 A 15 15 HIS CA C 15 55.289 54.228 1.061 1
1 163 . 22 1 1 A 15 15 HIS CB C 15 33.208 33.441 -0.233 1
1 165 . 22 1 1 A 15 15 HIS N N 15 117.643 124.038 -6.395 1
1 166 . 22 1 1 A 16 16 HIS H H 16 8.993 9.064 -0.071 1
1 167 . 22 1 1 A 16 16 HIS HA H 16 5.158 4.739 0.419 1
1 171 . 22 1 1 A 16 16 HIS C C 16 173.608 175.459 -1.851 1
1 172 . 22 1 1 A 16 16 HIS CA C 16 56.450 56.090 0.360 1
1 173 . 22 1 1 A 16 16 HIS CB C 16 34.171 30.336 3.835 1
1 175 . 22 1 1 A 16 16 HIS N N 16 123.520 120.361 3.159 1
1 176 . 22 1 1 A 17 17 ASN H H 17 7.829 9.075 -1.246 1
1 177 . 22 1 1 A 17 17 ASN HA H 17 4.713 5.259 -0.546 1
1 182 . 22 1 1 A 17 17 ASN C C 17 173.682 175.342 -1.660 1
1 183 . 22 1 1 A 17 17 ASN CA C 17 51.822 51.426 0.396 1
1 184 . 22 1 1 A 17 17 ASN CB C 17 43.176 41.542 1.634 1
1 185 . 22 1 1 A 17 17 ASN N N 17 122.213 119.493 2.720 1
1 187 . 22 1 1 A 18 18 GLY H H 18 8.423 8.150 0.273 1
1 188 . 22 1 1 A 18 18 GLY HA2 H 18 3.931 3.768 0.163 1
1 189 . 22 1 1 A 18 18 GLY HA3 H 18 3.707 4.011 -0.304 1
1 190 . 22 1 1 A 18 18 GLY C C 18 173.985 173.005 0.980 1
1 191 . 22 1 1 A 18 18 GLY CA C 18 43.949 44.270 -0.321 1
1 192 . 22 1 1 A 18 18 GLY N N 18 106.991 107.862 -0.871 1
1 193 . 22 1 1 A 19 19 PHE H H 19 8.338 8.168 0.170 1
1 194 . 22 1 1 A 19 19 PHE HA H 19 4.068 5.387 -1.319 1
1 197 . 22 1 1 A 19 19 PHE C C 19 176.568 174.293 2.275 1
1 198 . 22 1 1 A 19 19 PHE CA C 19 59.338 56.488 2.850 1
1 199 . 22 1 1 A 19 19 PHE CB C 19 40.201 43.331 -3.130 1
1 200 . 22 1 1 A 19 19 PHE N N 19 116.857 119.196 -2.339 1
1 201 . 22 1 1 A 20 20 ASP H H 20 8.794 8.733 0.061 1
1 202 . 22 1 1 A 20 20 ASP HA H 20 4.485 4.841 -0.356 1
1 205 . 22 1 1 A 20 20 ASP C C 20 177.379 176.775 0.604 1
1 206 . 22 1 1 A 20 20 ASP CA C 20 54.140 53.908 0.232 1
1 207 . 22 1 1 A 20 20 ASP CB C 20 41.915 41.511 0.404 1
1 208 . 22 1 1 A 20 20 ASP N N 20 123.025 124.167 -1.142 1
1 209 . 22 1 1 A 21 21 PHE H H 21 8.862 9.127 -0.265 1
1 210 . 22 1 1 A 21 21 PHE HA H 21 4.087 4.120 -0.033 1
1 218 . 22 1 1 A 21 21 PHE C C 21 176.952 177.179 -0.227 1
1 219 . 22 1 1 A 21 21 PHE CA C 21 61.095 62.389 -1.294 1
1 220 . 22 1 1 A 21 21 PHE CB C 21 38.678 39.388 -0.710 1
1 226 . 22 1 1 A 21 21 PHE N N 21 127.163 127.362 -0.199 1
1 227 . 22 1 1 A 22 22 ALA H H 22 8.561 8.269 0.292 1
1 228 . 22 1 1 A 22 22 ALA HA H 22 3.878 3.944 -0.066 1
1 232 . 22 1 1 A 22 22 ALA C C 22 180.710 179.706 1.004 1
1 233 . 22 1 1 A 22 22 ALA CA C 22 55.211 55.090 0.121 1
1 234 . 22 1 1 A 22 22 ALA CB C 22 18.321 18.254 0.067 1
1 235 . 22 1 1 A 22 22 ALA N N 22 120.293 121.309 -1.016 1
1 236 . 22 1 1 A 23 23 VAL H H 23 7.241 8.009 -0.768 1
1 237 . 22 1 1 A 23 23 VAL HA H 23 3.684 3.849 -0.165 1
1 245 . 22 1 1 A 23 23 VAL C C 23 177.101 178.020 -0.919 1
1 246 . 22 1 1 A 23 23 VAL CA C 23 65.237 65.511 -0.274 1
1 247 . 22 1 1 A 23 23 VAL CB C 23 31.780 31.446 0.334 1
1 250 . 22 1 1 A 23 23 VAL N N 23 118.775 116.959 1.816 1
1 251 . 22 1 1 A 24 24 ILE H H 24 6.761 8.024 -1.263 1
1 252 . 22 1 1 A 24 24 ILE HA H 24 3.196 3.510 -0.314 1
1 262 . 22 1 1 A 24 24 ILE C C 24 177.287 177.968 -0.681 1
1 263 . 22 1 1 A 24 24 ILE CA C 24 63.404 65.791 -2.387 1
1 264 . 22 1 1 A 24 24 ILE CB C 24 36.294 37.659 -1.365 1
1 268 . 22 1 1 A 24 24 ILE N N 24 119.036 121.910 -2.874 1
1 269 . 22 1 1 A 25 25 LYS H H 25 8.032 8.099 -0.067 1
1 270 . 22 1 1 A 25 25 LYS HA H 25 3.809 3.709 0.100 1
1 279 . 22 1 1 A 25 25 LYS C C 25 179.450 178.857 0.593 1
1 280 . 22 1 1 A 25 25 LYS CA C 25 59.621 59.607 0.014 1
1 281 . 22 1 1 A 25 25 LYS CB C 25 32.259 31.968 0.291 1
1 285 . 22 1 1 A 25 25 LYS N N 25 118.368 120.079 -1.711 1
1 286 . 22 1 1 A 26 26 GLU H H 26 7.845 8.332 -0.487 1
1 287 . 22 1 1 A 26 26 GLU HA H 26 4.021 4.194 -0.173 1
1 292 . 22 1 1 A 26 26 GLU C C 26 179.191 178.897 0.294 1
1 293 . 22 1 1 A 26 26 GLU CA C 26 59.530 58.993 0.537 1
1 294 . 22 1 1 A 26 26 GLU CB C 26 29.449 29.504 -0.055 1
1 296 . 22 1 1 A 26 26 GLU N N 26 120.522 119.008 1.514 1
1 297 . 22 1 1 A 27 27 LEU H H 27 8.165 8.047 0.118 1
1 298 . 22 1 1 A 27 27 LEU HA H 27 4.163 4.237 -0.074 1
1 308 . 22 1 1 A 27 27 LEU C C 27 177.256 178.305 -1.049 1
1 309 . 22 1 1 A 27 27 LEU CA C 27 58.049 57.874 0.175 1
1 310 . 22 1 1 A 27 27 LEU CB C 27 41.365 42.009 -0.644 1
1 314 . 22 1 1 A 27 27 LEU N N 27 120.879 120.791 0.088 1
1 315 . 22 1 1 A 28 28 LYS H H 28 8.902 8.130 0.772 1
1 316 . 22 1 1 A 28 28 LYS HA H 28 4.199 4.326 -0.127 1
1 317 . 22 1 1 A 28 28 LYS C C 28 179.707 179.523 0.184 1
1 318 . 22 1 1 A 28 28 LYS CA C 28 60.097 58.964 1.133 1
1 319 . 22 1 1 A 28 28 LYS CB C 28 33.420 31.833 1.587 1
1 320 . 22 1 1 A 28 28 LYS N N 28 120.050 119.444 0.606 1
1 321 . 22 1 1 A 29 29 THR H H 29 8.294 8.381 -0.087 1
1 322 . 22 1 1 A 29 29 THR HA H 29 3.892 3.918 -0.026 1
1 327 . 22 1 1 A 29 29 THR C C 29 175.711 176.520 -0.809 1
1 328 . 22 1 1 A 29 29 THR CA C 29 66.846 66.394 0.452 1
1 329 . 22 1 1 A 29 29 THR CB C 29 68.794 68.463 0.331 1
1 331 . 22 1 1 A 29 29 THR N N 29 115.933 116.756 -0.823 1
1 332 . 22 1 1 A 30 30 ALA H H 30 8.244 8.496 -0.252 1
1 333 . 22 1 1 A 30 30 ALA HA H 30 4.241 4.297 -0.056 1
1 337 . 22 1 1 A 30 30 ALA C C 30 179.128 179.738 -0.610 1
1 338 . 22 1 1 A 30 30 ALA CA C 30 55.714 55.399 0.315 1
1 339 . 22 1 1 A 30 30 ALA CB C 30 18.955 18.880 0.075 1
1 340 . 22 1 1 A 30 30 ALA N N 30 124.617 123.386 1.231 1
1 341 . 22 1 1 A 31 31 ALA H H 31 8.968 8.516 0.452 1
1 342 . 22 1 1 A 31 31 ALA HA H 31 3.890 4.082 -0.192 1
1 346 . 22 1 1 A 31 31 ALA C C 31 180.352 179.248 1.104 1
1 347 . 22 1 1 A 31 31 ALA CA C 31 55.454 55.453 0.001 1
1 348 . 22 1 1 A 31 31 ALA CB C 31 17.124 18.193 -1.069 1
1 349 . 22 1 1 A 31 31 ALA N N 31 119.327 121.054 -1.727 1
1 350 . 22 1 1 A 32 32 SER H H 32 7.995 7.824 0.171 1
1 351 . 22 1 1 A 32 32 SER HA H 32 4.238 4.135 0.103 1
1 354 . 22 1 1 A 32 32 SER C C 32 175.612 177.301 -1.689 1
1 355 . 22 1 1 A 32 32 SER CA C 32 61.203 61.388 -0.185 1
1 356 . 22 1 1 A 32 32 SER CB C 32 63.406 62.829 0.577 1
1 357 . 22 1 1 A 32 32 SER N N 32 111.962 113.606 -1.644 1
1 358 . 22 1 1 A 33 33 GLN H H 33 8.333 7.721 0.612 1
1 359 . 22 1 1 A 33 33 GLN HA H 33 3.992 3.825 0.167 1
1 366 . 22 1 1 A 33 33 GLN C C 33 177.486 177.692 -0.206 1
1 367 . 22 1 1 A 33 33 GLN CA C 33 58.277 58.364 -0.087 1
1 368 . 22 1 1 A 33 33 GLN CB C 33 29.140 28.224 0.916 1
1 370 . 22 1 1 A 33 33 GLN N N 33 119.527 120.607 -1.080 1
1 372 . 22 1 1 A 34 34 TYR H H 34 8.587 8.009 0.578 1
1 373 . 22 1 1 A 34 34 TYR HA H 34 4.792 4.528 0.264 1
1 380 . 22 1 1 A 34 34 TYR C C 34 176.499 176.645 -0.146 1
1 381 . 22 1 1 A 34 34 TYR CA C 34 57.711 58.966 -1.255 1
1 382 . 22 1 1 A 34 34 TYR CB C 34 39.561 39.105 0.456 1
1 387 . 22 1 1 A 34 34 TYR N N 34 114.610 115.648 -1.038 1
1 388 . 22 1 1 A 35 35 GLY H H 35 7.346 8.263 -0.917 1
1 389 . 22 1 1 A 35 35 GLY HA2 H 35 4.785 4.129 0.656 1
1 390 . 22 1 1 A 35 35 GLY HA3 H 35 4.007 4.137 -0.130 1
1 391 . 22 1 1 A 35 35 GLY C C 35 175.796 173.369 2.427 1
1 392 . 22 1 1 A 35 35 GLY CA C 35 44.355 44.761 -0.406 1
1 393 . 22 1 1 A 35 35 GLY N N 35 108.501 107.039 1.462 1
1 394 . 22 1 1 A 36 36 ALA H H 36 9.363 7.897 1.466 1
1 395 . 22 1 1 A 36 36 ALA HA H 36 4.217 4.605 -0.388 1
1 399 . 22 1 1 A 36 36 ALA C C 36 178.039 178.292 -0.253 1
1 400 . 22 1 1 A 36 36 ALA CA C 36 56.114 51.643 4.471 1
1 401 . 22 1 1 A 36 36 ALA CB C 36 19.179 20.222 -1.043 1
1 402 . 22 1 1 A 36 36 ALA N N 36 125.811 123.737 2.074 1
1 403 . 22 1 1 A 37 37 THR H H 37 8.070 8.974 -0.904 1
1 404 . 22 1 1 A 37 37 THR HA H 37 4.570 4.384 0.186 1
1 409 . 22 1 1 A 37 37 THR C C 37 173.685 174.090 -0.405 1
1 410 . 22 1 1 A 37 37 THR CA C 37 59.822 63.851 -4.029 1
1 411 . 22 1 1 A 37 37 THR CB C 37 68.267 67.020 1.247 1
1 413 . 22 1 1 A 37 37 THR N N 37 129.410 115.877 13.533 1
1 414 . 22 1 1 A 38 38 ALA H H 38 6.853 7.806 -0.953 1
1 415 . 22 1 1 A 38 38 ALA HA H 38 4.601 4.551 0.050 1
1 419 . 22 1 1 A 38 38 ALA CA C 38 50.758 50.591 0.167 1
1 420 . 22 1 1 A 38 38 ALA CB C 38 18.325 19.586 -1.261 1
1 421 . 22 1 1 A 38 38 ALA N N 38 124.674 125.325 -0.651 1
1 422 . 22 1 1 A 40 40 TYR HA H 40 4.032 4.025 0.007 1
1 429 . 22 1 1 A 40 40 TYR C C 40 176.456 177.328 -0.872 1
1 430 . 22 1 1 A 40 40 TYR CA C 40 61.010 61.673 -0.663 1
1 431 . 22 1 1 A 40 40 TYR CB C 40 39.286 38.435 0.851 1
1 436 . 22 1 1 A 41 41 THR H H 41 6.874 8.109 -1.235 1
1 437 . 22 1 1 A 41 41 THR HA H 41 3.616 4.014 -0.398 1
1 442 . 22 1 1 A 41 41 THR C C 41 176.930 176.618 0.312 1
1 443 . 22 1 1 A 41 41 THR CA C 41 65.557 65.692 -0.135 1
1 444 . 22 1 1 A 41 41 THR CB C 41 68.228 69.251 -1.023 1
1 446 . 22 1 1 A 41 41 THR N N 41 115.143 114.025 1.118 1
1 447 . 22 1 1 A 42 42 LEU H H 42 8.623 7.327 1.296 1
1 448 . 22 1 1 A 42 42 LEU HA H 42 3.708 4.057 -0.349 1
1 458 . 22 1 1 A 42 42 LEU C C 42 178.206 179.022 -0.816 1
1 459 . 22 1 1 A 42 42 LEU CA C 42 57.417 57.772 -0.355 1
1 460 . 22 1 1 A 42 42 LEU CB C 42 41.342 41.237 0.105 1
1 464 . 22 1 1 A 42 42 LEU N N 42 120.418 118.696 1.722 1
1 465 . 22 1 1 A 43 43 ALA H H 43 7.735 7.833 -0.098 1
1 466 . 22 1 1 A 43 43 ALA HA H 43 4.020 3.916 0.104 1
1 470 . 22 1 1 A 43 43 ALA C C 43 180.826 180.417 0.409 1
1 471 . 22 1 1 A 43 43 ALA CA C 43 54.925 55.096 -0.171 1
1 472 . 22 1 1 A 43 43 ALA CB C 43 17.506 18.139 -0.633 1
1 473 . 22 1 1 A 43 43 ALA N N 43 120.203 121.956 -1.753 1
1 474 . 22 1 1 A 44 44 ILE H H 44 7.149 7.383 -0.234 1
1 475 . 22 1 1 A 44 44 ILE HA H 44 3.603 3.586 0.017 1
1 485 . 22 1 1 A 44 44 ILE C C 44 178.594 177.877 0.717 1
1 486 . 22 1 1 A 44 44 ILE CA C 44 64.782 64.658 0.124 1
1 487 . 22 1 1 A 44 44 ILE CB C 44 37.472 37.654 -0.182 1
1 491 . 22 1 1 A 44 44 ILE N N 44 118.881 119.510 -0.629 1
1 492 . 22 1 1 A 45 45 VAL H H 45 7.968 7.911 0.057 1
1 493 . 22 1 1 A 45 45 VAL HA H 45 2.925 3.351 -0.426 1
1 501 . 22 1 1 A 45 45 VAL C C 45 177.023 177.936 -0.913 1
1 502 . 22 1 1 A 45 45 VAL CA C 45 67.081 67.127 -0.046 1
1 503 . 22 1 1 A 45 45 VAL CB C 45 30.854 31.236 -0.382 1
1 506 . 22 1 1 A 45 45 VAL N N 45 120.764 119.978 0.786 1
1 507 . 22 1 1 A 46 46 GLU H H 46 8.399 8.476 -0.077 1
1 508 . 22 1 1 A 46 46 GLU HA H 46 3.848 3.956 -0.108 1
1 513 . 22 1 1 A 46 46 GLU C C 46 178.656 178.194 0.462 1
1 514 . 22 1 1 A 46 46 GLU CA C 46 59.491 58.769 0.722 1
1 515 . 22 1 1 A 46 46 GLU CB C 46 28.991 28.448 0.543 1
1 517 . 22 1 1 A 46 46 GLU N N 46 116.599 119.658 -3.059 1
1 518 . 22 1 1 A 47 47 SER H H 47 7.273 7.805 -0.532 1
1 519 . 22 1 1 A 47 47 SER HA H 47 4.287 4.214 0.073 1
1 521 . 22 1 1 A 47 47 SER CA C 47 61.047 62.079 -1.032 1
1 522 . 22 1 1 A 47 47 SER CB C 47 63.016 63.041 -0.025 1
1 523 . 22 1 1 A 47 47 SER N N 47 113.609 117.671 -4.062 1
1 524 . 22 1 1 A 48 48 VAL H H 48 8.006 8.253 -0.247 1
1 525 . 22 1 1 A 48 48 VAL HA H 48 3.556 3.616 -0.060 1
1 533 . 22 1 1 A 48 48 VAL C C 48 177.257 176.477 0.780 1
1 534 . 22 1 1 A 48 48 VAL CA C 48 65.025 65.932 -0.907 1
1 535 . 22 1 1 A 48 48 VAL CB C 48 31.841 31.240 0.601 1
1 538 . 22 1 1 A 48 48 VAL N N 48 122.327 121.610 0.717 1
1 539 . 22 1 1 A 49 49 ALA H H 49 8.369 7.549 0.820 1
1 540 . 22 1 1 A 49 49 ALA HA H 49 4.115 4.582 -0.467 1
1 544 . 22 1 1 A 49 49 ALA C C 49 177.307 177.765 -0.458 1
1 545 . 22 1 1 A 49 49 ALA CA C 49 53.253 51.979 1.274 1
1 546 . 22 1 1 A 49 49 ALA CB C 49 20.131 18.806 1.325 1
1 547 . 22 1 1 A 49 49 ALA N N 49 118.050 120.808 -2.758 1
1 548 . 22 1 1 A 50 50 ASP H H 50 7.052 7.791 -0.739 1
1 549 . 22 1 1 A 50 50 ASP HA H 50 4.788 4.516 0.272 1
1 552 . 22 1 1 A 50 50 ASP C C 50 175.481 175.947 -0.466 1
1 553 . 22 1 1 A 50 50 ASP CA C 50 53.681 56.521 -2.840 1
1 554 . 22 1 1 A 50 50 ASP CB C 50 39.333 40.911 -1.578 1
1 555 . 22 1 1 A 50 50 ASP N N 50 116.997 117.841 -0.844 1
1 556 . 22 1 1 A 51 51 ASN H H 51 8.535 7.773 0.762 1
1 557 . 22 1 1 A 51 51 ASN HA H 51 4.628 4.704 -0.076 1
1 562 . 22 1 1 A 51 51 ASN C C 51 174.077 175.389 -1.312 1
1 563 . 22 1 1 A 51 51 ASN CA C 51 52.315 51.504 0.811 1
1 564 . 22 1 1 A 51 51 ASN CB C 51 41.928 39.415 2.513 1
1 565 . 22 1 1 A 51 51 ASN N N 51 118.626 114.240 4.386 1
1 567 . 22 1 1 A 52 52 TRP H H 52 8.555 8.515 0.040 1
1 574 . 22 1 1 A 52 52 TRP C C 52 173.269 176.565 -3.296 1
1 575 . 22 1 1 A 52 52 TRP CA C 52 55.031 57.451 -2.420 1
1 576 . 22 1 1 A 52 52 TRP CB C 52 26.801 30.626 -3.825 1
1 582 . 22 1 1 A 52 52 TRP N N 52 120.693 121.008 -0.315 1
1 584 . 22 1 1 A 53 53 LEU H H 53 7.847 8.723 -0.876 1
1 585 . 22 1 1 A 53 53 LEU HA H 53 4.859 4.882 -0.023 1
1 595 . 22 1 1 A 53 53 LEU C C 53 177.397 175.033 2.364 1
1 596 . 22 1 1 A 53 53 LEU CA C 53 53.619 53.776 -0.157 1
1 597 . 22 1 1 A 53 53 LEU CB C 53 41.812 45.125 -3.313 1
1 601 . 22 1 1 A 53 53 LEU N N 53 124.741 120.182 4.559 1
1 602 . 22 1 1 A 54 54 THR H H 54 8.850 8.419 0.431 1
1 603 . 22 1 1 A 54 54 THR HA H 54 4.598 4.713 -0.115 1
1 608 . 22 1 1 A 54 54 THR CA C 54 60.531 58.706 1.825 1
1 609 . 22 1 1 A 54 54 THR CB C 54 67.183 70.381 -3.198 1
1 611 . 22 1 1 A 54 54 THR N N 54 113.407 108.487 4.920 1
1 612 . 22 1 1 A 55 55 PRO HA H 55 4.511 4.432 0.079 1
1 619 . 22 1 1 A 55 55 PRO C C 55 179.383 177.953 1.430 1
1 620 . 22 1 1 A 55 55 PRO CA C 55 67.159 65.778 1.381 1
1 621 . 22 1 1 A 55 55 PRO CB C 55 32.095 31.985 0.110 1
1 622 . 22 1 1 A 56 56 THR H H 56 8.575 7.729 0.846 1
1 623 . 22 1 1 A 56 56 THR HA H 56 4.229 4.135 0.094 1
1 628 . 22 1 1 A 56 56 THR C C 56 176.668 177.106 -0.438 1
1 629 . 22 1 1 A 56 56 THR CA C 56 66.943 65.350 1.593 1
1 630 . 22 1 1 A 56 56 THR CB C 56 68.129 68.759 -0.630 1
1 632 . 22 1 1 A 56 56 THR N N 56 114.855 110.693 4.162 1
1 633 . 22 1 1 A 57 57 ASP H H 57 8.730 7.926 0.804 1
1 634 . 22 1 1 A 57 57 ASP HA H 57 4.425 4.620 -0.195 1
1 637 . 22 1 1 A 57 57 ASP C C 57 178.351 179.310 -0.959 1
1 638 . 22 1 1 A 57 57 ASP CA C 57 57.963 57.691 0.272 1
1 639 . 22 1 1 A 57 57 ASP CB C 57 40.134 40.605 -0.471 1
1 640 . 22 1 1 A 57 57 ASP N N 57 126.239 121.470 4.769 1
1 641 . 22 1 1 A 58 58 TRP H H 58 8.244 7.995 0.249 1
1 642 . 22 1 1 A 58 58 TRP HA H 58 4.030 4.491 -0.461 1
1 650 . 22 1 1 A 58 58 TRP C C 58 177.432 179.461 -2.029 1
1 651 . 22 1 1 A 58 58 TRP CA C 58 62.731 60.210 2.521 1
1 652 . 22 1 1 A 58 58 TRP CB C 58 29.122 29.203 -0.081 1
1 657 . 22 1 1 A 58 58 TRP N N 58 119.241 120.801 -1.560 1
1 659 . 22 1 1 A 59 59 ASN H H 59 8.098 8.885 -0.787 1
1 660 . 22 1 1 A 59 59 ASN HA H 59 4.424 4.465 -0.041 1
1 663 . 22 1 1 A 59 59 ASN C C 59 176.952 177.771 -0.819 1
1 664 . 22 1 1 A 59 59 ASN CA C 59 58.135 56.580 1.555 1
1 665 . 22 1 1 A 59 59 ASN CB C 59 40.168 38.189 1.979 1
1 666 . 22 1 1 A 59 59 ASN N N 59 115.747 117.663 -1.916 1
1 667 . 22 1 1 A 60 60 THR H H 60 8.712 7.977 0.735 1
1 668 . 22 1 1 A 60 60 THR HA H 60 3.717 4.059 -0.342 1
1 673 . 22 1 1 A 60 60 THR C C 60 176.044 176.757 -0.713 1
1 674 . 22 1 1 A 60 60 THR CA C 60 66.576 65.332 1.244 1
1 675 . 22 1 1 A 60 60 THR CB C 60 69.251 68.374 0.877 1
1 677 . 22 1 1 A 60 60 THR N N 60 114.896 113.021 1.875 1
1 678 . 22 1 1 A 61 61 LEU H H 61 8.485 8.333 0.152 1
1 679 . 22 1 1 A 61 61 LEU HA H 61 3.391 4.084 -0.693 1
1 689 . 22 1 1 A 61 61 LEU C C 61 177.433 178.710 -1.277 1
1 690 . 22 1 1 A 61 61 LEU CA C 61 58.354 58.708 -0.354 1
1 691 . 22 1 1 A 61 61 LEU CB C 61 41.761 42.395 -0.634 1
1 695 . 22 1 1 A 61 61 LEU N N 61 123.433 124.405 -0.972 1
1 696 . 22 1 1 A 62 62 VAL H H 62 8.073 8.576 -0.503 1
1 697 . 22 1 1 A 62 62 VAL HA H 62 3.207 3.845 -0.638 1
1 705 . 22 1 1 A 62 62 VAL C C 62 177.585 177.428 0.157 1
1 706 . 22 1 1 A 62 62 VAL CA C 62 67.345 65.438 1.907 1
1 707 . 22 1 1 A 62 62 VAL CB C 62 30.905 30.819 0.086 1
1 710 . 22 1 1 A 62 62 VAL N N 62 116.018 118.550 -2.532 1
1 711 . 22 1 1 A 63 63 ARG H H 63 7.765 8.054 -0.289 1
1 712 . 22 1 1 A 63 63 ARG HA H 63 3.602 4.014 -0.412 1
1 719 . 22 1 1 A 63 63 ARG C C 63 177.818 178.290 -0.472 1
1 720 . 22 1 1 A 63 63 ARG CA C 63 58.049 58.040 0.009 1
1 721 . 22 1 1 A 63 63 ARG CB C 63 29.955 29.200 0.755 1
1 724 . 22 1 1 A 63 63 ARG N N 63 116.700 120.368 -3.668 1
1 725 . 22 1 1 A 64 64 ALA H H 64 7.574 7.529 0.045 1
1 726 . 22 1 1 A 64 64 ALA HA H 64 4.158 4.376 -0.218 1
1 730 . 22 1 1 A 64 64 ALA C C 64 179.886 179.389 0.497 1
1 731 . 22 1 1 A 64 64 ALA CA C 64 54.007 54.044 -0.037 1
1 732 . 22 1 1 A 64 64 ALA CB C 64 19.147 19.601 -0.454 1
1 733 . 22 1 1 A 64 64 ALA N N 64 117.555 121.832 -4.277 1
1 734 . 22 1 1 A 65 65 VAL H H 65 7.554 8.163 -0.609 1
1 735 . 22 1 1 A 65 65 VAL HA H 65 4.253 3.799 0.454 1
1 743 . 22 1 1 A 65 65 VAL C C 65 174.180 175.974 -1.794 1
1 744 . 22 1 1 A 65 65 VAL CA C 65 62.683 65.446 -2.763 1
1 745 . 22 1 1 A 65 65 VAL CB C 65 33.458 31.410 2.048 1
1 748 . 22 1 1 A 65 65 VAL N N 65 110.013 115.546 -5.533 1
1 749 . 22 1 1 A 66 66 LEU H H 66 7.792 7.239 0.553 1
1 750 . 22 1 1 A 66 66 LEU HA H 66 4.790 4.771 0.019 1
1 760 . 22 1 1 A 66 66 LEU C C 66 177.537 174.848 2.689 1
1 761 . 22 1 1 A 66 66 LEU CA C 66 52.823 52.944 -0.121 1
1 762 . 22 1 1 A 66 66 LEU CB C 66 44.071 46.373 -2.302 1
1 766 . 22 1 1 A 66 66 LEU N N 66 118.967 120.256 -1.289 1
1 767 . 22 1 1 A 67 67 SER H H 67 9.208 8.510 0.698 1
1 768 . 22 1 1 A 67 67 SER HA H 67 4.414 4.789 -0.375 1
1 771 . 22 1 1 A 67 67 SER CA C 67 57.943 57.038 0.905 1
1 772 . 22 1 1 A 67 67 SER CB C 67 64.743 65.745 -1.002 1
1 773 . 22 1 1 A 67 67 SER N N 67 116.378 115.651 0.727 1
1 774 . 22 1 1 A 69 69 GLY HA2 H 69 3.916 3.805 0.111 1
1 775 . 22 1 1 A 69 69 GLY HA3 H 69 3.867 3.822 0.045 1
1 776 . 22 1 1 A 69 69 GLY C C 69 176.783 175.568 1.215 1
1 777 . 22 1 1 A 69 69 GLY CA C 69 46.977 46.439 0.538 1
1 778 . 22 1 1 A 70 70 ASP H H 70 7.674 8.211 -0.537 1
1 779 . 22 1 1 A 70 70 ASP HA H 70 4.511 3.805 0.706 1
1 782 . 22 1 1 A 70 70 ASP C C 70 178.096 178.164 -0.068 1
1 783 . 22 1 1 A 70 70 ASP CA C 70 57.262 56.493 0.769 1
1 784 . 22 1 1 A 70 70 ASP CB C 70 40.594 39.959 0.635 1
1 785 . 22 1 1 A 70 70 ASP N N 70 123.930 121.644 2.286 1
1 786 . 22 1 1 A 71 71 HIS H H 71 8.729 8.062 0.667 1
1 787 . 22 1 1 A 71 71 HIS HA H 71 4.235 4.172 0.063 1
1 790 . 22 1 1 A 71 71 HIS C C 71 176.769 177.933 -1.164 1
1 791 . 22 1 1 A 71 71 HIS CA C 71 60.041 59.032 1.009 1
1 792 . 22 1 1 A 71 71 HIS CB C 71 30.682 30.184 0.498 1
1 793 . 22 1 1 A 71 71 HIS N N 71 121.003 117.128 3.875 1
1 794 . 22 1 1 A 72 72 LEU H H 72 7.620 7.690 -0.070 1
1 795 . 22 1 1 A 72 72 LEU HA H 72 3.769 3.934 -0.165 1
1 805 . 22 1 1 A 72 72 LEU C C 72 180.275 179.026 1.249 1
1 806 . 22 1 1 A 72 72 LEU CA C 72 58.192 57.957 0.235 1
1 807 . 22 1 1 A 72 72 LEU CB C 72 41.381 41.396 -0.015 1
1 811 . 22 1 1 A 72 72 LEU N N 72 118.569 116.913 1.656 1
1 812 . 22 1 1 A 73 73 LEU H H 73 7.542 7.341 0.201 1
1 813 . 22 1 1 A 73 73 LEU HA H 73 4.107 4.217 -0.110 1
1 823 . 22 1 1 A 73 73 LEU C C 73 179.436 179.080 0.356 1
1 824 . 22 1 1 A 73 73 LEU CA C 73 58.026 57.191 0.835 1
1 825 . 22 1 1 A 73 73 LEU CB C 73 41.638 42.044 -0.406 1
1 829 . 22 1 1 A 73 73 LEU N N 73 121.418 120.046 1.372 1
1 830 . 22 1 1 A 74 74 TRP H H 74 8.786 7.959 0.827 1
1 831 . 22 1 1 A 74 74 TRP HA H 74 3.589 5.252 -1.663 1
1 840 . 22 1 1 A 74 74 TRP C C 74 176.816 178.598 -1.782 1
1 841 . 22 1 1 A 74 74 TRP CA C 74 63.046 59.928 3.118 1
1 842 . 22 1 1 A 74 74 TRP CB C 74 28.065 29.092 -1.027 1
1 848 . 22 1 1 A 74 74 TRP N N 74 121.111 118.112 2.999 1
1 850 . 22 1 1 A 75 75 LYS H H 75 8.939 7.427 1.512 1
1 851 . 22 1 1 A 75 75 LYS HA H 75 3.055 3.889 -0.834 1
1 860 . 22 1 1 A 75 75 LYS C C 75 177.967 178.675 -0.708 1
1 861 . 22 1 1 A 75 75 LYS CA C 75 60.029 58.193 1.836 1
1 862 . 22 1 1 A 75 75 LYS CB C 75 32.533 32.885 -0.352 1
1 866 . 22 1 1 A 75 75 LYS N N 75 119.783 118.483 1.300 1
1 867 . 22 1 1 A 76 76 SER H H 76 7.832 7.893 -0.061 1
1 868 . 22 1 1 A 76 76 SER HA H 76 4.040 4.085 -0.045 1
1 871 . 22 1 1 A 76 76 SER C C 76 177.816 176.943 0.873 1
1 872 . 22 1 1 A 76 76 SER CA C 76 62.105 61.347 0.758 1
1 873 . 22 1 1 A 76 76 SER CB C 76 62.679 63.173 -0.494 1
1 874 . 22 1 1 A 76 76 SER N N 76 113.395 116.901 -3.506 1
1 875 . 22 1 1 A 77 77 GLU H H 77 7.590 7.562 0.028 1
1 876 . 22 1 1 A 77 77 GLU HA H 77 4.042 4.243 -0.201 1
1 881 . 22 1 1 A 77 77 GLU C C 77 177.809 178.500 -0.691 1
1 882 . 22 1 1 A 77 77 GLU CA C 77 58.270 58.600 -0.330 1
1 883 . 22 1 1 A 77 77 GLU CB C 77 29.208 29.308 -0.100 1
1 885 . 22 1 1 A 77 77 GLU N N 77 121.574 122.429 -0.855 1
1 886 . 22 1 1 A 78 78 PHE H H 78 9.081 7.670 1.411 1
1 887 . 22 1 1 A 78 78 PHE HA H 78 3.778 4.199 -0.421 1
1 895 . 22 1 1 A 78 78 PHE C C 78 178.114 177.421 0.693 1
1 896 . 22 1 1 A 78 78 PHE CA C 78 60.629 61.414 -0.785 1
1 897 . 22 1 1 A 78 78 PHE CB C 78 38.295 38.876 -0.581 1
1 902 . 22 1 1 A 78 78 PHE N N 78 122.682 122.524 0.158 1
1 903 . 22 1 1 A 79 79 PHE H H 79 8.890 7.796 1.094 1
1 904 . 22 1 1 A 79 79 PHE HA H 79 3.800 4.105 -0.305 1
1 912 . 22 1 1 A 79 79 PHE C C 79 178.354 178.378 -0.024 1
1 913 . 22 1 1 A 79 79 PHE CA C 79 60.704 61.980 -1.276 1
1 914 . 22 1 1 A 79 79 PHE CB C 79 37.184 38.472 -1.288 1
1 920 . 22 1 1 A 79 79 PHE N N 79 121.056 118.650 2.406 1
1 921 . 22 1 1 A 80 80 GLU H H 80 7.793 8.322 -0.529 1
1 922 . 22 1 1 A 80 80 GLU HA H 80 4.082 4.048 0.034 1
1 927 . 22 1 1 A 80 80 GLU C C 80 179.068 179.367 -0.299 1
1 928 . 22 1 1 A 80 80 GLU CA C 80 59.735 59.820 -0.085 1
1 929 . 22 1 1 A 80 80 GLU CB C 80 28.722 29.305 -0.583 1
1 931 . 22 1 1 A 80 80 GLU N N 80 120.312 118.656 1.656 1
1 932 . 22 1 1 A 81 81 ASN H H 81 8.624 8.742 -0.118 1
1 933 . 22 1 1 A 81 81 ASN HA H 81 4.521 4.502 0.019 1
1 938 . 22 1 1 A 81 81 ASN C C 81 179.262 177.956 1.306 1
1 939 . 22 1 1 A 81 81 ASN CA C 81 55.504 56.373 -0.869 1
1 940 . 22 1 1 A 81 81 ASN CB C 81 37.517 37.739 -0.222 1
1 941 . 22 1 1 A 81 81 ASN N N 81 119.338 118.671 0.667 1
1 943 . 22 1 1 A 82 82 CYS H H 82 8.554 8.248 0.306 1
1 944 . 22 1 1 A 82 82 CYS HA H 82 3.792 4.017 -0.225 1
1 947 . 22 1 1 A 82 82 CYS C C 82 176.478 176.884 -0.406 1
1 948 . 22 1 1 A 82 82 CYS CA C 82 65.232 62.141 3.091 1
1 949 . 22 1 1 A 82 82 CYS CB C 82 26.762 26.823 -0.061 1
1 950 . 22 1 1 A 82 82 CYS N N 82 120.576 118.798 1.778 1
1 951 . 22 1 1 A 83 83 ARG H H 83 8.522 7.968 0.554 1
1 952 . 22 1 1 A 83 83 ARG HA H 83 3.932 4.190 -0.258 1
1 960 . 22 1 1 A 83 83 ARG C C 83 179.138 178.752 0.386 1
1 961 . 22 1 1 A 83 83 ARG CA C 83 60.443 59.093 1.350 1
1 962 . 22 1 1 A 83 83 ARG CB C 83 29.550 29.750 -0.200 1
1 965 . 22 1 1 A 83 83 ARG N N 83 123.035 120.549 2.486 1
1 967 . 22 1 1 A 84 84 ASP H H 84 7.791 8.384 -0.593 1
1 968 . 22 1 1 A 84 84 ASP HA H 84 4.353 4.423 -0.070 1
1 971 . 22 1 1 A 84 84 ASP C C 84 178.649 178.297 0.352 1
1 972 . 22 1 1 A 84 84 ASP CA C 84 57.767 57.603 0.164 1
1 973 . 22 1 1 A 84 84 ASP CB C 84 41.305 41.623 -0.318 1
1 974 . 22 1 1 A 84 84 ASP N N 84 120.332 119.661 0.671 1
1 975 . 22 1 1 A 85 85 THR H H 85 8.370 7.890 0.480 1
1 976 . 22 1 1 A 85 85 THR HA H 85 3.730 3.951 -0.221 1
1 981 . 22 1 1 A 85 85 THR C C 85 175.198 177.073 -1.875 1
1 982 . 22 1 1 A 85 85 THR CA C 85 66.830 65.371 1.459 1
1 983 . 22 1 1 A 85 85 THR CB C 85 68.533 68.841 -0.308 1
1 985 . 22 1 1 A 85 85 THR N N 85 117.360 113.494 3.866 1
1 986 . 22 1 1 A 86 86 ALA H H 86 8.845 8.332 0.513 1
1 987 . 22 1 1 A 86 86 ALA HA H 86 3.991 4.086 -0.095 1
1 991 . 22 1 1 A 86 86 ALA C C 86 179.980 179.490 0.490 1
1 992 . 22 1 1 A 86 86 ALA CA C 86 55.769 55.691 0.078 1
1 993 . 22 1 1 A 86 86 ALA CB C 86 17.881 18.771 -0.890 1
1 994 . 22 1 1 A 86 86 ALA N N 86 123.613 123.287 0.326 1
1 995 . 22 1 1 A 87 87 LYS H H 87 7.686 8.087 -0.401 1
1 996 . 22 1 1 A 87 87 LYS HA H 87 4.099 4.075 0.024 1
1 1005 . 22 1 1 A 87 87 LYS C C 87 179.592 178.341 1.251 1
1 1006 . 22 1 1 A 87 87 LYS CA C 87 59.708 59.191 0.517 1
1 1007 . 22 1 1 A 87 87 LYS CB C 87 32.054 31.929 0.125 1
1 1011 . 22 1 1 A 87 87 LYS N N 87 119.623 116.290 3.333 1
1 1012 . 22 1 1 A 88 88 ARG H H 88 7.683 7.589 0.094 1
1 1013 . 22 1 1 A 88 88 ARG HA H 88 4.051 4.171 -0.120 1
1 1020 . 22 1 1 A 88 88 ARG C C 88 180.053 178.379 1.674 1
1 1021 . 22 1 1 A 88 88 ARG CA C 88 59.558 58.654 0.904 1
1 1022 . 22 1 1 A 88 88 ARG CB C 88 29.684 30.006 -0.322 1
1 1025 . 22 1 1 A 88 88 ARG N N 88 120.788 119.168 1.620 1
1 1026 . 22 1 1 A 89 89 ASN H H 89 8.973 7.956 1.017 1
1 1027 . 22 1 1 A 89 89 ASN HA H 89 4.354 4.566 -0.212 1
1 1032 . 22 1 1 A 89 89 ASN C C 89 178.382 177.810 0.572 1
1 1033 . 22 1 1 A 89 89 ASN CA C 89 55.334 56.182 -0.848 1
1 1034 . 22 1 1 A 89 89 ASN CB C 89 37.864 38.418 -0.554 1
1 1035 . 22 1 1 A 89 89 ASN N N 89 121.012 118.056 2.956 1
1 1037 . 22 1 1 A 90 90 GLN H H 90 8.152 8.311 -0.159 1
1 1038 . 22 1 1 A 90 90 GLN HA H 90 4.020 4.090 -0.070 1
1 1045 . 22 1 1 A 90 90 GLN C C 90 179.075 179.020 0.055 1
1 1046 . 22 1 1 A 90 90 GLN CA C 90 59.318 58.950 0.368 1
1 1047 . 22 1 1 A 90 90 GLN CB C 90 28.049 28.329 -0.280 1
1 1049 . 22 1 1 A 90 90 GLN N N 90 122.122 118.501 3.621 1
1 1051 . 22 1 1 A 91 91 GLN H H 91 7.514 8.428 -0.914 1
1 1052 . 22 1 1 A 91 91 GLN HA H 91 4.053 4.101 -0.048 1
1 1059 . 22 1 1 A 91 91 GLN C C 91 177.081 177.556 -0.475 1
1 1060 . 22 1 1 A 91 91 GLN CA C 91 58.031 58.340 -0.309 1
1 1061 . 22 1 1 A 91 91 GLN CB C 91 28.365 27.449 0.916 1
1 1063 . 22 1 1 A 91 91 GLN N N 91 118.124 118.018 0.106 1
1 1065 . 22 1 1 A 92 92 ALA H H 92 7.704 7.759 -0.055 1
1 1066 . 22 1 1 A 92 92 ALA HA H 92 4.246 4.339 -0.093 1
1 1070 . 22 1 1 A 92 92 ALA C C 92 178.450 177.880 0.570 1
1 1071 . 22 1 1 A 92 92 ALA CA C 92 52.671 52.428 0.243 1
1 1072 . 22 1 1 A 92 92 ALA CB C 92 19.316 19.860 -0.544 1
1 1073 . 22 1 1 A 92 92 ALA N N 92 119.880 120.948 -1.068 1
1 1074 . 22 1 1 A 93 93 GLY H H 93 7.693 7.917 -0.224 1
1 1075 . 22 1 1 A 93 93 GLY HA2 H 93 3.941 3.874 0.067 1
1 1076 . 22 1 1 A 93 93 GLY HA3 H 93 3.744 3.879 -0.135 1
1 1077 . 22 1 1 A 93 93 GLY C C 93 174.344 175.210 -0.866 1
1 1078 . 22 1 1 A 93 93 GLY CA C 93 45.949 46.629 -0.680 1
1 1079 . 22 1 1 A 93 93 GLY N N 93 105.347 106.879 -1.532 1
1 1080 . 22 1 1 A 94 94 ASN H H 94 7.076 8.305 -1.229 1
1 1081 . 22 1 1 A 94 94 ASN HA H 94 4.115 4.639 -0.524 1
1 1085 . 22 1 1 A 94 94 ASN C C 94 175.410 175.262 0.148 1
1 1086 . 22 1 1 A 94 94 ASN CA C 94 52.651 52.991 -0.340 1
1 1087 . 22 1 1 A 94 94 ASN CB C 94 38.330 39.550 -1.220 1
1 1088 . 22 1 1 A 94 94 ASN N N 94 115.747 116.513 -0.766 1
1 1090 . 22 1 1 A 95 95 GLY H H 95 8.236 8.375 -0.139 1
1 1091 . 22 1 1 A 95 95 GLY HA2 H 95 3.633 3.444 0.189 1
1 1092 . 22 1 1 A 95 95 GLY HA3 H 95 3.633 3.605 0.028 1
1 1093 . 22 1 1 A 95 95 GLY C C 95 174.450 173.242 1.208 1
1 1094 . 22 1 1 A 95 95 GLY CA C 95 45.522 45.226 0.296 1
1 1095 . 22 1 1 A 95 95 GLY N N 95 109.166 106.483 2.683 1
1 1096 . 22 1 1 A 96 96 TRP H H 96 7.899 7.947 -0.048 1
1 1097 . 22 1 1 A 96 96 TRP HA H 96 5.241 5.226 0.015 1
1 1106 . 22 1 1 A 96 96 TRP C C 96 175.661 175.945 -0.284 1
1 1107 . 22 1 1 A 96 96 TRP CA C 96 55.090 55.981 -0.891 1
1 1108 . 22 1 1 A 96 96 TRP CB C 96 27.138 32.440 -5.302 1
1 1114 . 22 1 1 A 96 96 TRP N N 96 122.840 120.178 2.662 1
1 1116 . 22 1 1 A 97 97 ASP H H 97 7.344 9.302 -1.958 1
1 1117 . 22 1 1 A 97 97 ASP HA H 97 4.829 4.506 0.323 1
1 1120 . 22 1 1 A 97 97 ASP C C 97 175.019 176.563 -1.544 1
1 1121 . 22 1 1 A 97 97 ASP CA C 97 52.149 56.538 -4.389 1
1 1122 . 22 1 1 A 97 97 ASP CB C 97 42.697 39.518 3.179 1
1 1123 . 22 1 1 A 97 97 ASP N N 97 126.861 117.107 9.754 1
1 1124 . 22 1 1 A 98 98 PHE H H 98 8.566 8.489 0.077 1
1 1125 . 22 1 1 A 98 98 PHE HA H 98 3.727 4.066 -0.339 1
1 1133 . 22 1 1 A 98 98 PHE C C 98 177.443 177.401 0.042 1
1 1134 . 22 1 1 A 98 98 PHE CA C 98 62.471 62.205 0.266 1
1 1135 . 22 1 1 A 98 98 PHE CB C 98 39.919 39.195 0.724 1
1 1141 . 22 1 1 A 98 98 PHE N N 98 117.781 120.011 -2.230 1
1 1142 . 22 1 1 A 99 99 ASP H H 99 8.259 8.469 -0.210 1
1 1143 . 22 1 1 A 99 99 ASP HA H 99 3.960 4.272 -0.312 1
1 1146 . 22 1 1 A 99 99 ASP C C 99 178.132 178.357 -0.225 1
1 1147 . 22 1 1 A 99 99 ASP CA C 99 57.658 56.423 1.235 1
1 1148 . 22 1 1 A 99 99 ASP CB C 99 38.572 40.910 -2.338 1
1 1149 . 22 1 1 A 99 99 ASP N N 99 121.709 119.451 2.258 1
1 1150 . 22 1 1 A 100 100 MET H H 100 8.008 8.341 -0.333 1
1 1151 . 22 1 1 A 100 100 MET HA H 100 3.644 4.298 -0.654 1
1 1156 . 22 1 1 A 100 100 MET C C 100 180.008 176.759 3.249 1
1 1157 . 22 1 1 A 100 100 MET CA C 100 58.598 58.660 -0.062 1
1 1158 . 22 1 1 A 100 100 MET CB C 100 33.423 32.764 0.659 1
1 1160 . 22 1 1 A 100 100 MET N N 100 119.668 118.590 1.078 1
1 1161 . 22 1 1 A 101 101 LEU H H 101 7.961 8.817 -0.856 1
1 1162 . 22 1 1 A 101 101 LEU HA H 101 3.523 4.578 -1.055 1
1 1172 . 22 1 1 A 101 101 LEU C C 101 173.873 177.145 -3.272 1
1 1173 . 22 1 1 A 101 101 LEU CA C 101 58.743 53.851 4.892 1
1 1174 . 22 1 1 A 101 101 LEU CB C 101 42.632 43.395 -0.763 1
1 1178 . 22 1 1 A 101 101 LEU N N 101 119.752 119.658 0.094 1
1 1179 . 22 1 1 A 102 102 THR H H 102 6.955 8.812 -1.857 1
1 1180 . 22 1 1 A 102 102 THR HA H 102 4.134 4.096 0.038 1
1 1185 . 22 1 1 A 102 102 THR C C 102 176.513 175.360 1.153 1
1 1186 . 22 1 1 A 102 102 THR CA C 102 61.125 65.304 -4.179 1
1 1187 . 22 1 1 A 102 102 THR CB C 102 71.415 66.676 4.739 1
1 1189 . 22 1 1 A 102 102 THR N N 102 124.665 117.668 6.997 1
1 1190 . 22 1 1 A 103 103 GLY H H 103 7.816 7.824 -0.008 1
1 1191 . 22 1 1 A 103 103 GLY HA2 H 103 3.824 3.484 0.340 1
1 1192 . 22 1 1 A 103 103 GLY HA3 H 103 3.824 3.569 0.255 1
1 1193 . 22 1 1 A 103 103 GLY C C 103 174.126 175.056 -0.930 1
1 1194 . 22 1 1 A 103 103 GLY CA C 103 47.805 47.094 0.711 1
1 1195 . 22 1 1 A 103 103 GLY N N 103 114.191 108.435 5.756 1
1 1196 . 22 1 1 A 104 104 SER H H 104 8.860 8.987 -0.127 1
1 1197 . 22 1 1 A 104 104 SER HA H 104 4.758 4.500 0.258 1
1 1200 . 22 1 1 A 104 104 SER C C 104 174.591 174.518 0.073 1
1 1201 . 22 1 1 A 104 104 SER CA C 104 56.755 59.224 -2.469 1
1 1202 . 22 1 1 A 104 104 SER CB C 104 65.050 62.275 2.775 1
1 1203 . 22 1 1 A 104 104 SER N N 104 114.771 114.854 -0.083 1
1 1204 . 22 1 1 A 105 105 GLY H H 105 8.788 8.517 0.271 1
1 1205 . 22 1 1 A 105 105 GLY HA2 H 105 3.733 4.029 -0.296 1
1 1206 . 22 1 1 A 105 105 GLY HA3 H 105 3.733 4.051 -0.318 1
1 1207 . 22 1 1 A 105 105 GLY CA C 105 47.247 46.163 1.084 1
1 1208 . 22 1 1 A 105 105 GLY N N 105 110.394 109.274 1.120 1
1 1209 . 22 1 1 A 106 106 ASN HA H 106 4.454 4.465 -0.011 1
1 1212 . 22 1 1 A 106 106 ASN C C 106 175.180 175.986 -0.806 1
1 1213 . 22 1 1 A 106 106 ASN CA C 106 54.492 55.503 -1.011 1
1 1214 . 22 1 1 A 106 106 ASN CB C 106 37.282 38.906 -1.624 1
1 1215 . 22 1 1 A 107 107 TYR H H 107 8.241 7.775 0.466 1
1 1216 . 22 1 1 A 107 107 TYR HA H 107 4.335 4.916 -0.581 1
1 1223 . 22 1 1 A 107 107 TYR C C 107 173.954 176.433 -2.479 1
1 1224 . 22 1 1 A 107 107 TYR CA C 107 57.727 57.151 0.576 1
1 1225 . 22 1 1 A 107 107 TYR CB C 107 37.063 39.618 -2.555 1
1 1230 . 22 1 1 A 107 107 TYR N N 107 120.708 114.158 6.550 1
1 1231 . 22 1 1 A 108 108 SER H H 108 7.117 7.441 -0.324 1
1 1232 . 22 1 1 A 108 108 SER HA H 108 4.221 4.815 -0.594 1
1 1235 . 22 1 1 A 108 108 SER C C 108 174.834 174.233 0.601 1
1 1236 . 22 1 1 A 108 108 SER CA C 108 59.859 58.770 1.089 1
1 1237 . 22 1 1 A 108 108 SER CB C 108 63.846 64.490 -0.644 1
1 1238 . 22 1 1 A 108 108 SER N N 108 113.362 112.781 0.581 1
1 1239 . 22 1 1 A 109 109 SER H H 109 8.053 7.932 0.121 1
1 1240 . 22 1 1 A 109 109 SER HA H 109 4.560 4.248 0.312 1
1 1243 . 22 1 1 A 109 109 SER CA C 109 57.141 60.862 -3.721 1
1 1244 . 22 1 1 A 109 109 SER CB C 109 64.874 61.883 2.991 1
1 1245 . 22 1 1 A 109 109 SER N N 109 116.657 113.327 3.330 1
1 1246 . 22 1 1 A 110 110 THR HA H 110 3.541 4.077 -0.536 1
1 1251 . 22 1 1 A 110 110 THR C C 110 175.477 176.214 -0.737 1
1 1252 . 22 1 1 A 110 110 THR CA C 110 66.443 65.685 0.758 1
1 1253 . 22 1 1 A 110 110 THR CB C 110 68.091 68.616 -0.525 1
1 1255 . 22 1 1 A 111 111 ASP H H 111 8.224 8.056 0.168 1
1 1256 . 22 1 1 A 111 111 ASP HA H 111 4.237 4.354 -0.117 1
1 1259 . 22 1 1 A 111 111 ASP C C 111 177.520 178.193 -0.673 1
1 1260 . 22 1 1 A 111 111 ASP CA C 111 57.559 56.859 0.700 1
1 1261 . 22 1 1 A 111 111 ASP CB C 111 40.292 40.946 -0.654 1
1 1262 . 22 1 1 A 111 111 ASP N N 111 119.490 121.933 -2.443 1
1 1263 . 22 1 1 A 112 112 ALA H H 112 7.431 8.351 -0.920 1
1 1264 . 22 1 1 A 112 112 ALA HA H 112 4.191 4.062 0.129 1
1 1268 . 22 1 1 A 112 112 ALA C C 112 180.646 179.486 1.160 1
1 1269 . 22 1 1 A 112 112 ALA CA C 112 54.534 54.307 0.227 1
1 1270 . 22 1 1 A 112 112 ALA CB C 112 18.992 18.290 0.702 1
1 1271 . 22 1 1 A 112 112 ALA N N 112 119.710 121.632 -1.922 1
1 1272 . 22 1 1 A 113 113 GLN H H 113 7.576 8.153 -0.577 1
1 1273 . 22 1 1 A 113 113 GLN HA H 113 3.562 4.206 -0.644 1
1 1278 . 22 1 1 A 113 113 GLN C C 113 176.756 178.468 -1.712 1
1 1279 . 22 1 1 A 113 113 GLN CA C 113 57.736 58.227 -0.491 1
1 1280 . 22 1 1 A 113 113 GLN CB C 113 29.110 28.653 0.457 1
1 1281 . 22 1 1 A 113 113 GLN N N 113 117.518 116.026 1.492 1
1 1283 . 22 1 1 A 114 114 MET H H 114 8.192 7.812 0.380 1
1 1284 . 22 1 1 A 114 114 MET HA H 114 4.231 3.848 0.383 1
1 1289 . 22 1 1 A 114 114 MET C C 114 175.648 177.101 -1.453 1
1 1290 . 22 1 1 A 114 114 MET CA C 114 57.446 57.831 -0.385 1
1 1291 . 22 1 1 A 114 114 MET CB C 114 33.570 32.289 1.281 1
1 1293 . 22 1 1 A 114 114 MET N N 114 111.509 119.737 -8.228 1
1 1294 . 22 1 1 A 115 115 GLN H H 115 6.940 7.579 -0.639 1
1 1295 . 22 1 1 A 115 115 GLN HA H 115 4.307 4.367 -0.060 1
1 1302 . 22 1 1 A 115 115 GLN C C 115 176.270 174.771 1.499 1
1 1303 . 22 1 1 A 115 115 GLN CA C 115 54.680 55.159 -0.479 1
1 1304 . 22 1 1 A 115 115 GLN CB C 115 28.233 28.632 -0.399 1
1 1306 . 22 1 1 A 115 115 GLN N N 115 114.300 115.809 -1.509 1
1 1308 . 22 1 1 A 116 116 TYR H H 116 6.677 7.274 -0.597 1
1 1309 . 22 1 1 A 116 116 TYR HA H 116 4.193 4.487 -0.294 1
1 1312 . 22 1 1 A 116 116 TYR C C 116 175.268 175.297 -0.029 1
1 1313 . 22 1 1 A 116 116 TYR CA C 116 54.357 57.808 -3.451 1
1 1314 . 22 1 1 A 116 116 TYR CB C 116 35.498 39.167 -3.669 1
1 1315 . 22 1 1 A 116 116 TYR N N 116 117.919 118.934 -1.015 1
1 1316 . 22 1 1 A 117 117 ASP H H 117 8.081 8.868 -0.787 1
1 1317 . 22 1 1 A 117 117 ASP HA H 117 4.665 4.743 -0.078 1
1 1320 . 22 1 1 A 117 117 ASP CA C 117 52.422 52.973 -0.551 1
1 1321 . 22 1 1 A 117 117 ASP CB C 117 42.416 40.119 2.297 1
1 1322 . 22 1 1 A 117 117 ASP N N 117 120.887 122.506 -1.619 1
1 1323 . 22 1 1 A 118 118 PRO C C 118 179.180 178.300 0.880 1
1 1324 . 22 1 1 A 118 118 PRO CA C 118 65.942 64.578 1.364 1
1 1325 . 22 1 1 A 118 118 PRO CB C 118 32.197 31.759 0.438 1
1 1326 . 22 1 1 A 119 119 GLY H H 119 9.742 8.025 1.717 1
1 1327 . 22 1 1 A 119 119 GLY C C 119 175.622 175.325 0.297 1
1 1328 . 22 1 1 A 119 119 GLY CA C 119 46.785 46.504 0.281 1
1 1329 . 22 1 1 A 119 119 GLY N N 119 106.412 106.405 0.007 1
1 1330 . 22 1 1 A 120 120 LEU H H 120 6.666 7.567 -0.901 1
1 1331 . 22 1 1 A 120 120 LEU HA H 120 3.365 3.919 -0.554 1
1 1341 . 22 1 1 A 120 120 LEU C C 120 179.262 178.543 0.719 1
1 1342 . 22 1 1 A 120 120 LEU CA C 120 56.605 56.884 -0.279 1
1 1343 . 22 1 1 A 120 120 LEU CB C 120 39.262 41.451 -2.189 1
1 1347 . 22 1 1 A 120 120 LEU N N 120 126.226 122.464 3.762 1
1 1348 . 22 1 1 A 121 121 PHE H H 121 7.356 8.462 -1.106 1
1 1349 . 22 1 1 A 121 121 PHE HA H 121 4.459 3.641 0.818 1
1 1352 . 22 1 1 A 121 121 PHE C C 121 179.716 177.992 1.724 1
1 1353 . 22 1 1 A 121 121 PHE CA C 121 62.838 61.778 1.060 1
1 1354 . 22 1 1 A 121 121 PHE CB C 121 37.603 38.859 -1.256 1
1 1355 . 22 1 1 A 121 121 PHE N N 121 117.437 118.993 -1.556 1
1 1356 . 22 1 1 A 122 122 ALA H H 122 7.926 7.976 -0.050 1
1 1357 . 22 1 1 A 122 122 ALA HA H 122 4.523 3.814 0.709 1
1 1361 . 22 1 1 A 122 122 ALA C C 122 180.435 179.576 0.859 1
1 1362 . 22 1 1 A 122 122 ALA CA C 122 55.527 55.171 0.356 1
1 1363 . 22 1 1 A 122 122 ALA CB C 122 17.814 18.129 -0.315 1
1 1364 . 22 1 1 A 122 122 ALA N N 122 121.068 121.139 -0.071 1
1 1365 . 22 1 1 A 123 123 GLN H H 123 7.507 7.872 -0.365 1
1 1366 . 22 1 1 A 123 123 GLN HA H 123 4.153 3.933 0.220 1
1 1371 . 22 1 1 A 123 123 GLN C C 123 180.561 178.642 1.919 1
1 1372 . 22 1 1 A 123 123 GLN CA C 123 59.948 59.070 0.878 1
1 1373 . 22 1 1 A 123 123 GLN CB C 123 29.135 28.309 0.826 1
1 1375 . 22 1 1 A 123 123 GLN N N 123 120.324 118.377 1.947 1
1 1376 . 22 1 1 A 124 124 ILE H H 124 8.318 8.013 0.305 1
1 1377 . 22 1 1 A 124 124 ILE HA H 124 3.635 3.858 -0.223 1
1 1387 . 22 1 1 A 124 124 ILE C C 124 176.481 178.086 -1.605 1
1 1388 . 22 1 1 A 124 124 ILE CA C 124 66.432 64.344 2.088 1
1 1389 . 22 1 1 A 124 124 ILE CB C 124 39.168 37.994 1.174 1
1 1393 . 22 1 1 A 124 124 ILE N N 124 123.747 118.339 5.408 1
1 1394 . 22 1 1 A 125 125 GLN H H 125 8.474 8.127 0.347 1
1 1395 . 22 1 1 A 125 125 GLN HA H 125 4.264 3.886 0.378 1
1 1402 . 22 1 1 A 125 125 GLN C C 125 178.947 177.665 1.282 1
1 1403 . 22 1 1 A 125 125 GLN CA C 125 59.651 58.594 1.057 1
1 1404 . 22 1 1 A 125 125 GLN CB C 125 28.880 28.585 0.295 1
1 1406 . 22 1 1 A 125 125 GLN N N 125 120.368 121.321 -0.953 1
1 1408 . 22 1 1 A 126 126 ALA H H 126 8.002 7.694 0.308 1
1 1409 . 22 1 1 A 126 126 ALA HA H 126 4.144 3.998 0.146 1
1 1413 . 22 1 1 A 126 126 ALA C C 126 179.316 179.587 -0.271 1
1 1414 . 22 1 1 A 126 126 ALA CA C 126 55.036 55.039 -0.003 1
1 1415 . 22 1 1 A 126 126 ALA CB C 126 18.087 18.294 -0.207 1
1 1416 . 22 1 1 A 126 126 ALA N N 126 121.661 121.139 0.522 1
1 1417 . 22 1 1 A 127 127 ALA H H 127 7.823 8.207 -0.384 1
1 1418 . 22 1 1 A 127 127 ALA HA H 127 4.162 3.923 0.239 1
1 1422 . 22 1 1 A 127 127 ALA C C 127 180.707 179.457 1.250 1
1 1423 . 22 1 1 A 127 127 ALA CA C 127 55.080 54.925 0.155 1
1 1424 . 22 1 1 A 127 127 ALA CB C 127 19.354 18.112 1.242 1
1 1425 . 22 1 1 A 127 127 ALA N N 127 119.853 119.829 0.024 1
1 1426 . 22 1 1 A 128 128 ALA H H 128 8.936 7.988 0.948 1
1 1427 . 22 1 1 A 128 128 ALA HA H 128 3.928 3.938 -0.010 1
1 1431 . 22 1 1 A 128 128 ALA C C 128 181.031 178.876 2.155 1
1 1432 . 22 1 1 A 128 128 ALA CA C 128 55.502 54.658 0.844 1
1 1433 . 22 1 1 A 128 128 ALA CB C 128 16.609 17.546 -0.937 1
1 1434 . 22 1 1 A 128 128 ALA N N 128 121.355 119.997 1.358 1
1 1435 . 22 1 1 A 129 129 THR H H 129 8.543 7.269 1.274 1
1 1436 . 22 1 1 A 129 129 THR HA H 129 4.015 3.644 0.371 1
1 1441 . 22 1 1 A 129 129 THR C C 129 177.332 176.346 0.986 1
1 1442 . 22 1 1 A 129 129 THR CA C 129 65.893 64.975 0.918 1
1 1443 . 22 1 1 A 129 129 THR CB C 129 68.566 68.553 0.013 1
1 1445 . 22 1 1 A 129 129 THR N N 129 112.709 111.715 0.994 1
1 1446 . 22 1 1 A 130 130 LYS H H 130 8.126 7.537 0.589 1
1 1447 . 22 1 1 A 130 130 LYS HA H 130 4.000 4.087 -0.087 1
1 1456 . 22 1 1 A 130 130 LYS C C 130 179.082 178.420 0.662 1
1 1457 . 22 1 1 A 130 130 LYS CA C 130 60.299 58.806 1.493 1
1 1458 . 22 1 1 A 130 130 LYS CB C 130 32.767 31.970 0.797 1
1 1462 . 22 1 1 A 130 130 LYS N N 130 123.879 121.134 2.745 1
1 1463 . 22 1 1 A 131 131 ALA H H 131 7.184 7.709 -0.525 1
1 1464 . 22 1 1 A 131 131 ALA HA H 131 4.005 4.241 -0.236 1
1 1468 . 22 1 1 A 131 131 ALA C C 131 178.482 179.565 -1.083 1
1 1469 . 22 1 1 A 131 131 ALA CA C 131 55.027 55.095 -0.068 1
1 1470 . 22 1 1 A 131 131 ALA CB C 131 18.669 19.602 -0.933 1
1 1471 . 22 1 1 A 131 131 ALA N N 131 118.590 121.786 -3.196 1
1 1472 . 22 1 1 A 132 132 TRP H H 132 7.977 8.605 -0.628 1
1 1473 . 22 1 1 A 132 132 TRP HA H 132 4.001 4.347 -0.346 1
1 1480 . 22 1 1 A 132 132 TRP C C 132 177.332 175.758 1.574 1
1 1481 . 22 1 1 A 132 132 TRP CA C 132 60.431 57.461 2.970 1
1 1482 . 22 1 1 A 132 132 TRP CB C 132 27.786 27.644 0.142 1
1 1486 . 22 1 1 A 132 132 TRP N N 132 119.168 117.042 2.126 1
1 1488 . 22 1 1 A 133 133 ARG H H 133 8.006 8.085 -0.079 1
1 1489 . 22 1 1 A 133 133 ARG HA H 133 4.027 4.353 -0.326 1
1 1497 . 22 1 1 A 133 133 ARG C C 133 176.664 177.951 -1.287 1
1 1498 . 22 1 1 A 133 133 ARG CA C 133 59.355 57.256 2.099 1
1 1499 . 22 1 1 A 133 133 ARG CB C 133 30.451 32.263 -1.812 1
1 1502 . 22 1 1 A 133 133 ARG N N 133 113.062 120.688 -7.626 1
1 1504 . 22 1 1 A 134 134 LYS H H 134 7.322 7.537 -0.215 1
1 1505 . 22 1 1 A 134 134 LYS HA H 134 4.313 4.369 -0.056 1
1 1514 . 22 1 1 A 134 134 LYS C C 134 176.282 175.923 0.359 1
1 1515 . 22 1 1 A 134 134 LYS CA C 134 54.922 56.673 -1.751 1
1 1516 . 22 1 1 A 134 134 LYS CB C 134 32.633 32.728 -0.095 1
1 1520 . 22 1 1 A 134 134 LYS N N 134 118.170 117.673 0.497 1
1 1521 . 22 1 1 A 135 135 LEU H H 135 7.440 7.062 0.378 1
1 1522 . 22 1 1 A 135 135 LEU HA H 135 4.174 4.835 -0.661 1
1 1532 . 22 1 1 A 135 135 LEU CA C 135 54.408 51.537 2.871 1
1 1533 . 22 1 1 A 135 135 LEU CB C 135 40.407 42.870 -2.463 1
1 1537 . 22 1 1 A 135 135 LEU N N 135 123.358 116.673 6.685 1
1 1538 . 22 1 1 A 136 136 PRO HA H 136 4.437 4.495 -0.058 1
1 1545 . 22 1 1 A 136 136 PRO C C 136 177.106 175.935 1.171 1
1 1546 . 22 1 1 A 136 136 PRO CA C 136 62.889 62.748 0.141 1
1 1547 . 22 1 1 A 136 136 PRO CB C 136 32.192 32.305 -0.113 1
1 1550 . 22 1 1 A 137 137 VAL H H 137 8.219 8.281 -0.062 1
1 1551 . 22 1 1 A 137 137 VAL HA H 137 4.077 4.859 -0.782 1
1 1559 . 22 1 1 A 137 137 VAL C C 137 176.305 176.101 0.204 1
1 1560 . 22 1 1 A 137 137 VAL CA C 137 61.958 62.536 -0.578 1
1 1561 . 22 1 1 A 137 137 VAL CB C 137 32.755 33.016 -0.261 1
1 1564 . 22 1 1 A 137 137 VAL N N 137 120.079 119.524 0.555 1
1 1565 . 22 1 1 A 138 138 LYS H H 138 8.444 7.986 0.458 1
1 1566 . 22 1 1 A 138 138 LYS HA H 138 4.316 4.737 -0.421 1
1 1575 . 22 1 1 A 138 138 LYS C C 138 176.790 175.908 0.882 1
1 1576 . 22 1 1 A 138 138 LYS CA C 138 56.792 55.462 1.330 1
1 1577 . 22 1 1 A 138 138 LYS CB C 138 33.205 34.995 -1.790 1
1 1581 . 22 1 1 A 138 138 LYS N N 138 126.449 119.592 6.857 1
1 1582 . 22 1 1 A 139 139 GLY H H 139 8.518 8.497 0.021 1
1 1583 . 22 1 1 A 139 139 GLY HA2 H 139 4.070 3.980 0.090 1
1 1584 . 22 1 1 A 139 139 GLY HA3 H 139 3.897 3.986 -0.089 1
1 1585 . 22 1 1 A 139 139 GLY C C 139 172.874 172.995 -0.121 1
1 1586 . 22 1 1 A 139 139 GLY CA C 139 45.157 45.357 -0.200 1
1 1587 . 22 1 1 A 139 139 GLY N N 139 112.617 114.101 -1.484 1
1 6 . 23 1 1 A 2 2 VAL H H 2 8.992 9.373 -0.381 1
1 7 . 23 1 1 A 2 2 VAL HA H 2 5.370 4.468 0.902 1
1 15 . 23 1 1 A 2 2 VAL C C 2 174.325 175.354 -1.029 1
1 16 . 23 1 1 A 2 2 VAL CA C 2 61.267 62.745 -1.478 1
1 17 . 23 1 1 A 2 2 VAL CB C 2 33.890 32.276 1.614 1
1 20 . 23 1 1 A 2 2 VAL N N 2 126.939 121.111 5.828 1
1 21 . 23 1 1 A 3 3 THR H H 3 8.912 8.677 0.235 1
1 22 . 23 1 1 A 3 3 THR HA H 3 4.505 5.108 -0.603 1
1 27 . 23 1 1 A 3 3 THR C C 3 172.710 172.493 0.217 1
1 28 . 23 1 1 A 3 3 THR CA C 3 59.689 61.156 -1.467 1
1 29 . 23 1 1 A 3 3 THR CB C 3 72.398 71.603 0.795 1
1 31 . 23 1 1 A 3 3 THR N N 3 118.091 121.713 -3.622 1
1 32 . 23 1 1 A 4 4 GLU H H 4 8.631 9.404 -0.773 1
1 33 . 23 1 1 A 4 4 GLU HA H 4 5.788 5.013 0.775 1
1 38 . 23 1 1 A 4 4 GLU C C 4 175.758 173.989 1.769 1
1 39 . 23 1 1 A 4 4 GLU CA C 4 54.902 54.723 0.179 1
1 40 . 23 1 1 A 4 4 GLU CB C 4 35.097 33.607 1.490 1
1 42 . 23 1 1 A 4 4 GLU N N 4 120.966 126.129 -5.163 1
1 43 . 23 1 1 A 5 5 THR H H 5 9.188 8.526 0.662 1
1 44 . 23 1 1 A 5 5 THR HA H 5 4.739 5.027 -0.288 1
1 49 . 23 1 1 A 5 5 THR C C 5 172.757 172.686 0.071 1
1 50 . 23 1 1 A 5 5 THR CA C 5 60.382 59.841 0.541 1
1 51 . 23 1 1 A 5 5 THR CB C 5 71.558 71.470 0.088 1
1 53 . 23 1 1 A 5 5 THR N N 5 119.366 114.916 4.450 1
1 54 . 23 1 1 A 6 6 VAL H H 6 8.476 8.981 -0.505 1
1 55 . 23 1 1 A 6 6 VAL HA H 6 5.026 5.651 -0.625 1
1 63 . 23 1 1 A 6 6 VAL C C 6 176.674 173.910 2.764 1
1 64 . 23 1 1 A 6 6 VAL CA C 6 61.008 59.815 1.193 1
1 65 . 23 1 1 A 6 6 VAL CB C 6 33.861 35.569 -1.708 1
1 68 . 23 1 1 A 6 6 VAL N N 6 121.384 118.435 2.949 1
1 69 . 23 1 1 A 7 7 ASP H H 7 8.848 8.979 -0.131 1
1 70 . 23 1 1 A 7 7 ASP HA H 7 4.797 5.093 -0.296 1
1 73 . 23 1 1 A 7 7 ASP CA C 7 52.834 54.415 -1.581 1
1 74 . 23 1 1 A 7 7 ASP CB C 7 42.219 42.465 -0.246 1
1 75 . 23 1 1 A 7 7 ASP N N 7 127.061 126.198 0.863 1
1 76 . 23 1 1 A 8 8 GLY C C 8 175.143 175.183 -0.040 1
1 77 . 23 1 1 A 8 8 GLY CA C 8 46.553 46.866 -0.313 1
1 78 . 23 1 1 A 9 9 GLN H H 9 8.408 7.860 0.548 1
1 79 . 23 1 1 A 9 9 GLN HA H 9 4.541 4.220 0.321 1
1 86 . 23 1 1 A 9 9 GLN C C 9 176.463 176.341 0.122 1
1 87 . 23 1 1 A 9 9 GLN CA C 9 55.167 55.337 -0.170 1
1 88 . 23 1 1 A 9 9 GLN CB C 9 29.376 27.835 1.541 1
1 90 . 23 1 1 A 9 9 GLN N N 9 118.300 117.071 1.229 1
1 92 . 23 1 1 A 10 10 GLY H H 10 8.162 8.668 -0.506 1
1 93 . 23 1 1 A 10 10 GLY HA2 H 10 4.174 3.907 0.267 1
1 94 . 23 1 1 A 10 10 GLY HA3 H 10 3.521 3.928 -0.407 1
1 95 . 23 1 1 A 10 10 GLY C C 10 174.092 173.873 0.219 1
1 96 . 23 1 1 A 10 10 GLY CA C 10 45.558 46.270 -0.712 1
1 97 . 23 1 1 A 10 10 GLY N N 10 108.747 110.523 -1.776 1
1 98 . 23 1 1 A 11 11 GLN H H 11 8.507 7.201 1.306 1
1 99 . 23 1 1 A 11 11 GLN HA H 11 4.202 4.894 -0.692 1
1 106 . 23 1 1 A 11 11 GLN C C 11 173.992 174.296 -0.304 1
1 107 . 23 1 1 A 11 11 GLN CA C 11 55.098 53.747 1.351 1
1 108 . 23 1 1 A 11 11 GLN CB C 11 29.097 31.917 -2.820 1
1 110 . 23 1 1 A 11 11 GLN N N 11 122.979 115.851 7.128 1
1 112 . 23 1 1 A 12 12 ALA H H 12 8.259 8.822 -0.563 1
1 113 . 23 1 1 A 12 12 ALA HA H 12 5.156 5.986 -0.830 1
1 117 . 23 1 1 A 12 12 ALA C C 12 177.284 176.225 1.059 1
1 118 . 23 1 1 A 12 12 ALA CA C 12 51.087 50.390 0.697 1
1 119 . 23 1 1 A 12 12 ALA CB C 12 20.500 22.340 -1.840 1
1 120 . 23 1 1 A 12 12 ALA N N 12 127.100 122.711 4.389 1
1 121 . 23 1 1 A 13 13 TRP H H 13 9.245 8.953 0.292 1
1 122 . 23 1 1 A 13 13 TRP HA H 13 4.717 5.537 -0.820 1
1 131 . 23 1 1 A 13 13 TRP C C 13 175.108 174.383 0.725 1
1 132 . 23 1 1 A 13 13 TRP CA C 13 55.966 56.057 -0.091 1
1 133 . 23 1 1 A 13 13 TRP CB C 13 31.912 31.953 -0.041 1
1 139 . 23 1 1 A 13 13 TRP N N 13 123.088 118.727 4.361 1
1 141 . 23 1 1 A 14 14 ARG H H 14 8.575 8.686 -0.111 1
1 142 . 23 1 1 A 14 14 ARG HA H 14 5.335 4.430 0.905 1
1 150 . 23 1 1 A 14 14 ARG C C 14 175.191 174.051 1.140 1
1 151 . 23 1 1 A 14 14 ARG CA C 14 53.106 55.144 -2.038 1
1 152 . 23 1 1 A 14 14 ARG CB C 14 32.749 31.638 1.111 1
1 154 . 23 1 1 A 14 14 ARG N N 14 121.163 121.118 0.045 1
1 156 . 23 1 1 A 15 15 HIS H H 15 8.595 8.078 0.517 1
1 157 . 23 1 1 A 15 15 HIS HA H 15 4.790 5.213 -0.423 1
1 161 . 23 1 1 A 15 15 HIS C C 15 173.770 174.569 -0.799 1
1 162 . 23 1 1 A 15 15 HIS CA C 15 55.289 54.868 0.421 1
1 163 . 23 1 1 A 15 15 HIS CB C 15 33.208 33.130 0.078 1
1 165 . 23 1 1 A 15 15 HIS N N 15 117.643 119.537 -1.894 1
1 166 . 23 1 1 A 16 16 HIS H H 16 8.993 8.968 0.025 1
1 167 . 23 1 1 A 16 16 HIS HA H 16 5.158 4.843 0.315 1
1 171 . 23 1 1 A 16 16 HIS C C 16 173.608 174.091 -0.483 1
1 172 . 23 1 1 A 16 16 HIS CA C 16 56.450 56.602 -0.152 1
1 173 . 23 1 1 A 16 16 HIS CB C 16 34.171 31.103 3.068 1
1 175 . 23 1 1 A 16 16 HIS N N 16 123.520 123.540 -0.020 1
1 176 . 23 1 1 A 17 17 ASN H H 17 7.829 8.643 -0.814 1
1 177 . 23 1 1 A 17 17 ASN HA H 17 4.713 5.146 -0.433 1
1 182 . 23 1 1 A 17 17 ASN C C 17 173.682 175.535 -1.853 1
1 183 . 23 1 1 A 17 17 ASN CA C 17 51.822 51.648 0.174 1
1 184 . 23 1 1 A 17 17 ASN CB C 17 43.176 42.326 0.850 1
1 185 . 23 1 1 A 17 17 ASN N N 17 122.213 123.260 -1.047 1
1 187 . 23 1 1 A 18 18 GLY H H 18 8.423 8.440 -0.017 1
1 188 . 23 1 1 A 18 18 GLY HA2 H 18 3.931 3.820 0.111 1
1 189 . 23 1 1 A 18 18 GLY HA3 H 18 3.707 3.928 -0.221 1
1 190 . 23 1 1 A 18 18 GLY C C 18 173.985 173.129 0.856 1
1 191 . 23 1 1 A 18 18 GLY CA C 18 43.949 44.310 -0.361 1
1 192 . 23 1 1 A 18 18 GLY N N 18 106.991 108.833 -1.842 1
1 193 . 23 1 1 A 19 19 PHE H H 19 8.338 8.334 0.004 1
1 194 . 23 1 1 A 19 19 PHE HA H 19 4.068 4.392 -0.324 1
1 197 . 23 1 1 A 19 19 PHE C C 19 176.568 174.840 1.728 1
1 198 . 23 1 1 A 19 19 PHE CA C 19 59.338 57.803 1.535 1
1 199 . 23 1 1 A 19 19 PHE CB C 19 40.201 39.588 0.613 1
1 200 . 23 1 1 A 19 19 PHE N N 19 116.857 117.001 -0.144 1
1 201 . 23 1 1 A 20 20 ASP H H 20 8.794 8.643 0.151 1
1 202 . 23 1 1 A 20 20 ASP HA H 20 4.485 4.733 -0.248 1
1 205 . 23 1 1 A 20 20 ASP C C 20 177.379 177.264 0.115 1
1 206 . 23 1 1 A 20 20 ASP CA C 20 54.140 53.979 0.161 1
1 207 . 23 1 1 A 20 20 ASP CB C 20 41.915 41.158 0.757 1
1 208 . 23 1 1 A 20 20 ASP N N 20 123.025 123.786 -0.761 1
1 209 . 23 1 1 A 21 21 PHE H H 21 8.862 9.064 -0.202 1
1 210 . 23 1 1 A 21 21 PHE HA H 21 4.087 4.248 -0.161 1
1 218 . 23 1 1 A 21 21 PHE C C 21 176.952 177.172 -0.220 1
1 219 . 23 1 1 A 21 21 PHE CA C 21 61.095 61.550 -0.455 1
1 220 . 23 1 1 A 21 21 PHE CB C 21 38.678 39.601 -0.923 1
1 226 . 23 1 1 A 21 21 PHE N N 21 127.163 127.348 -0.185 1
1 227 . 23 1 1 A 22 22 ALA H H 22 8.561 8.302 0.259 1
1 228 . 23 1 1 A 22 22 ALA HA H 22 3.878 3.935 -0.057 1
1 232 . 23 1 1 A 22 22 ALA C C 22 180.710 179.585 1.125 1
1 233 . 23 1 1 A 22 22 ALA CA C 22 55.211 55.138 0.073 1
1 234 . 23 1 1 A 22 22 ALA CB C 22 18.321 18.096 0.225 1
1 235 . 23 1 1 A 22 22 ALA N N 22 120.293 121.314 -1.021 1
1 236 . 23 1 1 A 23 23 VAL H H 23 7.241 8.374 -1.133 1
1 237 . 23 1 1 A 23 23 VAL HA H 23 3.684 3.778 -0.094 1
1 245 . 23 1 1 A 23 23 VAL C C 23 177.101 177.867 -0.766 1
1 246 . 23 1 1 A 23 23 VAL CA C 23 65.237 65.338 -0.101 1
1 247 . 23 1 1 A 23 23 VAL CB C 23 31.780 31.320 0.460 1
1 250 . 23 1 1 A 23 23 VAL N N 23 118.775 116.458 2.317 1
1 251 . 23 1 1 A 24 24 ILE H H 24 6.761 7.897 -1.136 1
1 252 . 23 1 1 A 24 24 ILE HA H 24 3.196 3.488 -0.292 1
1 262 . 23 1 1 A 24 24 ILE C C 24 177.287 177.849 -0.562 1
1 263 . 23 1 1 A 24 24 ILE CA C 24 63.404 65.030 -1.626 1
1 264 . 23 1 1 A 24 24 ILE CB C 24 36.294 37.076 -0.782 1
1 268 . 23 1 1 A 24 24 ILE N N 24 119.036 121.549 -2.513 1
1 269 . 23 1 1 A 25 25 LYS H H 25 8.032 7.993 0.039 1
1 270 . 23 1 1 A 25 25 LYS HA H 25 3.809 3.635 0.174 1
1 279 . 23 1 1 A 25 25 LYS C C 25 179.450 178.003 1.447 1
1 280 . 23 1 1 A 25 25 LYS CA C 25 59.621 58.826 0.795 1
1 281 . 23 1 1 A 25 25 LYS CB C 25 32.259 31.672 0.587 1
1 285 . 23 1 1 A 25 25 LYS N N 25 118.368 119.911 -1.543 1
1 286 . 23 1 1 A 26 26 GLU H H 26 7.845 7.705 0.140 1
1 287 . 23 1 1 A 26 26 GLU HA H 26 4.021 4.166 -0.145 1
1 292 . 23 1 1 A 26 26 GLU C C 26 179.191 178.697 0.494 1
1 293 . 23 1 1 A 26 26 GLU CA C 26 59.530 58.863 0.667 1
1 294 . 23 1 1 A 26 26 GLU CB C 26 29.449 29.395 0.054 1
1 296 . 23 1 1 A 26 26 GLU N N 26 120.522 119.086 1.436 1
1 297 . 23 1 1 A 27 27 LEU H H 27 8.165 7.969 0.196 1
1 298 . 23 1 1 A 27 27 LEU HA H 27 4.163 4.054 0.109 1
1 308 . 23 1 1 A 27 27 LEU C C 27 177.256 178.297 -1.041 1
1 309 . 23 1 1 A 27 27 LEU CA C 27 58.049 57.719 0.330 1
1 310 . 23 1 1 A 27 27 LEU CB C 27 41.365 41.942 -0.577 1
1 314 . 23 1 1 A 27 27 LEU N N 27 120.879 121.338 -0.459 1
1 315 . 23 1 1 A 28 28 LYS H H 28 8.902 8.593 0.309 1
1 316 . 23 1 1 A 28 28 LYS HA H 28 4.199 3.929 0.270 1
1 317 . 23 1 1 A 28 28 LYS C C 28 179.707 178.888 0.819 1
1 318 . 23 1 1 A 28 28 LYS CA C 28 60.097 59.724 0.373 1
1 319 . 23 1 1 A 28 28 LYS CB C 28 33.420 32.131 1.289 1
1 320 . 23 1 1 A 28 28 LYS N N 28 120.050 119.730 0.320 1
1 321 . 23 1 1 A 29 29 THR H H 29 8.294 8.257 0.037 1
1 322 . 23 1 1 A 29 29 THR HA H 29 3.892 3.988 -0.096 1
1 327 . 23 1 1 A 29 29 THR C C 29 175.711 177.172 -1.461 1
1 328 . 23 1 1 A 29 29 THR CA C 29 66.846 66.400 0.446 1
1 329 . 23 1 1 A 29 29 THR CB C 29 68.794 68.778 0.016 1
1 331 . 23 1 1 A 29 29 THR N N 29 115.933 116.537 -0.604 1
1 332 . 23 1 1 A 30 30 ALA H H 30 8.244 8.061 0.183 1
1 333 . 23 1 1 A 30 30 ALA HA H 30 4.241 4.304 -0.063 1
1 337 . 23 1 1 A 30 30 ALA C C 30 179.128 179.890 -0.762 1
1 338 . 23 1 1 A 30 30 ALA CA C 30 55.714 55.322 0.392 1
1 339 . 23 1 1 A 30 30 ALA CB C 30 18.955 18.580 0.375 1
1 340 . 23 1 1 A 30 30 ALA N N 30 124.617 123.722 0.895 1
1 341 . 23 1 1 A 31 31 ALA H H 31 8.968 8.498 0.470 1
1 342 . 23 1 1 A 31 31 ALA HA H 31 3.890 4.054 -0.164 1
1 346 . 23 1 1 A 31 31 ALA C C 31 180.352 180.022 0.330 1
1 347 . 23 1 1 A 31 31 ALA CA C 31 55.454 55.318 0.136 1
1 348 . 23 1 1 A 31 31 ALA CB C 31 17.124 18.590 -1.466 1
1 349 . 23 1 1 A 31 31 ALA N N 31 119.327 120.479 -1.152 1
1 350 . 23 1 1 A 32 32 SER H H 32 7.995 7.939 0.056 1
1 351 . 23 1 1 A 32 32 SER HA H 32 4.238 4.429 -0.191 1
1 354 . 23 1 1 A 32 32 SER C C 32 175.612 175.335 0.277 1
1 355 . 23 1 1 A 32 32 SER CA C 32 61.203 60.895 0.308 1
1 356 . 23 1 1 A 32 32 SER CB C 32 63.406 63.481 -0.075 1
1 357 . 23 1 1 A 32 32 SER N N 32 111.962 113.839 -1.877 1
1 358 . 23 1 1 A 33 33 GLN H H 33 8.333 7.499 0.834 1
1 359 . 23 1 1 A 33 33 GLN HA H 33 3.992 4.322 -0.330 1
1 366 . 23 1 1 A 33 33 GLN C C 33 177.486 177.386 0.100 1
1 367 . 23 1 1 A 33 33 GLN CA C 33 58.277 58.041 0.236 1
1 368 . 23 1 1 A 33 33 GLN CB C 33 29.140 29.871 -0.731 1
1 370 . 23 1 1 A 33 33 GLN N N 33 119.527 118.938 0.589 1
1 372 . 23 1 1 A 34 34 TYR H H 34 8.587 8.221 0.366 1
1 373 . 23 1 1 A 34 34 TYR HA H 34 4.792 4.470 0.322 1
1 380 . 23 1 1 A 34 34 TYR C C 34 176.499 176.630 -0.131 1
1 381 . 23 1 1 A 34 34 TYR CA C 34 57.711 59.425 -1.714 1
1 382 . 23 1 1 A 34 34 TYR CB C 34 39.561 38.868 0.693 1
1 387 . 23 1 1 A 34 34 TYR N N 34 114.610 115.155 -0.545 1
1 388 . 23 1 1 A 35 35 GLY H H 35 7.346 8.331 -0.985 1
1 389 . 23 1 1 A 35 35 GLY HA2 H 35 4.785 4.093 0.692 1
1 390 . 23 1 1 A 35 35 GLY HA3 H 35 4.007 4.097 -0.090 1
1 391 . 23 1 1 A 35 35 GLY C C 35 175.796 173.223 2.573 1
1 392 . 23 1 1 A 35 35 GLY CA C 35 44.355 44.742 -0.387 1
1 393 . 23 1 1 A 35 35 GLY N N 35 108.501 106.460 2.041 1
1 394 . 23 1 1 A 36 36 ALA H H 36 9.363 8.255 1.108 1
1 395 . 23 1 1 A 36 36 ALA HA H 36 4.217 4.630 -0.413 1
1 399 . 23 1 1 A 36 36 ALA C C 36 178.039 177.228 0.811 1
1 400 . 23 1 1 A 36 36 ALA CA C 36 56.114 51.794 4.320 1
1 401 . 23 1 1 A 36 36 ALA CB C 36 19.179 19.128 0.051 1
1 402 . 23 1 1 A 36 36 ALA N N 36 125.811 123.156 2.655 1
1 403 . 23 1 1 A 37 37 THR H H 37 8.070 8.888 -0.818 1
1 404 . 23 1 1 A 37 37 THR HA H 37 4.570 4.544 0.026 1
1 409 . 23 1 1 A 37 37 THR C C 37 173.685 174.280 -0.595 1
1 410 . 23 1 1 A 37 37 THR CA C 37 59.822 63.169 -3.347 1
1 411 . 23 1 1 A 37 37 THR CB C 37 68.267 71.695 -3.428 1
1 413 . 23 1 1 A 37 37 THR N N 37 129.410 119.045 10.365 1
1 414 . 23 1 1 A 38 38 ALA H H 38 6.853 7.315 -0.462 1
1 415 . 23 1 1 A 38 38 ALA HA H 38 4.601 4.489 0.112 1
1 419 . 23 1 1 A 38 38 ALA CA C 38 50.758 50.826 -0.068 1
1 420 . 23 1 1 A 38 38 ALA CB C 38 18.325 18.990 -0.665 1
1 421 . 23 1 1 A 38 38 ALA N N 38 124.674 124.626 0.048 1
1 422 . 23 1 1 A 40 40 TYR HA H 40 4.032 4.069 -0.037 1
1 429 . 23 1 1 A 40 40 TYR C C 40 176.456 177.346 -0.890 1
1 430 . 23 1 1 A 40 40 TYR CA C 40 61.010 61.740 -0.730 1
1 431 . 23 1 1 A 40 40 TYR CB C 40 39.286 38.673 0.613 1
1 436 . 23 1 1 A 41 41 THR H H 41 6.874 8.204 -1.330 1
1 437 . 23 1 1 A 41 41 THR HA H 41 3.616 3.787 -0.171 1
1 442 . 23 1 1 A 41 41 THR C C 41 176.930 176.586 0.344 1
1 443 . 23 1 1 A 41 41 THR CA C 41 65.557 65.738 -0.181 1
1 444 . 23 1 1 A 41 41 THR CB C 41 68.228 69.251 -1.023 1
1 446 . 23 1 1 A 41 41 THR N N 41 115.143 113.959 1.184 1
1 447 . 23 1 1 A 42 42 LEU H H 42 8.623 7.402 1.221 1
1 448 . 23 1 1 A 42 42 LEU HA H 42 3.708 4.041 -0.333 1
1 458 . 23 1 1 A 42 42 LEU C C 42 178.206 179.034 -0.828 1
1 459 . 23 1 1 A 42 42 LEU CA C 42 57.417 57.820 -0.403 1
1 460 . 23 1 1 A 42 42 LEU CB C 42 41.342 41.206 0.136 1
1 464 . 23 1 1 A 42 42 LEU N N 42 120.418 117.879 2.539 1
1 465 . 23 1 1 A 43 43 ALA H H 43 7.735 7.633 0.102 1
1 466 . 23 1 1 A 43 43 ALA HA H 43 4.020 4.015 0.005 1
1 470 . 23 1 1 A 43 43 ALA C C 43 180.826 180.254 0.572 1
1 471 . 23 1 1 A 43 43 ALA CA C 43 54.925 54.945 -0.020 1
1 472 . 23 1 1 A 43 43 ALA CB C 43 17.506 18.296 -0.790 1
1 473 . 23 1 1 A 43 43 ALA N N 43 120.203 121.738 -1.535 1
1 474 . 23 1 1 A 44 44 ILE H H 44 7.149 7.339 -0.190 1
1 475 . 23 1 1 A 44 44 ILE HA H 44 3.603 3.571 0.032 1
1 485 . 23 1 1 A 44 44 ILE C C 44 178.594 178.343 0.251 1
1 486 . 23 1 1 A 44 44 ILE CA C 44 64.782 63.978 0.804 1
1 487 . 23 1 1 A 44 44 ILE CB C 44 37.472 36.644 0.828 1
1 491 . 23 1 1 A 44 44 ILE N N 44 118.881 119.239 -0.358 1
1 492 . 23 1 1 A 45 45 VAL H H 45 7.968 7.894 0.074 1
1 493 . 23 1 1 A 45 45 VAL HA H 45 2.925 3.335 -0.410 1
1 501 . 23 1 1 A 45 45 VAL C C 45 177.023 177.750 -0.727 1
1 502 . 23 1 1 A 45 45 VAL CA C 45 67.081 66.441 0.640 1
1 503 . 23 1 1 A 45 45 VAL CB C 45 30.854 31.217 -0.363 1
1 506 . 23 1 1 A 45 45 VAL N N 45 120.764 120.627 0.137 1
1 507 . 23 1 1 A 46 46 GLU H H 46 8.399 8.316 0.083 1
1 508 . 23 1 1 A 46 46 GLU HA H 46 3.848 4.017 -0.169 1
1 513 . 23 1 1 A 46 46 GLU C C 46 178.656 179.127 -0.471 1
1 514 . 23 1 1 A 46 46 GLU CA C 46 59.491 59.057 0.434 1
1 515 . 23 1 1 A 46 46 GLU CB C 46 28.991 28.553 0.438 1
1 517 . 23 1 1 A 46 46 GLU N N 46 116.599 119.868 -3.269 1
1 518 . 23 1 1 A 47 47 SER H H 47 7.273 7.422 -0.149 1
1 519 . 23 1 1 A 47 47 SER HA H 47 4.287 4.194 0.093 1
1 521 . 23 1 1 A 47 47 SER CA C 47 61.047 61.282 -0.235 1
1 522 . 23 1 1 A 47 47 SER CB C 47 63.016 62.798 0.218 1
1 523 . 23 1 1 A 47 47 SER N N 47 113.609 115.887 -2.278 1
1 524 . 23 1 1 A 48 48 VAL H H 48 8.006 8.012 -0.006 1
1 525 . 23 1 1 A 48 48 VAL HA H 48 3.556 3.715 -0.159 1
1 533 . 23 1 1 A 48 48 VAL C C 48 177.257 177.797 -0.540 1
1 534 . 23 1 1 A 48 48 VAL CA C 48 65.025 64.750 0.275 1
1 535 . 23 1 1 A 48 48 VAL CB C 48 31.841 31.410 0.431 1
1 538 . 23 1 1 A 48 48 VAL N N 48 122.327 119.008 3.319 1
1 539 . 23 1 1 A 49 49 ALA H H 49 8.369 7.485 0.884 1
1 540 . 23 1 1 A 49 49 ALA HA H 49 4.115 3.857 0.258 1
1 544 . 23 1 1 A 49 49 ALA C C 49 177.307 178.015 -0.708 1
1 545 . 23 1 1 A 49 49 ALA CA C 49 53.253 54.034 -0.781 1
1 546 . 23 1 1 A 49 49 ALA CB C 49 20.131 18.147 1.984 1
1 547 . 23 1 1 A 49 49 ALA N N 49 118.050 123.845 -5.795 1
1 548 . 23 1 1 A 50 50 ASP H H 50 7.052 7.936 -0.884 1
1 549 . 23 1 1 A 50 50 ASP HA H 50 4.788 4.796 -0.008 1
1 552 . 23 1 1 A 50 50 ASP C C 50 175.481 176.200 -0.719 1
1 553 . 23 1 1 A 50 50 ASP CA C 50 53.681 53.471 0.210 1
1 554 . 23 1 1 A 50 50 ASP CB C 50 39.333 41.203 -1.870 1
1 555 . 23 1 1 A 50 50 ASP N N 50 116.997 117.004 -0.007 1
1 556 . 23 1 1 A 51 51 ASN H H 51 8.535 7.461 1.074 1
1 557 . 23 1 1 A 51 51 ASN HA H 51 4.628 5.106 -0.478 1
1 562 . 23 1 1 A 51 51 ASN C C 51 174.077 175.462 -1.385 1
1 563 . 23 1 1 A 51 51 ASN CA C 51 52.315 52.054 0.261 1
1 564 . 23 1 1 A 51 51 ASN CB C 51 41.928 40.498 1.430 1
1 565 . 23 1 1 A 51 51 ASN N N 51 118.626 117.569 1.057 1
1 567 . 23 1 1 A 52 52 TRP H H 52 8.555 8.433 0.122 1
1 574 . 23 1 1 A 52 52 TRP C C 52 173.269 176.606 -3.337 1
1 575 . 23 1 1 A 52 52 TRP CA C 52 55.031 57.862 -2.831 1
1 576 . 23 1 1 A 52 52 TRP CB C 52 26.801 29.880 -3.079 1
1 582 . 23 1 1 A 52 52 TRP N N 52 120.693 121.422 -0.729 1
1 584 . 23 1 1 A 53 53 LEU H H 53 7.847 9.081 -1.234 1
1 585 . 23 1 1 A 53 53 LEU HA H 53 4.859 5.113 -0.254 1
1 595 . 23 1 1 A 53 53 LEU C C 53 177.397 175.233 2.164 1
1 596 . 23 1 1 A 53 53 LEU CA C 53 53.619 53.938 -0.319 1
1 597 . 23 1 1 A 53 53 LEU CB C 53 41.812 45.515 -3.703 1
1 601 . 23 1 1 A 53 53 LEU N N 53 124.741 120.661 4.080 1
1 602 . 23 1 1 A 54 54 THR H H 54 8.850 8.680 0.170 1
1 603 . 23 1 1 A 54 54 THR HA H 54 4.598 5.074 -0.476 1
1 608 . 23 1 1 A 54 54 THR CA C 54 60.531 58.724 1.807 1
1 609 . 23 1 1 A 54 54 THR CB C 54 67.183 70.120 -2.937 1
1 611 . 23 1 1 A 54 54 THR N N 54 113.407 107.959 5.448 1
1 612 . 23 1 1 A 55 55 PRO HA H 55 4.511 4.199 0.312 1
1 619 . 23 1 1 A 55 55 PRO C C 55 179.383 178.843 0.540 1
1 620 . 23 1 1 A 55 55 PRO CA C 55 67.159 65.430 1.729 1
1 621 . 23 1 1 A 55 55 PRO CB C 55 32.095 31.733 0.362 1
1 622 . 23 1 1 A 56 56 THR H H 56 8.575 7.952 0.623 1
1 623 . 23 1 1 A 56 56 THR HA H 56 4.229 4.121 0.108 1
1 628 . 23 1 1 A 56 56 THR C C 56 176.668 176.041 0.627 1
1 629 . 23 1 1 A 56 56 THR CA C 56 66.943 65.832 1.111 1
1 630 . 23 1 1 A 56 56 THR CB C 56 68.129 68.268 -0.139 1
1 632 . 23 1 1 A 56 56 THR N N 56 114.855 113.124 1.731 1
1 633 . 23 1 1 A 57 57 ASP H H 57 8.730 8.188 0.542 1
1 634 . 23 1 1 A 57 57 ASP HA H 57 4.425 4.550 -0.125 1
1 637 . 23 1 1 A 57 57 ASP C C 57 178.351 179.337 -0.986 1
1 638 . 23 1 1 A 57 57 ASP CA C 57 57.963 57.591 0.372 1
1 639 . 23 1 1 A 57 57 ASP CB C 57 40.134 40.863 -0.729 1
1 640 . 23 1 1 A 57 57 ASP N N 57 126.239 120.883 5.356 1
1 641 . 23 1 1 A 58 58 TRP H H 58 8.244 8.343 -0.099 1
1 642 . 23 1 1 A 58 58 TRP HA H 58 4.030 4.378 -0.348 1
1 650 . 23 1 1 A 58 58 TRP C C 58 177.432 179.436 -2.004 1
1 651 . 23 1 1 A 58 58 TRP CA C 58 62.731 60.314 2.417 1
1 652 . 23 1 1 A 58 58 TRP CB C 58 29.122 29.068 0.054 1
1 657 . 23 1 1 A 58 58 TRP N N 58 119.241 120.700 -1.459 1
1 659 . 23 1 1 A 59 59 ASN H H 59 8.098 8.993 -0.895 1
1 660 . 23 1 1 A 59 59 ASN HA H 59 4.424 4.634 -0.210 1
1 663 . 23 1 1 A 59 59 ASN C C 59 176.952 177.916 -0.964 1
1 664 . 23 1 1 A 59 59 ASN CA C 59 58.135 56.633 1.502 1
1 665 . 23 1 1 A 59 59 ASN CB C 59 40.168 38.127 2.041 1
1 666 . 23 1 1 A 59 59 ASN N N 59 115.747 117.839 -2.092 1
1 667 . 23 1 1 A 60 60 THR H H 60 8.712 7.852 0.860 1
1 668 . 23 1 1 A 60 60 THR HA H 60 3.717 4.083 -0.366 1
1 673 . 23 1 1 A 60 60 THR C C 60 176.044 176.049 -0.005 1
1 674 . 23 1 1 A 60 60 THR CA C 60 66.576 65.072 1.504 1
1 675 . 23 1 1 A 60 60 THR CB C 60 69.251 68.838 0.413 1
1 677 . 23 1 1 A 60 60 THR N N 60 114.896 116.029 -1.133 1
1 678 . 23 1 1 A 61 61 LEU H H 61 8.485 8.156 0.329 1
1 679 . 23 1 1 A 61 61 LEU HA H 61 3.391 3.998 -0.607 1
1 689 . 23 1 1 A 61 61 LEU C C 61 177.433 178.227 -0.794 1
1 690 . 23 1 1 A 61 61 LEU CA C 61 58.354 58.159 0.195 1
1 691 . 23 1 1 A 61 61 LEU CB C 61 41.761 41.849 -0.088 1
1 695 . 23 1 1 A 61 61 LEU N N 61 123.433 122.291 1.142 1
1 696 . 23 1 1 A 62 62 VAL H H 62 8.073 8.436 -0.363 1
1 697 . 23 1 1 A 62 62 VAL HA H 62 3.207 3.861 -0.654 1
1 705 . 23 1 1 A 62 62 VAL C C 62 177.585 177.669 -0.084 1
1 706 . 23 1 1 A 62 62 VAL CA C 62 67.345 65.133 2.212 1
1 707 . 23 1 1 A 62 62 VAL CB C 62 30.905 30.588 0.317 1
1 710 . 23 1 1 A 62 62 VAL N N 62 116.018 118.588 -2.570 1
1 711 . 23 1 1 A 63 63 ARG H H 63 7.765 7.753 0.012 1
1 712 . 23 1 1 A 63 63 ARG HA H 63 3.602 4.049 -0.447 1
1 719 . 23 1 1 A 63 63 ARG C C 63 177.818 177.580 0.238 1
1 720 . 23 1 1 A 63 63 ARG CA C 63 58.049 59.492 -1.443 1
1 721 . 23 1 1 A 63 63 ARG CB C 63 29.955 29.939 0.016 1
1 724 . 23 1 1 A 63 63 ARG N N 63 116.700 122.566 -5.866 1
1 725 . 23 1 1 A 64 64 ALA H H 64 7.574 7.896 -0.322 1
1 726 . 23 1 1 A 64 64 ALA HA H 64 4.158 4.255 -0.097 1
1 730 . 23 1 1 A 64 64 ALA C C 64 179.886 178.213 1.673 1
1 731 . 23 1 1 A 64 64 ALA CA C 64 54.007 52.803 1.204 1
1 732 . 23 1 1 A 64 64 ALA CB C 64 19.147 19.276 -0.129 1
1 733 . 23 1 1 A 64 64 ALA N N 64 117.555 120.883 -3.328 1
1 734 . 23 1 1 A 65 65 VAL H H 65 7.554 7.773 -0.219 1
1 735 . 23 1 1 A 65 65 VAL HA H 65 4.253 4.398 -0.145 1
1 743 . 23 1 1 A 65 65 VAL C C 65 174.180 175.247 -1.067 1
1 744 . 23 1 1 A 65 65 VAL CA C 65 62.683 63.604 -0.921 1
1 745 . 23 1 1 A 65 65 VAL CB C 65 33.458 33.672 -0.214 1
1 748 . 23 1 1 A 65 65 VAL N N 65 110.013 117.257 -7.244 1
1 749 . 23 1 1 A 66 66 LEU H H 66 7.792 6.918 0.874 1
1 750 . 23 1 1 A 66 66 LEU HA H 66 4.790 4.480 0.310 1
1 760 . 23 1 1 A 66 66 LEU C C 66 177.537 175.611 1.926 1
1 761 . 23 1 1 A 66 66 LEU CA C 66 52.823 53.935 -1.112 1
1 762 . 23 1 1 A 66 66 LEU CB C 66 44.071 42.121 1.950 1
1 766 . 23 1 1 A 66 66 LEU N N 66 118.967 123.241 -4.274 1
1 767 . 23 1 1 A 67 67 SER H H 67 9.208 8.391 0.817 1
1 768 . 23 1 1 A 67 67 SER HA H 67 4.414 4.816 -0.402 1
1 771 . 23 1 1 A 67 67 SER CA C 67 57.943 57.652 0.291 1
1 772 . 23 1 1 A 67 67 SER CB C 67 64.743 65.863 -1.120 1
1 773 . 23 1 1 A 67 67 SER N N 67 116.378 116.216 0.162 1
1 774 . 23 1 1 A 69 69 GLY HA2 H 69 3.916 3.799 0.117 1
1 775 . 23 1 1 A 69 69 GLY HA3 H 69 3.867 3.838 0.029 1
1 776 . 23 1 1 A 69 69 GLY C C 69 176.783 175.361 1.422 1
1 777 . 23 1 1 A 69 69 GLY CA C 69 46.977 47.245 -0.268 1
1 778 . 23 1 1 A 70 70 ASP H H 70 7.674 8.145 -0.471 1
1 779 . 23 1 1 A 70 70 ASP HA H 70 4.511 3.779 0.732 1
1 782 . 23 1 1 A 70 70 ASP C C 70 178.096 178.365 -0.269 1
1 783 . 23 1 1 A 70 70 ASP CA C 70 57.262 56.286 0.976 1
1 784 . 23 1 1 A 70 70 ASP CB C 70 40.594 39.475 1.119 1
1 785 . 23 1 1 A 70 70 ASP N N 70 123.930 122.219 1.711 1
1 786 . 23 1 1 A 71 71 HIS H H 71 8.729 7.899 0.830 1
1 787 . 23 1 1 A 71 71 HIS HA H 71 4.235 4.175 0.060 1
1 790 . 23 1 1 A 71 71 HIS C C 71 176.769 176.681 0.088 1
1 791 . 23 1 1 A 71 71 HIS CA C 71 60.041 59.966 0.075 1
1 792 . 23 1 1 A 71 71 HIS CB C 71 30.682 29.775 0.907 1
1 793 . 23 1 1 A 71 71 HIS N N 71 121.003 120.064 0.939 1
1 794 . 23 1 1 A 72 72 LEU H H 72 7.620 7.491 0.129 1
1 795 . 23 1 1 A 72 72 LEU HA H 72 3.769 3.740 0.029 1
1 805 . 23 1 1 A 72 72 LEU C C 72 180.275 179.233 1.042 1
1 806 . 23 1 1 A 72 72 LEU CA C 72 58.192 57.940 0.252 1
1 807 . 23 1 1 A 72 72 LEU CB C 72 41.381 41.176 0.205 1
1 811 . 23 1 1 A 72 72 LEU N N 72 118.569 117.790 0.779 1
1 812 . 23 1 1 A 73 73 LEU H H 73 7.542 7.665 -0.123 1
1 813 . 23 1 1 A 73 73 LEU HA H 73 4.107 4.207 -0.100 1
1 823 . 23 1 1 A 73 73 LEU C C 73 179.436 179.234 0.202 1
1 824 . 23 1 1 A 73 73 LEU CA C 73 58.026 57.319 0.707 1
1 825 . 23 1 1 A 73 73 LEU CB C 73 41.638 42.033 -0.395 1
1 829 . 23 1 1 A 73 73 LEU N N 73 121.418 120.404 1.014 1
1 830 . 23 1 1 A 74 74 TRP H H 74 8.786 8.361 0.425 1
1 831 . 23 1 1 A 74 74 TRP HA H 74 3.589 5.499 -1.910 1
1 840 . 23 1 1 A 74 74 TRP C C 74 176.816 178.690 -1.874 1
1 841 . 23 1 1 A 74 74 TRP CA C 74 63.046 60.036 3.010 1
1 842 . 23 1 1 A 74 74 TRP CB C 74 28.065 29.073 -1.008 1
1 848 . 23 1 1 A 74 74 TRP N N 74 121.111 118.121 2.990 1
1 850 . 23 1 1 A 75 75 LYS H H 75 8.939 7.949 0.990 1
1 851 . 23 1 1 A 75 75 LYS HA H 75 3.055 4.292 -1.237 1
1 860 . 23 1 1 A 75 75 LYS C C 75 177.967 179.349 -1.382 1
1 861 . 23 1 1 A 75 75 LYS CA C 75 60.029 58.832 1.197 1
1 862 . 23 1 1 A 75 75 LYS CB C 75 32.533 33.155 -0.622 1
1 866 . 23 1 1 A 75 75 LYS N N 75 119.783 118.639 1.144 1
1 867 . 23 1 1 A 76 76 SER H H 76 7.832 7.991 -0.159 1
1 868 . 23 1 1 A 76 76 SER HA H 76 4.040 4.319 -0.279 1
1 871 . 23 1 1 A 76 76 SER C C 76 177.816 177.226 0.590 1
1 872 . 23 1 1 A 76 76 SER CA C 76 62.105 62.443 -0.338 1
1 873 . 23 1 1 A 76 76 SER CB C 76 62.679 62.868 -0.189 1
1 874 . 23 1 1 A 76 76 SER N N 76 113.395 116.954 -3.559 1
1 875 . 23 1 1 A 77 77 GLU H H 77 7.590 7.673 -0.083 1
1 876 . 23 1 1 A 77 77 GLU HA H 77 4.042 4.205 -0.163 1
1 881 . 23 1 1 A 77 77 GLU C C 77 177.809 178.900 -1.091 1
1 882 . 23 1 1 A 77 77 GLU CA C 77 58.270 58.886 -0.616 1
1 883 . 23 1 1 A 77 77 GLU CB C 77 29.208 29.512 -0.304 1
1 885 . 23 1 1 A 77 77 GLU N N 77 121.574 122.429 -0.855 1
1 886 . 23 1 1 A 78 78 PHE H H 78 9.081 7.897 1.184 1
1 887 . 23 1 1 A 78 78 PHE HA H 78 3.778 4.289 -0.511 1
1 895 . 23 1 1 A 78 78 PHE C C 78 178.114 177.480 0.634 1
1 896 . 23 1 1 A 78 78 PHE CA C 78 60.629 61.407 -0.778 1
1 897 . 23 1 1 A 78 78 PHE CB C 78 38.295 38.705 -0.410 1
1 902 . 23 1 1 A 78 78 PHE N N 78 122.682 121.749 0.933 1
1 903 . 23 1 1 A 79 79 PHE H H 79 8.890 8.030 0.860 1
1 904 . 23 1 1 A 79 79 PHE HA H 79 3.800 3.937 -0.137 1
1 912 . 23 1 1 A 79 79 PHE C C 79 178.354 178.327 0.027 1
1 913 . 23 1 1 A 79 79 PHE CA C 79 60.704 61.637 -0.933 1
1 914 . 23 1 1 A 79 79 PHE CB C 79 37.184 38.217 -1.033 1
1 920 . 23 1 1 A 79 79 PHE N N 79 121.056 118.050 3.006 1
1 921 . 23 1 1 A 80 80 GLU H H 80 7.793 8.213 -0.420 1
1 922 . 23 1 1 A 80 80 GLU HA H 80 4.082 3.980 0.102 1
1 927 . 23 1 1 A 80 80 GLU C C 80 179.068 178.831 0.237 1
1 928 . 23 1 1 A 80 80 GLU CA C 80 59.735 59.856 -0.121 1
1 929 . 23 1 1 A 80 80 GLU CB C 80 28.722 29.423 -0.701 1
1 931 . 23 1 1 A 80 80 GLU N N 80 120.312 118.710 1.602 1
1 932 . 23 1 1 A 81 81 ASN H H 81 8.624 8.864 -0.240 1
1 933 . 23 1 1 A 81 81 ASN HA H 81 4.521 4.513 0.008 1
1 938 . 23 1 1 A 81 81 ASN C C 81 179.262 177.575 1.687 1
1 939 . 23 1 1 A 81 81 ASN CA C 81 55.504 56.032 -0.528 1
1 940 . 23 1 1 A 81 81 ASN CB C 81 37.517 37.519 -0.002 1
1 941 . 23 1 1 A 81 81 ASN N N 81 119.338 117.379 1.959 1
1 943 . 23 1 1 A 82 82 CYS H H 82 8.554 8.072 0.482 1
1 944 . 23 1 1 A 82 82 CYS HA H 82 3.792 3.975 -0.183 1
1 947 . 23 1 1 A 82 82 CYS C C 82 176.478 176.531 -0.053 1
1 948 . 23 1 1 A 82 82 CYS CA C 82 65.232 61.750 3.482 1
1 949 . 23 1 1 A 82 82 CYS CB C 82 26.762 26.822 -0.060 1
1 950 . 23 1 1 A 82 82 CYS N N 82 120.576 118.151 2.425 1
1 951 . 23 1 1 A 83 83 ARG H H 83 8.522 7.826 0.696 1
1 952 . 23 1 1 A 83 83 ARG HA H 83 3.932 4.206 -0.274 1
1 960 . 23 1 1 A 83 83 ARG C C 83 179.138 178.671 0.467 1
1 961 . 23 1 1 A 83 83 ARG CA C 83 60.443 58.888 1.555 1
1 962 . 23 1 1 A 83 83 ARG CB C 83 29.550 29.718 -0.168 1
1 965 . 23 1 1 A 83 83 ARG N N 83 123.035 120.497 2.538 1
1 967 . 23 1 1 A 84 84 ASP H H 84 7.791 8.101 -0.310 1
1 968 . 23 1 1 A 84 84 ASP HA H 84 4.353 4.410 -0.057 1
1 971 . 23 1 1 A 84 84 ASP C C 84 178.649 178.734 -0.085 1
1 972 . 23 1 1 A 84 84 ASP CA C 84 57.767 57.602 0.165 1
1 973 . 23 1 1 A 84 84 ASP CB C 84 41.305 41.539 -0.234 1
1 974 . 23 1 1 A 84 84 ASP N N 84 120.332 119.612 0.720 1
1 975 . 23 1 1 A 85 85 THR H H 85 8.370 8.170 0.200 1
1 976 . 23 1 1 A 85 85 THR HA H 85 3.730 3.906 -0.176 1
1 981 . 23 1 1 A 85 85 THR C C 85 175.198 176.323 -1.125 1
1 982 . 23 1 1 A 85 85 THR CA C 85 66.830 66.311 0.519 1
1 983 . 23 1 1 A 85 85 THR CB C 85 68.533 68.221 0.312 1
1 985 . 23 1 1 A 85 85 THR N N 85 117.360 115.528 1.832 1
1 986 . 23 1 1 A 86 86 ALA H H 86 8.845 8.356 0.489 1
1 987 . 23 1 1 A 86 86 ALA HA H 86 3.991 4.065 -0.074 1
1 991 . 23 1 1 A 86 86 ALA C C 86 179.980 179.540 0.440 1
1 992 . 23 1 1 A 86 86 ALA CA C 86 55.769 55.325 0.444 1
1 993 . 23 1 1 A 86 86 ALA CB C 86 17.881 18.167 -0.286 1
1 994 . 23 1 1 A 86 86 ALA N N 86 123.613 123.570 0.043 1
1 995 . 23 1 1 A 87 87 LYS H H 87 7.686 8.273 -0.587 1
1 996 . 23 1 1 A 87 87 LYS HA H 87 4.099 4.052 0.047 1
1 1005 . 23 1 1 A 87 87 LYS C C 87 179.592 178.557 1.035 1
1 1006 . 23 1 1 A 87 87 LYS CA C 87 59.708 59.115 0.593 1
1 1007 . 23 1 1 A 87 87 LYS CB C 87 32.054 31.881 0.173 1
1 1011 . 23 1 1 A 87 87 LYS N N 87 119.623 116.573 3.050 1
1 1012 . 23 1 1 A 88 88 ARG H H 88 7.683 7.881 -0.198 1
1 1013 . 23 1 1 A 88 88 ARG HA H 88 4.051 4.120 -0.069 1
1 1020 . 23 1 1 A 88 88 ARG C C 88 180.053 178.851 1.202 1
1 1021 . 23 1 1 A 88 88 ARG CA C 88 59.558 59.104 0.454 1
1 1022 . 23 1 1 A 88 88 ARG CB C 88 29.684 30.045 -0.361 1
1 1025 . 23 1 1 A 88 88 ARG N N 88 120.788 119.218 1.570 1
1 1026 . 23 1 1 A 89 89 ASN H H 89 8.973 8.033 0.940 1
1 1027 . 23 1 1 A 89 89 ASN HA H 89 4.354 4.599 -0.245 1
1 1032 . 23 1 1 A 89 89 ASN C C 89 178.382 178.383 -0.001 1
1 1033 . 23 1 1 A 89 89 ASN CA C 89 55.334 55.905 -0.571 1
1 1034 . 23 1 1 A 89 89 ASN CB C 89 37.864 37.988 -0.124 1
1 1035 . 23 1 1 A 89 89 ASN N N 89 121.012 117.997 3.015 1
1 1037 . 23 1 1 A 90 90 GLN H H 90 8.152 8.166 -0.014 1
1 1038 . 23 1 1 A 90 90 GLN HA H 90 4.020 4.145 -0.125 1
1 1045 . 23 1 1 A 90 90 GLN C C 90 179.075 178.723 0.352 1
1 1046 . 23 1 1 A 90 90 GLN CA C 90 59.318 58.731 0.587 1
1 1047 . 23 1 1 A 90 90 GLN CB C 90 28.049 28.610 -0.561 1
1 1049 . 23 1 1 A 90 90 GLN N N 90 122.122 120.973 1.149 1
1 1051 . 23 1 1 A 91 91 GLN H H 91 7.514 8.320 -0.806 1
1 1052 . 23 1 1 A 91 91 GLN HA H 91 4.053 4.065 -0.012 1
1 1059 . 23 1 1 A 91 91 GLN C C 91 177.081 177.972 -0.891 1
1 1060 . 23 1 1 A 91 91 GLN CA C 91 58.031 58.461 -0.430 1
1 1061 . 23 1 1 A 91 91 GLN CB C 91 28.365 27.937 0.428 1
1 1063 . 23 1 1 A 91 91 GLN N N 91 118.124 118.148 -0.024 1
1 1065 . 23 1 1 A 92 92 ALA H H 92 7.704 7.347 0.357 1
1 1066 . 23 1 1 A 92 92 ALA HA H 92 4.246 4.297 -0.051 1
1 1070 . 23 1 1 A 92 92 ALA C C 92 178.450 178.090 0.360 1
1 1071 . 23 1 1 A 92 92 ALA CA C 92 52.671 52.551 0.120 1
1 1072 . 23 1 1 A 92 92 ALA CB C 92 19.316 19.753 -0.437 1
1 1073 . 23 1 1 A 92 92 ALA N N 92 119.880 119.896 -0.016 1
1 1074 . 23 1 1 A 93 93 GLY H H 93 7.693 7.803 -0.110 1
1 1075 . 23 1 1 A 93 93 GLY HA2 H 93 3.941 3.937 0.004 1
1 1076 . 23 1 1 A 93 93 GLY HA3 H 93 3.744 3.942 -0.198 1
1 1077 . 23 1 1 A 93 93 GLY C C 93 174.344 175.025 -0.681 1
1 1078 . 23 1 1 A 93 93 GLY CA C 93 45.949 46.427 -0.478 1
1 1079 . 23 1 1 A 93 93 GLY N N 93 105.347 106.674 -1.327 1
1 1080 . 23 1 1 A 94 94 ASN H H 94 7.076 8.158 -1.082 1
1 1081 . 23 1 1 A 94 94 ASN HA H 94 4.115 4.548 -0.433 1
1 1085 . 23 1 1 A 94 94 ASN C C 94 175.410 175.166 0.244 1
1 1086 . 23 1 1 A 94 94 ASN CA C 94 52.651 54.056 -1.405 1
1 1087 . 23 1 1 A 94 94 ASN CB C 94 38.330 39.292 -0.962 1
1 1088 . 23 1 1 A 94 94 ASN N N 94 115.747 119.651 -3.904 1
1 1090 . 23 1 1 A 95 95 GLY H H 95 8.236 7.857 0.379 1
1 1091 . 23 1 1 A 95 95 GLY HA2 H 95 3.633 3.581 0.052 1
1 1092 . 23 1 1 A 95 95 GLY HA3 H 95 3.633 3.820 -0.187 1
1 1093 . 23 1 1 A 95 95 GLY C C 95 174.450 173.485 0.965 1
1 1094 . 23 1 1 A 95 95 GLY CA C 95 45.522 44.645 0.877 1
1 1095 . 23 1 1 A 95 95 GLY N N 95 109.166 106.484 2.682 1
1 1096 . 23 1 1 A 96 96 TRP H H 96 7.899 7.919 -0.020 1
1 1097 . 23 1 1 A 96 96 TRP HA H 96 5.241 4.981 0.260 1
1 1106 . 23 1 1 A 96 96 TRP C C 96 175.661 175.482 0.179 1
1 1107 . 23 1 1 A 96 96 TRP CA C 96 55.090 56.621 -1.531 1
1 1108 . 23 1 1 A 96 96 TRP CB C 96 27.138 32.456 -5.318 1
1 1114 . 23 1 1 A 96 96 TRP N N 96 122.840 120.513 2.327 1
1 1116 . 23 1 1 A 97 97 ASP H H 97 7.344 9.020 -1.676 1
1 1117 . 23 1 1 A 97 97 ASP HA H 97 4.829 5.162 -0.333 1
1 1120 . 23 1 1 A 97 97 ASP C C 97 175.019 176.501 -1.482 1
1 1121 . 23 1 1 A 97 97 ASP CA C 97 52.149 52.611 -0.462 1
1 1122 . 23 1 1 A 97 97 ASP CB C 97 42.697 44.738 -2.041 1
1 1123 . 23 1 1 A 97 97 ASP N N 97 126.861 120.609 6.252 1
1 1124 . 23 1 1 A 98 98 PHE H H 98 8.566 9.533 -0.967 1
1 1125 . 23 1 1 A 98 98 PHE HA H 98 3.727 4.043 -0.316 1
1 1133 . 23 1 1 A 98 98 PHE C C 98 177.443 177.058 0.385 1
1 1134 . 23 1 1 A 98 98 PHE CA C 98 62.471 62.193 0.278 1
1 1135 . 23 1 1 A 98 98 PHE CB C 98 39.919 39.361 0.558 1
1 1141 . 23 1 1 A 98 98 PHE N N 98 117.781 120.402 -2.621 1
1 1142 . 23 1 1 A 99 99 ASP H H 99 8.259 8.083 0.176 1
1 1143 . 23 1 1 A 99 99 ASP HA H 99 3.960 4.219 -0.259 1
1 1146 . 23 1 1 A 99 99 ASP C C 99 178.132 178.961 -0.829 1
1 1147 . 23 1 1 A 99 99 ASP CA C 99 57.658 56.306 1.352 1
1 1148 . 23 1 1 A 99 99 ASP CB C 99 38.572 40.371 -1.799 1
1 1149 . 23 1 1 A 99 99 ASP N N 99 121.709 118.449 3.260 1
1 1150 . 23 1 1 A 100 100 MET H H 100 8.008 8.039 -0.031 1
1 1151 . 23 1 1 A 100 100 MET HA H 100 3.644 4.784 -1.140 1
1 1156 . 23 1 1 A 100 100 MET C C 100 180.008 176.447 3.561 1
1 1157 . 23 1 1 A 100 100 MET CA C 100 58.598 58.193 0.405 1
1 1158 . 23 1 1 A 100 100 MET CB C 100 33.423 33.589 -0.166 1
1 1160 . 23 1 1 A 100 100 MET N N 100 119.668 117.699 1.969 1
1 1161 . 23 1 1 A 101 101 LEU H H 101 7.961 7.821 0.140 1
1 1162 . 23 1 1 A 101 101 LEU HA H 101 3.523 4.613 -1.090 1
1 1172 . 23 1 1 A 101 101 LEU C C 101 173.873 175.132 -1.259 1
1 1173 . 23 1 1 A 101 101 LEU CA C 101 58.743 53.671 5.072 1
1 1174 . 23 1 1 A 101 101 LEU CB C 101 42.632 43.529 -0.897 1
1 1178 . 23 1 1 A 101 101 LEU N N 101 119.752 119.364 0.388 1
1 1179 . 23 1 1 A 102 102 THR H H 102 6.955 8.158 -1.203 1
1 1180 . 23 1 1 A 102 102 THR HA H 102 4.134 4.357 -0.223 1
1 1185 . 23 1 1 A 102 102 THR C C 102 176.513 173.691 2.822 1
1 1186 . 23 1 1 A 102 102 THR CA C 102 61.125 60.944 0.181 1
1 1187 . 23 1 1 A 102 102 THR CB C 102 71.415 70.348 1.067 1
1 1189 . 23 1 1 A 102 102 THR N N 102 124.665 116.752 7.913 1
1 1190 . 23 1 1 A 103 103 GLY H H 103 7.816 8.039 -0.223 1
1 1191 . 23 1 1 A 103 103 GLY HA2 H 103 3.824 3.933 -0.109 1
1 1192 . 23 1 1 A 103 103 GLY HA3 H 103 3.824 4.018 -0.194 1
1 1193 . 23 1 1 A 103 103 GLY C C 103 174.126 174.053 0.073 1
1 1194 . 23 1 1 A 103 103 GLY CA C 103 47.805 45.890 1.915 1
1 1195 . 23 1 1 A 103 103 GLY N N 103 114.191 109.561 4.630 1
1 1196 . 23 1 1 A 104 104 SER H H 104 8.860 7.835 1.025 1
1 1197 . 23 1 1 A 104 104 SER HA H 104 4.758 4.323 0.435 1
1 1200 . 23 1 1 A 104 104 SER C C 104 174.591 173.405 1.186 1
1 1201 . 23 1 1 A 104 104 SER CA C 104 56.755 60.364 -3.609 1
1 1202 . 23 1 1 A 104 104 SER CB C 104 65.050 61.956 3.094 1
1 1203 . 23 1 1 A 104 104 SER N N 104 114.771 110.823 3.948 1
1 1204 . 23 1 1 A 105 105 GLY H H 105 8.788 8.282 0.506 1
1 1205 . 23 1 1 A 105 105 GLY HA2 H 105 3.733 4.036 -0.303 1
1 1206 . 23 1 1 A 105 105 GLY HA3 H 105 3.733 4.127 -0.394 1
1 1207 . 23 1 1 A 105 105 GLY CA C 105 47.247 45.992 1.255 1
1 1208 . 23 1 1 A 105 105 GLY N N 105 110.394 108.516 1.878 1
1 1209 . 23 1 1 A 106 106 ASN HA H 106 4.454 4.956 -0.502 1
1 1212 . 23 1 1 A 106 106 ASN C C 106 175.180 176.641 -1.461 1
1 1213 . 23 1 1 A 106 106 ASN CA C 106 54.492 54.368 0.124 1
1 1214 . 23 1 1 A 106 106 ASN CB C 106 37.282 41.175 -3.893 1
1 1215 . 23 1 1 A 107 107 TYR H H 107 8.241 8.290 -0.049 1
1 1216 . 23 1 1 A 107 107 TYR HA H 107 4.335 4.808 -0.473 1
1 1223 . 23 1 1 A 107 107 TYR C C 107 173.954 175.476 -1.522 1
1 1224 . 23 1 1 A 107 107 TYR CA C 107 57.727 57.248 0.479 1
1 1225 . 23 1 1 A 107 107 TYR CB C 107 37.063 40.845 -3.782 1
1 1230 . 23 1 1 A 107 107 TYR N N 107 120.708 112.828 7.880 1
1 1231 . 23 1 1 A 108 108 SER H H 108 7.117 8.151 -1.034 1
1 1232 . 23 1 1 A 108 108 SER HA H 108 4.221 4.978 -0.757 1
1 1235 . 23 1 1 A 108 108 SER C C 108 174.834 172.880 1.954 1
1 1236 . 23 1 1 A 108 108 SER CA C 108 59.859 58.282 1.577 1
1 1237 . 23 1 1 A 108 108 SER CB C 108 63.846 62.214 1.632 1
1 1238 . 23 1 1 A 108 108 SER N N 108 113.362 116.384 -3.022 1
1 1239 . 23 1 1 A 109 109 SER H H 109 8.053 8.543 -0.490 1
1 1240 . 23 1 1 A 109 109 SER HA H 109 4.560 5.245 -0.685 1
1 1243 . 23 1 1 A 109 109 SER CA C 109 57.141 57.695 -0.554 1
1 1244 . 23 1 1 A 109 109 SER CB C 109 64.874 64.950 -0.076 1
1 1245 . 23 1 1 A 109 109 SER N N 109 116.657 116.106 0.551 1
1 1246 . 23 1 1 A 110 110 THR HA H 110 3.541 3.992 -0.451 1
1 1251 . 23 1 1 A 110 110 THR C C 110 175.477 175.943 -0.466 1
1 1252 . 23 1 1 A 110 110 THR CA C 110 66.443 65.974 0.469 1
1 1253 . 23 1 1 A 110 110 THR CB C 110 68.091 68.694 -0.603 1
1 1255 . 23 1 1 A 111 111 ASP H H 111 8.224 8.332 -0.108 1
1 1256 . 23 1 1 A 111 111 ASP HA H 111 4.237 4.288 -0.051 1
1 1259 . 23 1 1 A 111 111 ASP C C 111 177.520 177.979 -0.459 1
1 1260 . 23 1 1 A 111 111 ASP CA C 111 57.559 57.106 0.453 1
1 1261 . 23 1 1 A 111 111 ASP CB C 111 40.292 41.050 -0.758 1
1 1262 . 23 1 1 A 111 111 ASP N N 111 119.490 121.555 -2.065 1
1 1263 . 23 1 1 A 112 112 ALA H H 112 7.431 8.164 -0.733 1
1 1264 . 23 1 1 A 112 112 ALA HA H 112 4.191 4.076 0.115 1
1 1268 . 23 1 1 A 112 112 ALA C C 112 180.646 179.979 0.667 1
1 1269 . 23 1 1 A 112 112 ALA CA C 112 54.534 55.247 -0.713 1
1 1270 . 23 1 1 A 112 112 ALA CB C 112 18.992 18.697 0.295 1
1 1271 . 23 1 1 A 112 112 ALA N N 112 119.710 120.670 -0.960 1
1 1272 . 23 1 1 A 113 113 GLN H H 113 7.576 7.401 0.175 1
1 1273 . 23 1 1 A 113 113 GLN HA H 113 3.562 4.211 -0.649 1
1 1278 . 23 1 1 A 113 113 GLN C C 113 176.756 178.583 -1.827 1
1 1279 . 23 1 1 A 113 113 GLN CA C 113 57.736 58.483 -0.747 1
1 1280 . 23 1 1 A 113 113 GLN CB C 113 29.110 28.171 0.939 1
1 1281 . 23 1 1 A 113 113 GLN N N 113 117.518 117.526 -0.008 1
1 1283 . 23 1 1 A 114 114 MET H H 114 8.192 7.992 0.200 1
1 1284 . 23 1 1 A 114 114 MET HA H 114 4.231 4.097 0.134 1
1 1289 . 23 1 1 A 114 114 MET C C 114 175.648 178.137 -2.489 1
1 1290 . 23 1 1 A 114 114 MET CA C 114 57.446 58.262 -0.816 1
1 1291 . 23 1 1 A 114 114 MET CB C 114 33.570 31.965 1.605 1
1 1293 . 23 1 1 A 114 114 MET N N 114 111.509 119.943 -8.434 1
1 1294 . 23 1 1 A 115 115 GLN H H 115 6.940 7.402 -0.462 1
1 1295 . 23 1 1 A 115 115 GLN HA H 115 4.307 4.136 0.171 1
1 1302 . 23 1 1 A 115 115 GLN C C 115 176.270 175.799 0.471 1
1 1303 . 23 1 1 A 115 115 GLN CA C 115 54.680 58.258 -3.578 1
1 1304 . 23 1 1 A 115 115 GLN CB C 115 28.233 28.993 -0.760 1
1 1306 . 23 1 1 A 115 115 GLN N N 115 114.300 116.098 -1.798 1
1 1308 . 23 1 1 A 116 116 TYR H H 116 6.677 7.535 -0.858 1
1 1309 . 23 1 1 A 116 116 TYR HA H 116 4.193 4.095 0.098 1
1 1312 . 23 1 1 A 116 116 TYR C C 116 175.268 174.353 0.915 1
1 1313 . 23 1 1 A 116 116 TYR CA C 116 54.357 58.686 -4.329 1
1 1314 . 23 1 1 A 116 116 TYR CB C 116 35.498 36.225 -0.727 1
1 1315 . 23 1 1 A 116 116 TYR N N 116 117.919 118.984 -1.065 1
1 1316 . 23 1 1 A 117 117 ASP H H 117 8.081 8.496 -0.415 1
1 1317 . 23 1 1 A 117 117 ASP HA H 117 4.665 4.886 -0.221 1
1 1320 . 23 1 1 A 117 117 ASP CA C 117 52.422 50.940 1.482 1
1 1321 . 23 1 1 A 117 117 ASP CB C 117 42.416 41.461 0.955 1
1 1322 . 23 1 1 A 117 117 ASP N N 117 120.887 125.405 -4.518 1
1 1323 . 23 1 1 A 118 118 PRO C C 118 179.180 177.313 1.867 1
1 1324 . 23 1 1 A 118 118 PRO CA C 118 65.942 64.181 1.761 1
1 1325 . 23 1 1 A 118 118 PRO CB C 118 32.197 31.816 0.381 1
1 1326 . 23 1 1 A 119 119 GLY H H 119 9.742 8.151 1.591 1
1 1327 . 23 1 1 A 119 119 GLY C C 119 175.622 174.751 0.871 1
1 1328 . 23 1 1 A 119 119 GLY CA C 119 46.785 45.665 1.120 1
1 1329 . 23 1 1 A 119 119 GLY N N 119 106.412 106.291 0.121 1
1 1330 . 23 1 1 A 120 120 LEU H H 120 6.666 7.061 -0.395 1
1 1331 . 23 1 1 A 120 120 LEU HA H 120 3.365 3.316 0.049 1
1 1341 . 23 1 1 A 120 120 LEU C C 120 179.262 178.247 1.015 1
1 1342 . 23 1 1 A 120 120 LEU CA C 120 56.605 56.551 0.054 1
1 1343 . 23 1 1 A 120 120 LEU CB C 120 39.262 41.204 -1.942 1
1 1347 . 23 1 1 A 120 120 LEU N N 120 126.226 122.476 3.750 1
1 1348 . 23 1 1 A 121 121 PHE H H 121 7.356 8.175 -0.819 1
1 1349 . 23 1 1 A 121 121 PHE HA H 121 4.459 4.260 0.199 1
1 1352 . 23 1 1 A 121 121 PHE C C 121 179.716 177.239 2.477 1
1 1353 . 23 1 1 A 121 121 PHE CA C 121 62.838 61.991 0.847 1
1 1354 . 23 1 1 A 121 121 PHE CB C 121 37.603 39.473 -1.870 1
1 1355 . 23 1 1 A 121 121 PHE N N 121 117.437 119.217 -1.780 1
1 1356 . 23 1 1 A 122 122 ALA H H 122 7.926 7.939 -0.013 1
1 1357 . 23 1 1 A 122 122 ALA HA H 122 4.523 3.875 0.648 1
1 1361 . 23 1 1 A 122 122 ALA C C 122 180.435 179.638 0.797 1
1 1362 . 23 1 1 A 122 122 ALA CA C 122 55.527 55.264 0.263 1
1 1363 . 23 1 1 A 122 122 ALA CB C 122 17.814 18.007 -0.193 1
1 1364 . 23 1 1 A 122 122 ALA N N 122 121.068 121.493 -0.425 1
1 1365 . 23 1 1 A 123 123 GLN H H 123 7.507 7.607 -0.100 1
1 1366 . 23 1 1 A 123 123 GLN HA H 123 4.153 3.927 0.226 1
1 1371 . 23 1 1 A 123 123 GLN C C 123 180.561 178.666 1.895 1
1 1372 . 23 1 1 A 123 123 GLN CA C 123 59.948 58.620 1.328 1
1 1373 . 23 1 1 A 123 123 GLN CB C 123 29.135 28.508 0.627 1
1 1375 . 23 1 1 A 123 123 GLN N N 123 120.324 117.127 3.197 1
1 1376 . 23 1 1 A 124 124 ILE H H 124 8.318 8.008 0.310 1
1 1377 . 23 1 1 A 124 124 ILE HA H 124 3.635 3.387 0.248 1
1 1387 . 23 1 1 A 124 124 ILE C C 124 176.481 177.706 -1.225 1
1 1388 . 23 1 1 A 124 124 ILE CA C 124 66.432 65.117 1.315 1
1 1389 . 23 1 1 A 124 124 ILE CB C 124 39.168 37.490 1.678 1
1 1393 . 23 1 1 A 124 124 ILE N N 124 123.747 120.691 3.056 1
1 1394 . 23 1 1 A 125 125 GLN H H 125 8.474 8.178 0.296 1
1 1395 . 23 1 1 A 125 125 GLN HA H 125 4.264 3.970 0.294 1
1 1402 . 23 1 1 A 125 125 GLN C C 125 178.947 178.169 0.778 1
1 1403 . 23 1 1 A 125 125 GLN CA C 125 59.651 58.508 1.143 1
1 1404 . 23 1 1 A 125 125 GLN CB C 125 28.880 28.592 0.288 1
1 1406 . 23 1 1 A 125 125 GLN N N 125 120.368 119.816 0.552 1
1 1408 . 23 1 1 A 126 126 ALA H H 126 8.002 7.677 0.325 1
1 1409 . 23 1 1 A 126 126 ALA HA H 126 4.144 4.090 0.054 1
1 1413 . 23 1 1 A 126 126 ALA C C 126 179.316 179.916 -0.600 1
1 1414 . 23 1 1 A 126 126 ALA CA C 126 55.036 54.906 0.130 1
1 1415 . 23 1 1 A 126 126 ALA CB C 126 18.087 18.029 0.058 1
1 1416 . 23 1 1 A 126 126 ALA N N 126 121.661 120.756 0.905 1
1 1417 . 23 1 1 A 127 127 ALA H H 127 7.823 7.468 0.355 1
1 1418 . 23 1 1 A 127 127 ALA HA H 127 4.162 4.156 0.006 1
1 1422 . 23 1 1 A 127 127 ALA C C 127 180.707 179.076 1.631 1
1 1423 . 23 1 1 A 127 127 ALA CA C 127 55.080 54.905 0.175 1
1 1424 . 23 1 1 A 127 127 ALA CB C 127 19.354 18.377 0.977 1
1 1425 . 23 1 1 A 127 127 ALA N N 127 119.853 119.595 0.258 1
1 1426 . 23 1 1 A 128 128 ALA H H 128 8.936 8.050 0.886 1
1 1427 . 23 1 1 A 128 128 ALA HA H 128 3.928 4.186 -0.258 1
1 1431 . 23 1 1 A 128 128 ALA C C 128 181.031 179.471 1.560 1
1 1432 . 23 1 1 A 128 128 ALA CA C 128 55.502 55.038 0.464 1
1 1433 . 23 1 1 A 128 128 ALA CB C 128 16.609 17.677 -1.068 1
1 1434 . 23 1 1 A 128 128 ALA N N 128 121.355 120.880 0.475 1
1 1435 . 23 1 1 A 129 129 THR H H 129 8.543 8.081 0.462 1
1 1436 . 23 1 1 A 129 129 THR HA H 129 4.015 3.911 0.104 1
1 1441 . 23 1 1 A 129 129 THR C C 129 177.332 176.750 0.582 1
1 1442 . 23 1 1 A 129 129 THR CA C 129 65.893 65.472 0.421 1
1 1443 . 23 1 1 A 129 129 THR CB C 129 68.566 68.351 0.215 1
1 1445 . 23 1 1 A 129 129 THR N N 129 112.709 111.028 1.681 1
1 1446 . 23 1 1 A 130 130 LYS H H 130 8.126 7.553 0.573 1
1 1447 . 23 1 1 A 130 130 LYS HA H 130 4.000 4.132 -0.132 1
1 1456 . 23 1 1 A 130 130 LYS C C 130 179.082 178.670 0.412 1
1 1457 . 23 1 1 A 130 130 LYS CA C 130 60.299 58.661 1.638 1
1 1458 . 23 1 1 A 130 130 LYS CB C 130 32.767 32.233 0.534 1
1 1462 . 23 1 1 A 130 130 LYS N N 130 123.879 121.625 2.254 1
1 1463 . 23 1 1 A 131 131 ALA H H 131 7.184 7.775 -0.591 1
1 1464 . 23 1 1 A 131 131 ALA HA H 131 4.005 4.306 -0.301 1
1 1468 . 23 1 1 A 131 131 ALA C C 131 178.482 179.655 -1.173 1
1 1469 . 23 1 1 A 131 131 ALA CA C 131 55.027 55.196 -0.169 1
1 1470 . 23 1 1 A 131 131 ALA CB C 131 18.669 19.694 -1.025 1
1 1471 . 23 1 1 A 131 131 ALA N N 131 118.590 121.557 -2.967 1
1 1472 . 23 1 1 A 132 132 TRP H H 132 7.977 8.830 -0.853 1
1 1473 . 23 1 1 A 132 132 TRP HA H 132 4.001 4.378 -0.377 1
1 1480 . 23 1 1 A 132 132 TRP C C 132 177.332 175.866 1.466 1
1 1481 . 23 1 1 A 132 132 TRP CA C 132 60.431 57.540 2.891 1
1 1482 . 23 1 1 A 132 132 TRP CB C 132 27.786 27.883 -0.097 1
1 1486 . 23 1 1 A 132 132 TRP N N 132 119.168 117.164 2.004 1
1 1488 . 23 1 1 A 133 133 ARG H H 133 8.006 8.169 -0.163 1
1 1489 . 23 1 1 A 133 133 ARG HA H 133 4.027 4.431 -0.404 1
1 1497 . 23 1 1 A 133 133 ARG C C 133 176.664 177.757 -1.093 1
1 1498 . 23 1 1 A 133 133 ARG CA C 133 59.355 57.363 1.992 1
1 1499 . 23 1 1 A 133 133 ARG CB C 133 30.451 32.239 -1.788 1
1 1502 . 23 1 1 A 133 133 ARG N N 133 113.062 120.766 -7.704 1
1 1504 . 23 1 1 A 134 134 LYS H H 134 7.322 7.686 -0.364 1
1 1505 . 23 1 1 A 134 134 LYS HA H 134 4.313 4.501 -0.188 1
1 1514 . 23 1 1 A 134 134 LYS C C 134 176.282 176.054 0.228 1
1 1515 . 23 1 1 A 134 134 LYS CA C 134 54.922 56.588 -1.666 1
1 1516 . 23 1 1 A 134 134 LYS CB C 134 32.633 31.349 1.284 1
1 1520 . 23 1 1 A 134 134 LYS N N 134 118.170 118.660 -0.490 1
1 1521 . 23 1 1 A 135 135 LEU H H 135 7.440 8.015 -0.575 1
1 1522 . 23 1 1 A 135 135 LEU HA H 135 4.174 4.644 -0.470 1
1 1532 . 23 1 1 A 135 135 LEU CA C 135 54.408 52.733 1.675 1
1 1533 . 23 1 1 A 135 135 LEU CB C 135 40.407 41.559 -1.152 1
1 1537 . 23 1 1 A 135 135 LEU N N 135 123.358 121.300 2.058 1
1 1538 . 23 1 1 A 136 136 PRO HA H 136 4.437 4.650 -0.213 1
1 1545 . 23 1 1 A 136 136 PRO C C 136 177.106 176.300 0.806 1
1 1546 . 23 1 1 A 136 136 PRO CA C 136 62.889 62.112 0.777 1
1 1547 . 23 1 1 A 136 136 PRO CB C 136 32.192 32.772 -0.580 1
1 1550 . 23 1 1 A 137 137 VAL H H 137 8.219 8.461 -0.242 1
1 1551 . 23 1 1 A 137 137 VAL HA H 137 4.077 4.114 -0.037 1
1 1559 . 23 1 1 A 137 137 VAL C C 137 176.305 176.291 0.014 1
1 1560 . 23 1 1 A 137 137 VAL CA C 137 61.958 62.931 -0.973 1
1 1561 . 23 1 1 A 137 137 VAL CB C 137 32.755 32.425 0.330 1
1 1564 . 23 1 1 A 137 137 VAL N N 137 120.079 121.555 -1.476 1
1 1565 . 23 1 1 A 138 138 LYS H H 138 8.444 8.503 -0.059 1
1 1566 . 23 1 1 A 138 138 LYS HA H 138 4.316 4.056 0.260 1
1 1575 . 23 1 1 A 138 138 LYS C C 138 176.790 177.065 -0.275 1
1 1576 . 23 1 1 A 138 138 LYS CA C 138 56.792 58.286 -1.494 1
1 1577 . 23 1 1 A 138 138 LYS CB C 138 33.205 32.239 0.966 1
1 1581 . 23 1 1 A 138 138 LYS N N 138 126.449 126.635 -0.186 1
1 1582 . 23 1 1 A 139 139 GLY H H 139 8.518 8.529 -0.011 1
1 1583 . 23 1 1 A 139 139 GLY HA2 H 139 4.070 3.987 0.083 1
1 1584 . 23 1 1 A 139 139 GLY HA3 H 139 3.897 3.988 -0.091 1
1 1585 . 23 1 1 A 139 139 GLY C C 139 172.874 174.727 -1.853 1
1 1586 . 23 1 1 A 139 139 GLY CA C 139 45.157 45.375 -0.218 1
1 1587 . 23 1 1 A 139 139 GLY N N 139 112.617 114.048 -1.431 1
1 6 . 24 1 1 A 2 2 VAL H H 2 8.992 8.406 0.586 1
1 7 . 24 1 1 A 2 2 VAL HA H 2 5.370 4.996 0.374 1
1 15 . 24 1 1 A 2 2 VAL C C 2 174.325 174.579 -0.254 1
1 16 . 24 1 1 A 2 2 VAL CA C 2 61.267 60.460 0.807 1
1 17 . 24 1 1 A 2 2 VAL CB C 2 33.890 35.340 -1.450 1
1 20 . 24 1 1 A 2 2 VAL N N 2 126.939 120.928 6.011 1
1 21 . 24 1 1 A 3 3 THR H H 3 8.912 8.732 0.180 1
1 22 . 24 1 1 A 3 3 THR HA H 3 4.505 5.020 -0.515 1
1 27 . 24 1 1 A 3 3 THR C C 3 172.710 172.904 -0.194 1
1 28 . 24 1 1 A 3 3 THR CA C 3 59.689 59.773 -0.084 1
1 29 . 24 1 1 A 3 3 THR CB C 3 72.398 72.093 0.305 1
1 31 . 24 1 1 A 3 3 THR N N 3 118.091 121.618 -3.527 1
1 32 . 24 1 1 A 4 4 GLU H H 4 8.631 8.737 -0.106 1
1 33 . 24 1 1 A 4 4 GLU HA H 4 5.788 5.403 0.385 1
1 38 . 24 1 1 A 4 4 GLU C C 4 175.758 174.837 0.921 1
1 39 . 24 1 1 A 4 4 GLU CA C 4 54.902 54.687 0.215 1
1 40 . 24 1 1 A 4 4 GLU CB C 4 35.097 33.544 1.553 1
1 42 . 24 1 1 A 4 4 GLU N N 4 120.966 123.207 -2.241 1
1 43 . 24 1 1 A 5 5 THR H H 5 9.188 8.702 0.486 1
1 44 . 24 1 1 A 5 5 THR HA H 5 4.739 5.059 -0.320 1
1 49 . 24 1 1 A 5 5 THR C C 5 172.757 173.326 -0.569 1
1 50 . 24 1 1 A 5 5 THR CA C 5 60.382 60.569 -0.187 1
1 51 . 24 1 1 A 5 5 THR CB C 5 71.558 71.433 0.125 1
1 53 . 24 1 1 A 5 5 THR N N 5 119.366 115.194 4.172 1
1 54 . 24 1 1 A 6 6 VAL H H 6 8.476 9.064 -0.588 1
1 55 . 24 1 1 A 6 6 VAL HA H 6 5.026 5.909 -0.883 1
1 63 . 24 1 1 A 6 6 VAL C C 6 176.674 173.660 3.014 1
1 64 . 24 1 1 A 6 6 VAL CA C 6 61.008 59.669 1.339 1
1 65 . 24 1 1 A 6 6 VAL CB C 6 33.861 34.269 -0.408 1
1 68 . 24 1 1 A 6 6 VAL N N 6 121.384 124.018 -2.634 1
1 69 . 24 1 1 A 7 7 ASP H H 7 8.848 8.715 0.133 1
1 70 . 24 1 1 A 7 7 ASP HA H 7 4.797 5.175 -0.378 1
1 73 . 24 1 1 A 7 7 ASP CA C 7 52.834 52.623 0.211 1
1 74 . 24 1 1 A 7 7 ASP CB C 7 42.219 43.768 -1.549 1
1 75 . 24 1 1 A 7 7 ASP N N 7 127.061 123.326 3.735 1
1 76 . 24 1 1 A 8 8 GLY C C 8 175.143 174.882 0.261 1
1 77 . 24 1 1 A 8 8 GLY CA C 8 46.553 46.997 -0.444 1
1 78 . 24 1 1 A 9 9 GLN H H 9 8.408 7.640 0.768 1
1 79 . 24 1 1 A 9 9 GLN HA H 9 4.541 4.274 0.267 1
1 86 . 24 1 1 A 9 9 GLN C C 9 176.463 176.784 -0.321 1
1 87 . 24 1 1 A 9 9 GLN CA C 9 55.167 55.383 -0.216 1
1 88 . 24 1 1 A 9 9 GLN CB C 9 29.376 27.911 1.465 1
1 90 . 24 1 1 A 9 9 GLN N N 9 118.300 116.713 1.587 1
1 92 . 24 1 1 A 10 10 GLY H H 10 8.162 8.355 -0.193 1
1 93 . 24 1 1 A 10 10 GLY HA2 H 10 4.174 3.896 0.278 1
1 94 . 24 1 1 A 10 10 GLY HA3 H 10 3.521 3.910 -0.389 1
1 95 . 24 1 1 A 10 10 GLY C C 10 174.092 174.555 -0.463 1
1 96 . 24 1 1 A 10 10 GLY CA C 10 45.558 46.024 -0.466 1
1 97 . 24 1 1 A 10 10 GLY N N 10 108.747 110.274 -1.527 1
1 98 . 24 1 1 A 11 11 GLN H H 11 8.507 7.549 0.958 1
1 99 . 24 1 1 A 11 11 GLN HA H 11 4.202 4.362 -0.160 1
1 106 . 24 1 1 A 11 11 GLN C C 11 173.992 174.949 -0.957 1
1 107 . 24 1 1 A 11 11 GLN CA C 11 55.098 54.860 0.238 1
1 108 . 24 1 1 A 11 11 GLN CB C 11 29.097 29.635 -0.538 1
1 110 . 24 1 1 A 11 11 GLN N N 11 122.979 120.398 2.581 1
1 112 . 24 1 1 A 12 12 ALA H H 12 8.259 8.754 -0.495 1
1 113 . 24 1 1 A 12 12 ALA HA H 12 5.156 4.941 0.215 1
1 117 . 24 1 1 A 12 12 ALA C C 12 177.284 176.858 0.426 1
1 118 . 24 1 1 A 12 12 ALA CA C 12 51.087 50.580 0.507 1
1 119 . 24 1 1 A 12 12 ALA CB C 12 20.500 20.080 0.420 1
1 120 . 24 1 1 A 12 12 ALA N N 12 127.100 128.768 -1.668 1
1 121 . 24 1 1 A 13 13 TRP H H 13 9.245 9.430 -0.185 1
1 122 . 24 1 1 A 13 13 TRP HA H 13 4.717 5.261 -0.544 1
1 131 . 24 1 1 A 13 13 TRP C C 13 175.108 175.472 -0.364 1
1 132 . 24 1 1 A 13 13 TRP CA C 13 55.966 56.538 -0.572 1
1 133 . 24 1 1 A 13 13 TRP CB C 13 31.912 33.006 -1.094 1
1 139 . 24 1 1 A 13 13 TRP N N 13 123.088 124.518 -1.430 1
1 141 . 24 1 1 A 14 14 ARG H H 14 8.575 8.971 -0.396 1
1 142 . 24 1 1 A 14 14 ARG HA H 14 5.335 5.023 0.312 1
1 150 . 24 1 1 A 14 14 ARG C C 14 175.191 174.282 0.909 1
1 151 . 24 1 1 A 14 14 ARG CA C 14 53.106 55.412 -2.306 1
1 152 . 24 1 1 A 14 14 ARG CB C 14 32.749 34.519 -1.770 1
1 154 . 24 1 1 A 14 14 ARG N N 14 121.163 121.501 -0.338 1
1 156 . 24 1 1 A 15 15 HIS H H 15 8.595 9.260 -0.665 1
1 157 . 24 1 1 A 15 15 HIS HA H 15 4.790 5.150 -0.360 1
1 161 . 24 1 1 A 15 15 HIS C C 15 173.770 174.536 -0.766 1
1 162 . 24 1 1 A 15 15 HIS CA C 15 55.289 54.055 1.234 1
1 163 . 24 1 1 A 15 15 HIS CB C 15 33.208 33.714 -0.506 1
1 165 . 24 1 1 A 15 15 HIS N N 15 117.643 123.073 -5.430 1
1 166 . 24 1 1 A 16 16 HIS H H 16 8.993 9.091 -0.098 1
1 167 . 24 1 1 A 16 16 HIS HA H 16 5.158 4.975 0.183 1
1 171 . 24 1 1 A 16 16 HIS C C 16 173.608 175.320 -1.712 1
1 172 . 24 1 1 A 16 16 HIS CA C 16 56.450 55.530 0.920 1
1 173 . 24 1 1 A 16 16 HIS CB C 16 34.171 31.084 3.087 1
1 175 . 24 1 1 A 16 16 HIS N N 16 123.520 121.051 2.469 1
1 176 . 24 1 1 A 17 17 ASN H H 17 7.829 9.361 -1.532 1
1 177 . 24 1 1 A 17 17 ASN HA H 17 4.713 5.374 -0.661 1
1 182 . 24 1 1 A 17 17 ASN C C 17 173.682 175.836 -2.154 1
1 183 . 24 1 1 A 17 17 ASN CA C 17 51.822 51.811 0.011 1
1 184 . 24 1 1 A 17 17 ASN CB C 17 43.176 41.847 1.329 1
1 185 . 24 1 1 A 17 17 ASN N N 17 122.213 120.297 1.916 1
1 187 . 24 1 1 A 18 18 GLY H H 18 8.423 8.433 -0.010 1
1 188 . 24 1 1 A 18 18 GLY HA2 H 18 3.931 3.756 0.175 1
1 189 . 24 1 1 A 18 18 GLY HA3 H 18 3.707 3.974 -0.267 1
1 190 . 24 1 1 A 18 18 GLY C C 18 173.985 173.000 0.985 1
1 191 . 24 1 1 A 18 18 GLY CA C 18 43.949 44.756 -0.807 1
1 192 . 24 1 1 A 18 18 GLY N N 18 106.991 107.824 -0.833 1
1 193 . 24 1 1 A 19 19 PHE H H 19 8.338 7.948 0.390 1
1 194 . 24 1 1 A 19 19 PHE HA H 19 4.068 4.590 -0.522 1
1 197 . 24 1 1 A 19 19 PHE C C 19 176.568 175.455 1.113 1
1 198 . 24 1 1 A 19 19 PHE CA C 19 59.338 59.217 0.121 1
1 199 . 24 1 1 A 19 19 PHE CB C 19 40.201 39.167 1.034 1
1 200 . 24 1 1 A 19 19 PHE N N 19 116.857 119.208 -2.351 1
1 201 . 24 1 1 A 20 20 ASP H H 20 8.794 8.768 0.026 1
1 202 . 24 1 1 A 20 20 ASP HA H 20 4.485 4.846 -0.361 1
1 205 . 24 1 1 A 20 20 ASP C C 20 177.379 176.964 0.415 1
1 206 . 24 1 1 A 20 20 ASP CA C 20 54.140 54.189 -0.049 1
1 207 . 24 1 1 A 20 20 ASP CB C 20 41.915 41.927 -0.012 1
1 208 . 24 1 1 A 20 20 ASP N N 20 123.025 124.940 -1.915 1
1 209 . 24 1 1 A 21 21 PHE H H 21 8.862 9.153 -0.291 1
1 210 . 24 1 1 A 21 21 PHE HA H 21 4.087 4.094 -0.007 1
1 218 . 24 1 1 A 21 21 PHE C C 21 176.952 177.252 -0.300 1
1 219 . 24 1 1 A 21 21 PHE CA C 21 61.095 62.323 -1.228 1
1 220 . 24 1 1 A 21 21 PHE CB C 21 38.678 39.347 -0.669 1
1 226 . 24 1 1 A 21 21 PHE N N 21 127.163 127.525 -0.362 1
1 227 . 24 1 1 A 22 22 ALA H H 22 8.561 8.403 0.158 1
1 228 . 24 1 1 A 22 22 ALA HA H 22 3.878 3.963 -0.085 1
1 232 . 24 1 1 A 22 22 ALA C C 22 180.710 179.845 0.865 1
1 233 . 24 1 1 A 22 22 ALA CA C 22 55.211 55.208 0.003 1
1 234 . 24 1 1 A 22 22 ALA CB C 22 18.321 18.335 -0.014 1
1 235 . 24 1 1 A 22 22 ALA N N 22 120.293 121.113 -0.820 1
1 236 . 24 1 1 A 23 23 VAL H H 23 7.241 8.238 -0.997 1
1 237 . 24 1 1 A 23 23 VAL HA H 23 3.684 3.481 0.203 1
1 245 . 24 1 1 A 23 23 VAL C C 23 177.101 178.034 -0.933 1
1 246 . 24 1 1 A 23 23 VAL CA C 23 65.237 66.902 -1.665 1
1 247 . 24 1 1 A 23 23 VAL CB C 23 31.780 31.495 0.285 1
1 250 . 24 1 1 A 23 23 VAL N N 23 118.775 117.786 0.989 1
1 251 . 24 1 1 A 24 24 ILE H H 24 6.761 7.983 -1.222 1
1 252 . 24 1 1 A 24 24 ILE HA H 24 3.196 3.483 -0.287 1
1 262 . 24 1 1 A 24 24 ILE C C 24 177.287 178.247 -0.960 1
1 263 . 24 1 1 A 24 24 ILE CA C 24 63.404 65.574 -2.170 1
1 264 . 24 1 1 A 24 24 ILE CB C 24 36.294 37.758 -1.464 1
1 268 . 24 1 1 A 24 24 ILE N N 24 119.036 119.460 -0.424 1
1 269 . 24 1 1 A 25 25 LYS H H 25 8.032 8.282 -0.250 1
1 270 . 24 1 1 A 25 25 LYS HA H 25 3.809 3.704 0.105 1
1 279 . 24 1 1 A 25 25 LYS C C 25 179.450 178.533 0.917 1
1 280 . 24 1 1 A 25 25 LYS CA C 25 59.621 59.485 0.136 1
1 281 . 24 1 1 A 25 25 LYS CB C 25 32.259 32.223 0.036 1
1 285 . 24 1 1 A 25 25 LYS N N 25 118.368 120.264 -1.896 1
1 286 . 24 1 1 A 26 26 GLU H H 26 7.845 7.953 -0.108 1
1 287 . 24 1 1 A 26 26 GLU HA H 26 4.021 4.106 -0.085 1
1 292 . 24 1 1 A 26 26 GLU C C 26 179.191 178.729 0.462 1
1 293 . 24 1 1 A 26 26 GLU CA C 26 59.530 59.039 0.491 1
1 294 . 24 1 1 A 26 26 GLU CB C 26 29.449 29.482 -0.033 1
1 296 . 24 1 1 A 26 26 GLU N N 26 120.522 119.159 1.363 1
1 297 . 24 1 1 A 27 27 LEU H H 27 8.165 7.905 0.260 1
1 298 . 24 1 1 A 27 27 LEU HA H 27 4.163 4.135 0.028 1
1 308 . 24 1 1 A 27 27 LEU C C 27 177.256 178.317 -1.061 1
1 309 . 24 1 1 A 27 27 LEU CA C 27 58.049 57.677 0.372 1
1 310 . 24 1 1 A 27 27 LEU CB C 27 41.365 41.736 -0.371 1
1 314 . 24 1 1 A 27 27 LEU N N 27 120.879 121.160 -0.281 1
1 315 . 24 1 1 A 28 28 LYS H H 28 8.902 8.241 0.661 1
1 316 . 24 1 1 A 28 28 LYS HA H 28 4.199 4.575 -0.376 1
1 317 . 24 1 1 A 28 28 LYS C C 28 179.707 179.269 0.438 1
1 318 . 24 1 1 A 28 28 LYS CA C 28 60.097 59.139 0.958 1
1 319 . 24 1 1 A 28 28 LYS CB C 28 33.420 31.980 1.440 1
1 320 . 24 1 1 A 28 28 LYS N N 28 120.050 119.753 0.297 1
1 321 . 24 1 1 A 29 29 THR H H 29 8.294 7.951 0.343 1
1 322 . 24 1 1 A 29 29 THR HA H 29 3.892 3.898 -0.006 1
1 327 . 24 1 1 A 29 29 THR C C 29 175.711 176.119 -0.408 1
1 328 . 24 1 1 A 29 29 THR CA C 29 66.846 66.210 0.636 1
1 329 . 24 1 1 A 29 29 THR CB C 29 68.794 68.766 0.028 1
1 331 . 24 1 1 A 29 29 THR N N 29 115.933 115.538 0.395 1
1 332 . 24 1 1 A 30 30 ALA H H 30 8.244 8.755 -0.511 1
1 333 . 24 1 1 A 30 30 ALA HA H 30 4.241 4.174 0.067 1
1 337 . 24 1 1 A 30 30 ALA C C 30 179.128 179.844 -0.716 1
1 338 . 24 1 1 A 30 30 ALA CA C 30 55.714 55.721 -0.007 1
1 339 . 24 1 1 A 30 30 ALA CB C 30 18.955 18.169 0.786 1
1 340 . 24 1 1 A 30 30 ALA N N 30 124.617 123.277 1.340 1
1 341 . 24 1 1 A 31 31 ALA H H 31 8.968 8.656 0.312 1
1 342 . 24 1 1 A 31 31 ALA HA H 31 3.890 4.199 -0.309 1
1 346 . 24 1 1 A 31 31 ALA C C 31 180.352 179.863 0.489 1
1 347 . 24 1 1 A 31 31 ALA CA C 31 55.454 55.030 0.424 1
1 348 . 24 1 1 A 31 31 ALA CB C 31 17.124 18.250 -1.126 1
1 349 . 24 1 1 A 31 31 ALA N N 31 119.327 120.610 -1.283 1
1 350 . 24 1 1 A 32 32 SER H H 32 7.995 7.875 0.120 1
1 351 . 24 1 1 A 32 32 SER HA H 32 4.238 4.349 -0.111 1
1 354 . 24 1 1 A 32 32 SER C C 32 175.612 175.575 0.037 1
1 355 . 24 1 1 A 32 32 SER CA C 32 61.203 61.419 -0.216 1
1 356 . 24 1 1 A 32 32 SER CB C 32 63.406 63.364 0.042 1
1 357 . 24 1 1 A 32 32 SER N N 32 111.962 114.458 -2.496 1
1 358 . 24 1 1 A 33 33 GLN H H 33 8.333 7.993 0.340 1
1 359 . 24 1 1 A 33 33 GLN HA H 33 3.992 4.323 -0.331 1
1 366 . 24 1 1 A 33 33 GLN C C 33 177.486 177.281 0.205 1
1 367 . 24 1 1 A 33 33 GLN CA C 33 58.277 57.767 0.510 1
1 368 . 24 1 1 A 33 33 GLN CB C 33 29.140 30.067 -0.927 1
1 370 . 24 1 1 A 33 33 GLN N N 33 119.527 119.614 -0.087 1
1 372 . 24 1 1 A 34 34 TYR H H 34 8.587 8.282 0.305 1
1 373 . 24 1 1 A 34 34 TYR HA H 34 4.792 4.526 0.266 1
1 380 . 24 1 1 A 34 34 TYR C C 34 176.499 176.729 -0.230 1
1 381 . 24 1 1 A 34 34 TYR CA C 34 57.711 59.038 -1.327 1
1 382 . 24 1 1 A 34 34 TYR CB C 34 39.561 39.276 0.285 1
1 387 . 24 1 1 A 34 34 TYR N N 34 114.610 115.430 -0.820 1
1 388 . 24 1 1 A 35 35 GLY H H 35 7.346 8.312 -0.966 1
1 389 . 24 1 1 A 35 35 GLY HA2 H 35 4.785 4.105 0.680 1
1 390 . 24 1 1 A 35 35 GLY HA3 H 35 4.007 4.114 -0.107 1
1 391 . 24 1 1 A 35 35 GLY C C 35 175.796 173.753 2.043 1
1 392 . 24 1 1 A 35 35 GLY CA C 35 44.355 44.781 -0.426 1
1 393 . 24 1 1 A 35 35 GLY N N 35 108.501 107.053 1.448 1
1 394 . 24 1 1 A 36 36 ALA H H 36 9.363 8.316 1.047 1
1 395 . 24 1 1 A 36 36 ALA HA H 36 4.217 4.253 -0.036 1
1 399 . 24 1 1 A 36 36 ALA C C 36 178.039 178.098 -0.059 1
1 400 . 24 1 1 A 36 36 ALA CA C 36 56.114 53.166 2.948 1
1 401 . 24 1 1 A 36 36 ALA CB C 36 19.179 18.727 0.452 1
1 402 . 24 1 1 A 36 36 ALA N N 36 125.811 124.240 1.571 1
1 403 . 24 1 1 A 37 37 THR H H 37 8.070 8.837 -0.767 1
1 404 . 24 1 1 A 37 37 THR HA H 37 4.570 4.396 0.174 1
1 409 . 24 1 1 A 37 37 THR C C 37 173.685 174.101 -0.416 1
1 410 . 24 1 1 A 37 37 THR CA C 37 59.822 63.909 -4.087 1
1 411 . 24 1 1 A 37 37 THR CB C 37 68.267 66.948 1.319 1
1 413 . 24 1 1 A 37 37 THR N N 37 129.410 116.299 13.111 1
1 414 . 24 1 1 A 38 38 ALA H H 38 6.853 7.425 -0.572 1
1 415 . 24 1 1 A 38 38 ALA HA H 38 4.601 4.554 0.047 1
1 419 . 24 1 1 A 38 38 ALA CA C 38 50.758 50.706 0.052 1
1 420 . 24 1 1 A 38 38 ALA CB C 38 18.325 19.740 -1.415 1
1 421 . 24 1 1 A 38 38 ALA N N 38 124.674 125.431 -0.757 1
1 422 . 24 1 1 A 40 40 TYR HA H 40 4.032 4.041 -0.009 1
1 429 . 24 1 1 A 40 40 TYR C C 40 176.456 177.286 -0.830 1
1 430 . 24 1 1 A 40 40 TYR CA C 40 61.010 61.709 -0.699 1
1 431 . 24 1 1 A 40 40 TYR CB C 40 39.286 38.707 0.579 1
1 436 . 24 1 1 A 41 41 THR H H 41 6.874 8.354 -1.480 1
1 437 . 24 1 1 A 41 41 THR HA H 41 3.616 3.869 -0.253 1
1 442 . 24 1 1 A 41 41 THR C C 41 176.930 176.567 0.363 1
1 443 . 24 1 1 A 41 41 THR CA C 41 65.557 65.658 -0.101 1
1 444 . 24 1 1 A 41 41 THR CB C 41 68.228 69.075 -0.847 1
1 446 . 24 1 1 A 41 41 THR N N 41 115.143 113.967 1.176 1
1 447 . 24 1 1 A 42 42 LEU H H 42 8.623 7.396 1.227 1
1 448 . 24 1 1 A 42 42 LEU HA H 42 3.708 4.063 -0.355 1
1 458 . 24 1 1 A 42 42 LEU C C 42 178.206 179.118 -0.912 1
1 459 . 24 1 1 A 42 42 LEU CA C 42 57.417 57.785 -0.368 1
1 460 . 24 1 1 A 42 42 LEU CB C 42 41.342 41.252 0.090 1
1 464 . 24 1 1 A 42 42 LEU N N 42 120.418 119.175 1.243 1
1 465 . 24 1 1 A 43 43 ALA H H 43 7.735 7.858 -0.123 1
1 466 . 24 1 1 A 43 43 ALA HA H 43 4.020 3.976 0.044 1
1 470 . 24 1 1 A 43 43 ALA C C 43 180.826 180.543 0.283 1
1 471 . 24 1 1 A 43 43 ALA CA C 43 54.925 55.054 -0.129 1
1 472 . 24 1 1 A 43 43 ALA CB C 43 17.506 18.229 -0.723 1
1 473 . 24 1 1 A 43 43 ALA N N 43 120.203 121.815 -1.612 1
1 474 . 24 1 1 A 44 44 ILE H H 44 7.149 7.375 -0.226 1
1 475 . 24 1 1 A 44 44 ILE HA H 44 3.603 3.556 0.047 1
1 485 . 24 1 1 A 44 44 ILE C C 44 178.594 178.184 0.410 1
1 486 . 24 1 1 A 44 44 ILE CA C 44 64.782 64.345 0.437 1
1 487 . 24 1 1 A 44 44 ILE CB C 44 37.472 37.184 0.288 1
1 491 . 24 1 1 A 44 44 ILE N N 44 118.881 119.260 -0.379 1
1 492 . 24 1 1 A 45 45 VAL H H 45 7.968 7.697 0.271 1
1 493 . 24 1 1 A 45 45 VAL HA H 45 2.925 3.333 -0.408 1
1 501 . 24 1 1 A 45 45 VAL C C 45 177.023 177.565 -0.542 1
1 502 . 24 1 1 A 45 45 VAL CA C 45 67.081 66.402 0.679 1
1 503 . 24 1 1 A 45 45 VAL CB C 45 30.854 31.100 -0.246 1
1 506 . 24 1 1 A 45 45 VAL N N 45 120.764 119.896 0.868 1
1 507 . 24 1 1 A 46 46 GLU H H 46 8.399 8.098 0.301 1
1 508 . 24 1 1 A 46 46 GLU HA H 46 3.848 3.880 -0.032 1
1 513 . 24 1 1 A 46 46 GLU C C 46 178.656 179.025 -0.369 1
1 514 . 24 1 1 A 46 46 GLU CA C 46 59.491 59.587 -0.096 1
1 515 . 24 1 1 A 46 46 GLU CB C 46 28.991 29.715 -0.724 1
1 517 . 24 1 1 A 46 46 GLU N N 46 116.599 119.878 -3.279 1
1 518 . 24 1 1 A 47 47 SER H H 47 7.273 8.134 -0.861 1
1 519 . 24 1 1 A 47 47 SER HA H 47 4.287 4.075 0.212 1
1 521 . 24 1 1 A 47 47 SER CA C 47 61.047 62.401 -1.354 1
1 522 . 24 1 1 A 47 47 SER CB C 47 63.016 63.045 -0.029 1
1 523 . 24 1 1 A 47 47 SER N N 47 113.609 116.903 -3.294 1
1 524 . 24 1 1 A 48 48 VAL H H 48 8.006 8.178 -0.172 1
1 525 . 24 1 1 A 48 48 VAL HA H 48 3.556 3.661 -0.105 1
1 533 . 24 1 1 A 48 48 VAL C C 48 177.257 177.901 -0.644 1
1 534 . 24 1 1 A 48 48 VAL CA C 48 65.025 64.844 0.181 1
1 535 . 24 1 1 A 48 48 VAL CB C 48 31.841 31.427 0.414 1
1 538 . 24 1 1 A 48 48 VAL N N 48 122.327 118.884 3.443 1
1 539 . 24 1 1 A 49 49 ALA H H 49 8.369 7.606 0.763 1
1 540 . 24 1 1 A 49 49 ALA HA H 49 4.115 3.878 0.237 1
1 544 . 24 1 1 A 49 49 ALA C C 49 177.307 179.134 -1.827 1
1 545 . 24 1 1 A 49 49 ALA CA C 49 53.253 54.182 -0.929 1
1 546 . 24 1 1 A 49 49 ALA CB C 49 20.131 18.301 1.830 1
1 547 . 24 1 1 A 49 49 ALA N N 49 118.050 124.209 -6.159 1
1 548 . 24 1 1 A 50 50 ASP H H 50 7.052 7.606 -0.554 1
1 549 . 24 1 1 A 50 50 ASP HA H 50 4.788 4.667 0.121 1
1 552 . 24 1 1 A 50 50 ASP C C 50 175.481 176.180 -0.699 1
1 553 . 24 1 1 A 50 50 ASP CA C 50 53.681 55.102 -1.421 1
1 554 . 24 1 1 A 50 50 ASP CB C 50 39.333 40.930 -1.597 1
1 555 . 24 1 1 A 50 50 ASP N N 50 116.997 117.025 -0.028 1
1 556 . 24 1 1 A 51 51 ASN H H 51 8.535 7.676 0.859 1
1 557 . 24 1 1 A 51 51 ASN HA H 51 4.628 5.017 -0.389 1
1 562 . 24 1 1 A 51 51 ASN C C 51 174.077 175.332 -1.255 1
1 563 . 24 1 1 A 51 51 ASN CA C 51 52.315 51.946 0.369 1
1 564 . 24 1 1 A 51 51 ASN CB C 51 41.928 40.630 1.298 1
1 565 . 24 1 1 A 51 51 ASN N N 51 118.626 117.846 0.780 1
1 567 . 24 1 1 A 52 52 TRP H H 52 8.555 8.441 0.114 1
1 574 . 24 1 1 A 52 52 TRP C C 52 173.269 176.225 -2.956 1
1 575 . 24 1 1 A 52 52 TRP CA C 52 55.031 57.933 -2.902 1
1 576 . 24 1 1 A 52 52 TRP CB C 52 26.801 29.001 -2.200 1
1 582 . 24 1 1 A 52 52 TRP N N 52 120.693 121.294 -0.601 1
1 584 . 24 1 1 A 53 53 LEU H H 53 7.847 7.559 0.288 1
1 585 . 24 1 1 A 53 53 LEU HA H 53 4.859 4.335 0.524 1
1 595 . 24 1 1 A 53 53 LEU C C 53 177.397 176.915 0.482 1
1 596 . 24 1 1 A 53 53 LEU CA C 53 53.619 55.472 -1.853 1
1 597 . 24 1 1 A 53 53 LEU CB C 53 41.812 42.460 -0.648 1
1 601 . 24 1 1 A 53 53 LEU N N 53 124.741 119.511 5.230 1
1 602 . 24 1 1 A 54 54 THR H H 54 8.850 8.246 0.604 1
1 603 . 24 1 1 A 54 54 THR HA H 54 4.598 4.803 -0.205 1
1 608 . 24 1 1 A 54 54 THR CA C 54 60.531 60.431 0.100 1
1 609 . 24 1 1 A 54 54 THR CB C 54 67.183 68.837 -1.654 1
1 611 . 24 1 1 A 54 54 THR N N 54 113.407 113.744 -0.337 1
1 612 . 24 1 1 A 55 55 PRO HA H 55 4.511 4.305 0.206 1
1 619 . 24 1 1 A 55 55 PRO C C 55 179.383 178.839 0.544 1
1 620 . 24 1 1 A 55 55 PRO CA C 55 67.159 64.796 2.363 1
1 621 . 24 1 1 A 55 55 PRO CB C 55 32.095 31.699 0.396 1
1 622 . 24 1 1 A 56 56 THR H H 56 8.575 7.827 0.748 1
1 623 . 24 1 1 A 56 56 THR HA H 56 4.229 4.147 0.082 1
1 628 . 24 1 1 A 56 56 THR C C 56 176.668 176.622 0.046 1
1 629 . 24 1 1 A 56 56 THR CA C 56 66.943 65.775 1.168 1
1 630 . 24 1 1 A 56 56 THR CB C 56 68.129 68.764 -0.635 1
1 632 . 24 1 1 A 56 56 THR N N 56 114.855 111.976 2.879 1
1 633 . 24 1 1 A 57 57 ASP H H 57 8.730 8.389 0.341 1
1 634 . 24 1 1 A 57 57 ASP HA H 57 4.425 4.669 -0.244 1
1 637 . 24 1 1 A 57 57 ASP C C 57 178.351 178.846 -0.495 1
1 638 . 24 1 1 A 57 57 ASP CA C 57 57.963 57.038 0.925 1
1 639 . 24 1 1 A 57 57 ASP CB C 57 40.134 40.056 0.078 1
1 640 . 24 1 1 A 57 57 ASP N N 57 126.239 119.654 6.585 1
1 641 . 24 1 1 A 58 58 TRP H H 58 8.244 8.118 0.126 1
1 642 . 24 1 1 A 58 58 TRP HA H 58 4.030 4.453 -0.423 1
1 650 . 24 1 1 A 58 58 TRP C C 58 177.432 179.209 -1.777 1
1 651 . 24 1 1 A 58 58 TRP CA C 58 62.731 60.144 2.587 1
1 652 . 24 1 1 A 58 58 TRP CB C 58 29.122 29.127 -0.005 1
1 657 . 24 1 1 A 58 58 TRP N N 58 119.241 119.957 -0.716 1
1 659 . 24 1 1 A 59 59 ASN H H 59 8.098 8.867 -0.769 1
1 660 . 24 1 1 A 59 59 ASN HA H 59 4.424 4.584 -0.160 1
1 663 . 24 1 1 A 59 59 ASN C C 59 176.952 178.076 -1.124 1
1 664 . 24 1 1 A 59 59 ASN CA C 59 58.135 56.680 1.455 1
1 665 . 24 1 1 A 59 59 ASN CB C 59 40.168 39.633 0.535 1
1 666 . 24 1 1 A 59 59 ASN N N 59 115.747 117.878 -2.131 1
1 667 . 24 1 1 A 60 60 THR H H 60 8.712 7.919 0.793 1
1 668 . 24 1 1 A 60 60 THR HA H 60 3.717 3.940 -0.223 1
1 673 . 24 1 1 A 60 60 THR C C 60 176.044 177.049 -1.005 1
1 674 . 24 1 1 A 60 60 THR CA C 60 66.576 66.623 -0.047 1
1 675 . 24 1 1 A 60 60 THR CB C 60 69.251 67.856 1.395 1
1 677 . 24 1 1 A 60 60 THR N N 60 114.896 116.277 -1.381 1
1 678 . 24 1 1 A 61 61 LEU H H 61 8.485 8.523 -0.038 1
1 679 . 24 1 1 A 61 61 LEU HA H 61 3.391 3.935 -0.544 1
1 689 . 24 1 1 A 61 61 LEU C C 61 177.433 178.910 -1.477 1
1 690 . 24 1 1 A 61 61 LEU CA C 61 58.354 58.403 -0.049 1
1 691 . 24 1 1 A 61 61 LEU CB C 61 41.761 42.015 -0.254 1
1 695 . 24 1 1 A 61 61 LEU N N 61 123.433 122.053 1.380 1
1 696 . 24 1 1 A 62 62 VAL H H 62 8.073 8.163 -0.090 1
1 697 . 24 1 1 A 62 62 VAL HA H 62 3.207 3.751 -0.544 1
1 705 . 24 1 1 A 62 62 VAL C C 62 177.585 177.418 0.167 1
1 706 . 24 1 1 A 62 62 VAL CA C 62 67.345 65.169 2.176 1
1 707 . 24 1 1 A 62 62 VAL CB C 62 30.905 30.434 0.471 1
1 710 . 24 1 1 A 62 62 VAL N N 62 116.018 118.421 -2.403 1
1 711 . 24 1 1 A 63 63 ARG H H 63 7.765 8.108 -0.343 1
1 712 . 24 1 1 A 63 63 ARG HA H 63 3.602 4.021 -0.419 1
1 719 . 24 1 1 A 63 63 ARG C C 63 177.818 178.081 -0.263 1
1 720 . 24 1 1 A 63 63 ARG CA C 63 58.049 58.328 -0.279 1
1 721 . 24 1 1 A 63 63 ARG CB C 63 29.955 29.730 0.225 1
1 724 . 24 1 1 A 63 63 ARG N N 63 116.700 120.874 -4.174 1
1 725 . 24 1 1 A 64 64 ALA H H 64 7.574 7.448 0.126 1
1 726 . 24 1 1 A 64 64 ALA HA H 64 4.158 4.407 -0.249 1
1 730 . 24 1 1 A 64 64 ALA C C 64 179.886 179.122 0.764 1
1 731 . 24 1 1 A 64 64 ALA CA C 64 54.007 53.683 0.324 1
1 732 . 24 1 1 A 64 64 ALA CB C 64 19.147 19.969 -0.822 1
1 733 . 24 1 1 A 64 64 ALA N N 64 117.555 120.984 -3.429 1
1 734 . 24 1 1 A 65 65 VAL H H 65 7.554 8.008 -0.454 1
1 735 . 24 1 1 A 65 65 VAL HA H 65 4.253 3.853 0.400 1
1 743 . 24 1 1 A 65 65 VAL C C 65 174.180 175.768 -1.588 1
1 744 . 24 1 1 A 65 65 VAL CA C 65 62.683 65.462 -2.779 1
1 745 . 24 1 1 A 65 65 VAL CB C 65 33.458 31.349 2.109 1
1 748 . 24 1 1 A 65 65 VAL N N 65 110.013 115.667 -5.654 1
1 749 . 24 1 1 A 66 66 LEU H H 66 7.792 7.812 -0.020 1
1 750 . 24 1 1 A 66 66 LEU HA H 66 4.790 4.787 0.003 1
1 760 . 24 1 1 A 66 66 LEU C C 66 177.537 174.505 3.032 1
1 761 . 24 1 1 A 66 66 LEU CA C 66 52.823 53.565 -0.742 1
1 762 . 24 1 1 A 66 66 LEU CB C 66 44.071 45.800 -1.729 1
1 766 . 24 1 1 A 66 66 LEU N N 66 118.967 121.937 -2.970 1
1 767 . 24 1 1 A 67 67 SER H H 67 9.208 8.379 0.829 1
1 768 . 24 1 1 A 67 67 SER HA H 67 4.414 5.055 -0.641 1
1 771 . 24 1 1 A 67 67 SER CA C 67 57.943 57.563 0.380 1
1 772 . 24 1 1 A 67 67 SER CB C 67 64.743 65.888 -1.145 1
1 773 . 24 1 1 A 67 67 SER N N 67 116.378 117.978 -1.600 1
1 774 . 24 1 1 A 69 69 GLY HA2 H 69 3.916 3.746 0.170 1
1 775 . 24 1 1 A 69 69 GLY HA3 H 69 3.867 3.767 0.100 1
1 776 . 24 1 1 A 69 69 GLY C C 69 176.783 175.528 1.255 1
1 777 . 24 1 1 A 69 69 GLY CA C 69 46.977 46.502 0.475 1
1 778 . 24 1 1 A 70 70 ASP H H 70 7.674 8.133 -0.459 1
1 779 . 24 1 1 A 70 70 ASP HA H 70 4.511 3.577 0.934 1
1 782 . 24 1 1 A 70 70 ASP C C 70 178.096 178.162 -0.066 1
1 783 . 24 1 1 A 70 70 ASP CA C 70 57.262 56.555 0.707 1
1 784 . 24 1 1 A 70 70 ASP CB C 70 40.594 39.817 0.777 1
1 785 . 24 1 1 A 70 70 ASP N N 70 123.930 121.729 2.201 1
1 786 . 24 1 1 A 71 71 HIS H H 71 8.729 7.912 0.817 1
1 787 . 24 1 1 A 71 71 HIS HA H 71 4.235 4.164 0.071 1
1 790 . 24 1 1 A 71 71 HIS C C 71 176.769 176.949 -0.180 1
1 791 . 24 1 1 A 71 71 HIS CA C 71 60.041 59.938 0.103 1
1 792 . 24 1 1 A 71 71 HIS CB C 71 30.682 30.346 0.336 1
1 793 . 24 1 1 A 71 71 HIS N N 71 121.003 119.219 1.784 1
1 794 . 24 1 1 A 72 72 LEU H H 72 7.620 7.955 -0.335 1
1 795 . 24 1 1 A 72 72 LEU HA H 72 3.769 3.859 -0.090 1
1 805 . 24 1 1 A 72 72 LEU C C 72 180.275 179.058 1.217 1
1 806 . 24 1 1 A 72 72 LEU CA C 72 58.192 58.156 0.036 1
1 807 . 24 1 1 A 72 72 LEU CB C 72 41.381 41.560 -0.179 1
1 811 . 24 1 1 A 72 72 LEU N N 72 118.569 118.467 0.102 1
1 812 . 24 1 1 A 73 73 LEU H H 73 7.542 7.657 -0.115 1
1 813 . 24 1 1 A 73 73 LEU HA H 73 4.107 4.147 -0.040 1
1 823 . 24 1 1 A 73 73 LEU C C 73 179.436 179.161 0.275 1
1 824 . 24 1 1 A 73 73 LEU CA C 73 58.026 57.443 0.583 1
1 825 . 24 1 1 A 73 73 LEU CB C 73 41.638 42.020 -0.382 1
1 829 . 24 1 1 A 73 73 LEU N N 73 121.418 120.032 1.386 1
1 830 . 24 1 1 A 74 74 TRP H H 74 8.786 8.059 0.727 1
1 831 . 24 1 1 A 74 74 TRP HA H 74 3.589 5.543 -1.954 1
1 840 . 24 1 1 A 74 74 TRP C C 74 176.816 178.794 -1.978 1
1 841 . 24 1 1 A 74 74 TRP CA C 74 63.046 59.934 3.112 1
1 842 . 24 1 1 A 74 74 TRP CB C 74 28.065 29.180 -1.115 1
1 848 . 24 1 1 A 74 74 TRP N N 74 121.111 118.224 2.887 1
1 850 . 24 1 1 A 75 75 LYS H H 75 8.939 7.489 1.450 1
1 851 . 24 1 1 A 75 75 LYS HA H 75 3.055 4.176 -1.121 1
1 860 . 24 1 1 A 75 75 LYS C C 75 177.967 179.280 -1.313 1
1 861 . 24 1 1 A 75 75 LYS CA C 75 60.029 58.654 1.375 1
1 862 . 24 1 1 A 75 75 LYS CB C 75 32.533 32.775 -0.242 1
1 866 . 24 1 1 A 75 75 LYS N N 75 119.783 118.670 1.113 1
1 867 . 24 1 1 A 76 76 SER H H 76 7.832 7.817 0.015 1
1 868 . 24 1 1 A 76 76 SER HA H 76 4.040 4.353 -0.313 1
1 871 . 24 1 1 A 76 76 SER C C 76 177.816 177.357 0.459 1
1 872 . 24 1 1 A 76 76 SER CA C 76 62.105 61.334 0.771 1
1 873 . 24 1 1 A 76 76 SER CB C 76 62.679 63.211 -0.532 1
1 874 . 24 1 1 A 76 76 SER N N 76 113.395 114.917 -1.522 1
1 875 . 24 1 1 A 77 77 GLU H H 77 7.590 7.709 -0.119 1
1 876 . 24 1 1 A 77 77 GLU HA H 77 4.042 4.174 -0.132 1
1 881 . 24 1 1 A 77 77 GLU C C 77 177.809 178.998 -1.189 1
1 882 . 24 1 1 A 77 77 GLU CA C 77 58.270 59.177 -0.907 1
1 883 . 24 1 1 A 77 77 GLU CB C 77 29.208 29.169 0.039 1
1 885 . 24 1 1 A 77 77 GLU N N 77 121.574 121.790 -0.216 1
1 886 . 24 1 1 A 78 78 PHE H H 78 9.081 7.829 1.252 1
1 887 . 24 1 1 A 78 78 PHE HA H 78 3.778 4.277 -0.499 1
1 895 . 24 1 1 A 78 78 PHE C C 78 178.114 177.458 0.656 1
1 896 . 24 1 1 A 78 78 PHE CA C 78 60.629 61.359 -0.730 1
1 897 . 24 1 1 A 78 78 PHE CB C 78 38.295 38.593 -0.298 1
1 902 . 24 1 1 A 78 78 PHE N N 78 122.682 120.892 1.790 1
1 903 . 24 1 1 A 79 79 PHE H H 79 8.890 7.995 0.895 1
1 904 . 24 1 1 A 79 79 PHE HA H 79 3.800 4.092 -0.292 1
1 912 . 24 1 1 A 79 79 PHE C C 79 178.354 178.199 0.155 1
1 913 . 24 1 1 A 79 79 PHE CA C 79 60.704 61.899 -1.195 1
1 914 . 24 1 1 A 79 79 PHE CB C 79 37.184 38.343 -1.159 1
1 920 . 24 1 1 A 79 79 PHE N N 79 121.056 118.008 3.048 1
1 921 . 24 1 1 A 80 80 GLU H H 80 7.793 8.164 -0.371 1
1 922 . 24 1 1 A 80 80 GLU HA H 80 4.082 4.030 0.052 1
1 927 . 24 1 1 A 80 80 GLU C C 80 179.068 178.912 0.156 1
1 928 . 24 1 1 A 80 80 GLU CA C 80 59.735 59.625 0.110 1
1 929 . 24 1 1 A 80 80 GLU CB C 80 28.722 29.317 -0.595 1
1 931 . 24 1 1 A 80 80 GLU N N 80 120.312 118.791 1.521 1
1 932 . 24 1 1 A 81 81 ASN H H 81 8.624 9.044 -0.420 1
1 933 . 24 1 1 A 81 81 ASN HA H 81 4.521 4.449 0.072 1
1 938 . 24 1 1 A 81 81 ASN C C 81 179.262 177.712 1.550 1
1 939 . 24 1 1 A 81 81 ASN CA C 81 55.504 56.017 -0.513 1
1 940 . 24 1 1 A 81 81 ASN CB C 81 37.517 37.390 0.127 1
1 941 . 24 1 1 A 81 81 ASN N N 81 119.338 117.107 2.231 1
1 943 . 24 1 1 A 82 82 CYS H H 82 8.554 7.737 0.817 1
1 944 . 24 1 1 A 82 82 CYS HA H 82 3.792 4.076 -0.284 1
1 947 . 24 1 1 A 82 82 CYS C C 82 176.478 177.120 -0.642 1
1 948 . 24 1 1 A 82 82 CYS CA C 82 65.232 63.518 1.714 1
1 949 . 24 1 1 A 82 82 CYS CB C 82 26.762 26.720 0.042 1
1 950 . 24 1 1 A 82 82 CYS N N 82 120.576 117.634 2.942 1
1 951 . 24 1 1 A 83 83 ARG H H 83 8.522 7.741 0.781 1
1 952 . 24 1 1 A 83 83 ARG HA H 83 3.932 4.170 -0.238 1
1 960 . 24 1 1 A 83 83 ARG C C 83 179.138 178.693 0.445 1
1 961 . 24 1 1 A 83 83 ARG CA C 83 60.443 59.018 1.425 1
1 962 . 24 1 1 A 83 83 ARG CB C 83 29.550 29.582 -0.032 1
1 965 . 24 1 1 A 83 83 ARG N N 83 123.035 119.919 3.116 1
1 967 . 24 1 1 A 84 84 ASP H H 84 7.791 8.249 -0.458 1
1 968 . 24 1 1 A 84 84 ASP HA H 84 4.353 4.372 -0.019 1
1 971 . 24 1 1 A 84 84 ASP C C 84 178.649 178.655 -0.006 1
1 972 . 24 1 1 A 84 84 ASP CA C 84 57.767 57.538 0.229 1
1 973 . 24 1 1 A 84 84 ASP CB C 84 41.305 41.686 -0.381 1
1 974 . 24 1 1 A 84 84 ASP N N 84 120.332 119.388 0.944 1
1 975 . 24 1 1 A 85 85 THR H H 85 8.370 8.221 0.149 1
1 976 . 24 1 1 A 85 85 THR HA H 85 3.730 3.929 -0.199 1
1 981 . 24 1 1 A 85 85 THR C C 85 175.198 176.418 -1.220 1
1 982 . 24 1 1 A 85 85 THR CA C 85 66.830 65.792 1.038 1
1 983 . 24 1 1 A 85 85 THR CB C 85 68.533 68.241 0.292 1
1 985 . 24 1 1 A 85 85 THR N N 85 117.360 115.629 1.731 1
1 986 . 24 1 1 A 86 86 ALA H H 86 8.845 8.313 0.532 1
1 987 . 24 1 1 A 86 86 ALA HA H 86 3.991 4.106 -0.115 1
1 991 . 24 1 1 A 86 86 ALA C C 86 179.980 179.671 0.309 1
1 992 . 24 1 1 A 86 86 ALA CA C 86 55.769 55.719 0.050 1
1 993 . 24 1 1 A 86 86 ALA CB C 86 17.881 18.471 -0.590 1
1 994 . 24 1 1 A 86 86 ALA N N 86 123.613 123.061 0.552 1
1 995 . 24 1 1 A 87 87 LYS H H 87 7.686 8.089 -0.403 1
1 996 . 24 1 1 A 87 87 LYS HA H 87 4.099 4.012 0.087 1
1 1005 . 24 1 1 A 87 87 LYS C C 87 179.592 178.525 1.067 1
1 1006 . 24 1 1 A 87 87 LYS CA C 87 59.708 59.171 0.537 1
1 1007 . 24 1 1 A 87 87 LYS CB C 87 32.054 31.875 0.179 1
1 1011 . 24 1 1 A 87 87 LYS N N 87 119.623 116.674 2.949 1
1 1012 . 24 1 1 A 88 88 ARG H H 88 7.683 7.603 0.080 1
1 1013 . 24 1 1 A 88 88 ARG HA H 88 4.051 4.138 -0.087 1
1 1020 . 24 1 1 A 88 88 ARG C C 88 180.053 179.339 0.714 1
1 1021 . 24 1 1 A 88 88 ARG CA C 88 59.558 58.807 0.751 1
1 1022 . 24 1 1 A 88 88 ARG CB C 88 29.684 29.741 -0.057 1
1 1025 . 24 1 1 A 88 88 ARG N N 88 120.788 119.253 1.535 1
1 1026 . 24 1 1 A 89 89 ASN H H 89 8.973 8.317 0.656 1
1 1027 . 24 1 1 A 89 89 ASN HA H 89 4.354 4.516 -0.162 1
1 1032 . 24 1 1 A 89 89 ASN C C 89 178.382 177.892 0.490 1
1 1033 . 24 1 1 A 89 89 ASN CA C 89 55.334 56.240 -0.906 1
1 1034 . 24 1 1 A 89 89 ASN CB C 89 37.864 38.583 -0.719 1
1 1035 . 24 1 1 A 89 89 ASN N N 89 121.012 117.788 3.224 1
1 1037 . 24 1 1 A 90 90 GLN H H 90 8.152 7.992 0.160 1
1 1038 . 24 1 1 A 90 90 GLN HA H 90 4.020 3.991 0.029 1
1 1045 . 24 1 1 A 90 90 GLN C C 90 179.075 178.526 0.549 1
1 1046 . 24 1 1 A 90 90 GLN CA C 90 59.318 58.869 0.449 1
1 1047 . 24 1 1 A 90 90 GLN CB C 90 28.049 28.151 -0.102 1
1 1049 . 24 1 1 A 90 90 GLN N N 90 122.122 118.277 3.845 1
1 1051 . 24 1 1 A 91 91 GLN H H 91 7.514 7.994 -0.480 1
1 1052 . 24 1 1 A 91 91 GLN HA H 91 4.053 4.068 -0.015 1
1 1059 . 24 1 1 A 91 91 GLN C C 91 177.081 177.923 -0.842 1
1 1060 . 24 1 1 A 91 91 GLN CA C 91 58.031 58.423 -0.392 1
1 1061 . 24 1 1 A 91 91 GLN CB C 91 28.365 27.920 0.445 1
1 1063 . 24 1 1 A 91 91 GLN N N 91 118.124 118.227 -0.103 1
1 1065 . 24 1 1 A 92 92 ALA H H 92 7.704 7.622 0.082 1
1 1066 . 24 1 1 A 92 92 ALA HA H 92 4.246 4.243 0.003 1
1 1070 . 24 1 1 A 92 92 ALA C C 92 178.450 178.055 0.395 1
1 1071 . 24 1 1 A 92 92 ALA CA C 92 52.671 52.630 0.041 1
1 1072 . 24 1 1 A 92 92 ALA CB C 92 19.316 19.678 -0.362 1
1 1073 . 24 1 1 A 92 92 ALA N N 92 119.880 120.249 -0.369 1
1 1074 . 24 1 1 A 93 93 GLY H H 93 7.693 7.962 -0.269 1
1 1075 . 24 1 1 A 93 93 GLY HA2 H 93 3.941 3.893 0.048 1
1 1076 . 24 1 1 A 93 93 GLY HA3 H 93 3.744 3.902 -0.158 1
1 1077 . 24 1 1 A 93 93 GLY C C 93 174.344 174.957 -0.613 1
1 1078 . 24 1 1 A 93 93 GLY CA C 93 45.949 46.425 -0.476 1
1 1079 . 24 1 1 A 93 93 GLY N N 93 105.347 106.524 -1.177 1
1 1080 . 24 1 1 A 94 94 ASN H H 94 7.076 8.398 -1.322 1
1 1081 . 24 1 1 A 94 94 ASN HA H 94 4.115 4.525 -0.410 1
1 1085 . 24 1 1 A 94 94 ASN C C 94 175.410 175.182 0.228 1
1 1086 . 24 1 1 A 94 94 ASN CA C 94 52.651 52.878 -0.227 1
1 1087 . 24 1 1 A 94 94 ASN CB C 94 38.330 39.386 -1.056 1
1 1088 . 24 1 1 A 94 94 ASN N N 94 115.747 116.328 -0.581 1
1 1090 . 24 1 1 A 95 95 GLY H H 95 8.236 8.181 0.055 1
1 1091 . 24 1 1 A 95 95 GLY HA2 H 95 3.633 3.576 0.057 1
1 1092 . 24 1 1 A 95 95 GLY HA3 H 95 3.633 3.766 -0.133 1
1 1093 . 24 1 1 A 95 95 GLY C C 95 174.450 173.407 1.043 1
1 1094 . 24 1 1 A 95 95 GLY CA C 95 45.522 45.384 0.138 1
1 1095 . 24 1 1 A 95 95 GLY N N 95 109.166 106.054 3.112 1
1 1096 . 24 1 1 A 96 96 TRP H H 96 7.899 7.893 0.006 1
1 1097 . 24 1 1 A 96 96 TRP HA H 96 5.241 5.127 0.114 1
1 1106 . 24 1 1 A 96 96 TRP C C 96 175.661 175.791 -0.130 1
1 1107 . 24 1 1 A 96 96 TRP CA C 96 55.090 56.066 -0.976 1
1 1108 . 24 1 1 A 96 96 TRP CB C 96 27.138 32.447 -5.309 1
1 1114 . 24 1 1 A 96 96 TRP N N 96 122.840 119.748 3.092 1
1 1116 . 24 1 1 A 97 97 ASP H H 97 7.344 8.990 -1.646 1
1 1117 . 24 1 1 A 97 97 ASP HA H 97 4.829 4.308 0.521 1
1 1120 . 24 1 1 A 97 97 ASP C C 97 175.019 175.946 -0.927 1
1 1121 . 24 1 1 A 97 97 ASP CA C 97 52.149 56.226 -4.077 1
1 1122 . 24 1 1 A 97 97 ASP CB C 97 42.697 38.718 3.979 1
1 1123 . 24 1 1 A 97 97 ASP N N 97 126.861 117.114 9.747 1
1 1124 . 24 1 1 A 98 98 PHE H H 98 8.566 8.355 0.211 1
1 1125 . 24 1 1 A 98 98 PHE HA H 98 3.727 4.162 -0.435 1
1 1133 . 24 1 1 A 98 98 PHE C C 98 177.443 177.555 -0.112 1
1 1134 . 24 1 1 A 98 98 PHE CA C 98 62.471 61.192 1.279 1
1 1135 . 24 1 1 A 98 98 PHE CB C 98 39.919 39.847 0.072 1
1 1141 . 24 1 1 A 98 98 PHE N N 98 117.781 121.020 -3.239 1
1 1142 . 24 1 1 A 99 99 ASP H H 99 8.259 8.328 -0.069 1
1 1143 . 24 1 1 A 99 99 ASP HA H 99 3.960 4.113 -0.153 1
1 1146 . 24 1 1 A 99 99 ASP C C 99 178.132 178.220 -0.088 1
1 1147 . 24 1 1 A 99 99 ASP CA C 99 57.658 56.474 1.184 1
1 1148 . 24 1 1 A 99 99 ASP CB C 99 38.572 40.516 -1.944 1
1 1149 . 24 1 1 A 99 99 ASP N N 99 121.709 119.022 2.687 1
1 1150 . 24 1 1 A 100 100 MET H H 100 8.008 7.866 0.142 1
1 1151 . 24 1 1 A 100 100 MET HA H 100 3.644 4.465 -0.821 1
1 1156 . 24 1 1 A 100 100 MET C C 100 180.008 175.737 4.271 1
1 1157 . 24 1 1 A 100 100 MET CA C 100 58.598 57.213 1.385 1
1 1158 . 24 1 1 A 100 100 MET CB C 100 33.423 33.152 0.271 1
1 1160 . 24 1 1 A 100 100 MET N N 100 119.668 116.209 3.459 1
1 1161 . 24 1 1 A 101 101 LEU H H 101 7.961 7.615 0.346 1
1 1162 . 24 1 1 A 101 101 LEU HA H 101 3.523 4.583 -1.060 1
1 1172 . 24 1 1 A 101 101 LEU C C 101 173.873 176.170 -2.297 1
1 1173 . 24 1 1 A 101 101 LEU CA C 101 58.743 53.256 5.487 1
1 1174 . 24 1 1 A 101 101 LEU CB C 101 42.632 44.387 -1.755 1
1 1178 . 24 1 1 A 101 101 LEU N N 101 119.752 120.344 -0.592 1
1 1179 . 24 1 1 A 102 102 THR H H 102 6.955 8.451 -1.496 1
1 1180 . 24 1 1 A 102 102 THR HA H 102 4.134 3.985 0.149 1
1 1185 . 24 1 1 A 102 102 THR C C 102 176.513 173.993 2.520 1
1 1186 . 24 1 1 A 102 102 THR CA C 102 61.125 62.757 -1.632 1
1 1187 . 24 1 1 A 102 102 THR CB C 102 71.415 68.295 3.120 1
1 1189 . 24 1 1 A 102 102 THR N N 102 124.665 120.073 4.592 1
1 1190 . 24 1 1 A 103 103 GLY H H 103 7.816 8.498 -0.682 1
1 1191 . 24 1 1 A 103 103 GLY HA2 H 103 3.824 4.143 -0.319 1
1 1192 . 24 1 1 A 103 103 GLY HA3 H 103 3.824 4.330 -0.506 1
1 1193 . 24 1 1 A 103 103 GLY C C 103 174.126 173.789 0.337 1
1 1194 . 24 1 1 A 103 103 GLY CA C 103 47.805 45.598 2.207 1
1 1195 . 24 1 1 A 103 103 GLY N N 103 114.191 112.053 2.138 1
1 1196 . 24 1 1 A 104 104 SER H H 104 8.860 8.675 0.185 1
1 1197 . 24 1 1 A 104 104 SER HA H 104 4.758 4.924 -0.166 1
1 1200 . 24 1 1 A 104 104 SER C C 104 174.591 172.188 2.403 1
1 1201 . 24 1 1 A 104 104 SER CA C 104 56.755 57.767 -1.012 1
1 1202 . 24 1 1 A 104 104 SER CB C 104 65.050 65.407 -0.357 1
1 1203 . 24 1 1 A 104 104 SER N N 104 114.771 118.682 -3.911 1
1 1204 . 24 1 1 A 105 105 GLY H H 105 8.788 8.340 0.448 1
1 1205 . 24 1 1 A 105 105 GLY HA2 H 105 3.733 4.177 -0.444 1
1 1206 . 24 1 1 A 105 105 GLY HA3 H 105 3.733 4.243 -0.510 1
1 1207 . 24 1 1 A 105 105 GLY CA C 105 47.247 45.737 1.510 1
1 1208 . 24 1 1 A 105 105 GLY N N 105 110.394 111.849 -1.455 1
1 1209 . 24 1 1 A 106 106 ASN HA H 106 4.454 4.609 -0.155 1
1 1212 . 24 1 1 A 106 106 ASN C C 106 175.180 176.066 -0.886 1
1 1213 . 24 1 1 A 106 106 ASN CA C 106 54.492 55.483 -0.991 1
1 1214 . 24 1 1 A 106 106 ASN CB C 106 37.282 39.375 -2.093 1
1 1215 . 24 1 1 A 107 107 TYR H H 107 8.241 7.441 0.800 1
1 1216 . 24 1 1 A 107 107 TYR HA H 107 4.335 4.789 -0.454 1
1 1223 . 24 1 1 A 107 107 TYR C C 107 173.954 177.420 -3.466 1
1 1224 . 24 1 1 A 107 107 TYR CA C 107 57.727 57.900 -0.173 1
1 1225 . 24 1 1 A 107 107 TYR CB C 107 37.063 39.877 -2.814 1
1 1230 . 24 1 1 A 107 107 TYR N N 107 120.708 114.416 6.292 1
1 1231 . 24 1 1 A 108 108 SER H H 108 7.117 7.826 -0.709 1
1 1232 . 24 1 1 A 108 108 SER HA H 108 4.221 4.116 0.105 1
1 1235 . 24 1 1 A 108 108 SER C C 108 174.834 174.968 -0.134 1
1 1236 . 24 1 1 A 108 108 SER CA C 108 59.859 62.072 -2.213 1
1 1237 . 24 1 1 A 108 108 SER CB C 108 63.846 62.951 0.895 1
1 1238 . 24 1 1 A 108 108 SER N N 108 113.362 117.069 -3.707 1
1 1239 . 24 1 1 A 109 109 SER H H 109 8.053 7.641 0.412 1
1 1240 . 24 1 1 A 109 109 SER HA H 109 4.560 4.208 0.352 1
1 1243 . 24 1 1 A 109 109 SER CA C 109 57.141 60.874 -3.733 1
1 1244 . 24 1 1 A 109 109 SER CB C 109 64.874 61.868 3.006 1
1 1245 . 24 1 1 A 109 109 SER N N 109 116.657 114.434 2.223 1
1 1246 . 24 1 1 A 110 110 THR HA H 110 3.541 3.989 -0.448 1
1 1251 . 24 1 1 A 110 110 THR C C 110 175.477 176.041 -0.564 1
1 1252 . 24 1 1 A 110 110 THR CA C 110 66.443 66.153 0.290 1
1 1253 . 24 1 1 A 110 110 THR CB C 110 68.091 68.260 -0.169 1
1 1255 . 24 1 1 A 111 111 ASP H H 111 8.224 8.431 -0.207 1
1 1256 . 24 1 1 A 111 111 ASP HA H 111 4.237 4.449 -0.212 1
1 1259 . 24 1 1 A 111 111 ASP C C 111 177.520 178.675 -1.155 1
1 1260 . 24 1 1 A 111 111 ASP CA C 111 57.559 57.244 0.315 1
1 1261 . 24 1 1 A 111 111 ASP CB C 111 40.292 40.690 -0.398 1
1 1262 . 24 1 1 A 111 111 ASP N N 111 119.490 120.368 -0.878 1
1 1263 . 24 1 1 A 112 112 ALA H H 112 7.431 8.141 -0.710 1
1 1264 . 24 1 1 A 112 112 ALA HA H 112 4.191 4.094 0.097 1
1 1268 . 24 1 1 A 112 112 ALA C C 112 180.646 180.087 0.559 1
1 1269 . 24 1 1 A 112 112 ALA CA C 112 54.534 55.204 -0.670 1
1 1270 . 24 1 1 A 112 112 ALA CB C 112 18.992 18.677 0.315 1
1 1271 . 24 1 1 A 112 112 ALA N N 112 119.710 122.168 -2.458 1
1 1272 . 24 1 1 A 113 113 GLN H H 113 7.576 7.971 -0.395 1
1 1273 . 24 1 1 A 113 113 GLN HA H 113 3.562 4.148 -0.586 1
1 1278 . 24 1 1 A 113 113 GLN C C 113 176.756 178.509 -1.753 1
1 1279 . 24 1 1 A 113 113 GLN CA C 113 57.736 58.537 -0.801 1
1 1280 . 24 1 1 A 113 113 GLN CB C 113 29.110 28.215 0.895 1
1 1281 . 24 1 1 A 113 113 GLN N N 113 117.518 117.498 0.020 1
1 1283 . 24 1 1 A 114 114 MET H H 114 8.192 8.315 -0.123 1
1 1284 . 24 1 1 A 114 114 MET HA H 114 4.231 4.167 0.064 1
1 1289 . 24 1 1 A 114 114 MET C C 114 175.648 178.432 -2.784 1
1 1290 . 24 1 1 A 114 114 MET CA C 114 57.446 59.050 -1.604 1
1 1291 . 24 1 1 A 114 114 MET CB C 114 33.570 33.464 0.106 1
1 1293 . 24 1 1 A 114 114 MET N N 114 111.509 118.740 -7.231 1
1 1294 . 24 1 1 A 115 115 GLN H H 115 6.940 7.443 -0.503 1
1 1295 . 24 1 1 A 115 115 GLN HA H 115 4.307 4.208 0.099 1
1 1302 . 24 1 1 A 115 115 GLN C C 115 176.270 175.970 0.300 1
1 1303 . 24 1 1 A 115 115 GLN CA C 115 54.680 57.876 -3.196 1
1 1304 . 24 1 1 A 115 115 GLN CB C 115 28.233 28.936 -0.703 1
1 1306 . 24 1 1 A 115 115 GLN N N 115 114.300 116.759 -2.459 1
1 1308 . 24 1 1 A 116 116 TYR H H 116 6.677 7.985 -1.308 1
1 1309 . 24 1 1 A 116 116 TYR HA H 116 4.193 3.993 0.200 1
1 1312 . 24 1 1 A 116 116 TYR C C 116 175.268 174.442 0.826 1
1 1313 . 24 1 1 A 116 116 TYR CA C 116 54.357 58.525 -4.168 1
1 1314 . 24 1 1 A 116 116 TYR CB C 116 35.498 36.345 -0.847 1
1 1315 . 24 1 1 A 116 116 TYR N N 116 117.919 118.979 -1.060 1
1 1316 . 24 1 1 A 117 117 ASP H H 117 8.081 7.950 0.131 1
1 1317 . 24 1 1 A 117 117 ASP HA H 117 4.665 4.660 0.005 1
1 1320 . 24 1 1 A 117 117 ASP CA C 117 52.422 49.847 2.575 1
1 1321 . 24 1 1 A 117 117 ASP CB C 117 42.416 42.278 0.138 1
1 1322 . 24 1 1 A 117 117 ASP N N 117 120.887 127.807 -6.920 1
1 1323 . 24 1 1 A 118 118 PRO C C 118 179.180 178.472 0.708 1
1 1324 . 24 1 1 A 118 118 PRO CA C 118 65.942 64.680 1.262 1
1 1325 . 24 1 1 A 118 118 PRO CB C 118 32.197 31.710 0.487 1
1 1326 . 24 1 1 A 119 119 GLY H H 119 9.742 7.476 2.266 1
1 1327 . 24 1 1 A 119 119 GLY C C 119 175.622 174.999 0.623 1
1 1328 . 24 1 1 A 119 119 GLY CA C 119 46.785 46.338 0.447 1
1 1329 . 24 1 1 A 119 119 GLY N N 119 106.412 106.083 0.329 1
1 1330 . 24 1 1 A 120 120 LEU H H 120 6.666 6.966 -0.300 1
1 1331 . 24 1 1 A 120 120 LEU HA H 120 3.365 3.376 -0.011 1
1 1341 . 24 1 1 A 120 120 LEU C C 120 179.262 178.483 0.779 1
1 1342 . 24 1 1 A 120 120 LEU CA C 120 56.605 57.359 -0.754 1
1 1343 . 24 1 1 A 120 120 LEU CB C 120 39.262 41.188 -1.926 1
1 1347 . 24 1 1 A 120 120 LEU N N 120 126.226 121.785 4.441 1
1 1348 . 24 1 1 A 121 121 PHE H H 121 7.356 8.359 -1.003 1
1 1349 . 24 1 1 A 121 121 PHE HA H 121 4.459 3.897 0.562 1
1 1352 . 24 1 1 A 121 121 PHE C C 121 179.716 177.484 2.232 1
1 1353 . 24 1 1 A 121 121 PHE CA C 121 62.838 62.045 0.793 1
1 1354 . 24 1 1 A 121 121 PHE CB C 121 37.603 39.260 -1.657 1
1 1355 . 24 1 1 A 121 121 PHE N N 121 117.437 119.259 -1.822 1
1 1356 . 24 1 1 A 122 122 ALA H H 122 7.926 7.737 0.189 1
1 1357 . 24 1 1 A 122 122 ALA HA H 122 4.523 3.849 0.674 1
1 1361 . 24 1 1 A 122 122 ALA C C 122 180.435 179.925 0.510 1
1 1362 . 24 1 1 A 122 122 ALA CA C 122 55.527 55.222 0.305 1
1 1363 . 24 1 1 A 122 122 ALA CB C 122 17.814 17.934 -0.120 1
1 1364 . 24 1 1 A 122 122 ALA N N 122 121.068 121.006 0.062 1
1 1365 . 24 1 1 A 123 123 GLN H H 123 7.507 7.818 -0.311 1
1 1366 . 24 1 1 A 123 123 GLN HA H 123 4.153 3.927 0.226 1
1 1371 . 24 1 1 A 123 123 GLN C C 123 180.561 178.576 1.985 1
1 1372 . 24 1 1 A 123 123 GLN CA C 123 59.948 59.096 0.852 1
1 1373 . 24 1 1 A 123 123 GLN CB C 123 29.135 28.307 0.828 1
1 1375 . 24 1 1 A 123 123 GLN N N 123 120.324 116.787 3.537 1
1 1376 . 24 1 1 A 124 124 ILE H H 124 8.318 7.964 0.354 1
1 1377 . 24 1 1 A 124 124 ILE HA H 124 3.635 3.455 0.180 1
1 1387 . 24 1 1 A 124 124 ILE C C 124 176.481 177.722 -1.241 1
1 1388 . 24 1 1 A 124 124 ILE CA C 124 66.432 65.183 1.249 1
1 1389 . 24 1 1 A 124 124 ILE CB C 124 39.168 37.615 1.553 1
1 1393 . 24 1 1 A 124 124 ILE N N 124 123.747 120.783 2.964 1
1 1394 . 24 1 1 A 125 125 GLN H H 125 8.474 8.097 0.377 1
1 1395 . 24 1 1 A 125 125 GLN HA H 125 4.264 4.029 0.235 1
1 1402 . 24 1 1 A 125 125 GLN C C 125 178.947 177.944 1.003 1
1 1403 . 24 1 1 A 125 125 GLN CA C 125 59.651 58.560 1.091 1
1 1404 . 24 1 1 A 125 125 GLN CB C 125 28.880 28.494 0.386 1
1 1406 . 24 1 1 A 125 125 GLN N N 125 120.368 120.722 -0.354 1
1 1408 . 24 1 1 A 126 126 ALA H H 126 8.002 7.615 0.387 1
1 1409 . 24 1 1 A 126 126 ALA HA H 126 4.144 4.124 0.020 1
1 1413 . 24 1 1 A 126 126 ALA C C 126 179.316 179.780 -0.464 1
1 1414 . 24 1 1 A 126 126 ALA CA C 126 55.036 54.792 0.244 1
1 1415 . 24 1 1 A 126 126 ALA CB C 126 18.087 18.189 -0.102 1
1 1416 . 24 1 1 A 126 126 ALA N N 126 121.661 121.318 0.343 1
1 1417 . 24 1 1 A 127 127 ALA H H 127 7.823 8.282 -0.459 1
1 1418 . 24 1 1 A 127 127 ALA HA H 127 4.162 4.199 -0.037 1
1 1422 . 24 1 1 A 127 127 ALA C C 127 180.707 179.309 1.398 1
1 1423 . 24 1 1 A 127 127 ALA CA C 127 55.080 54.937 0.143 1
1 1424 . 24 1 1 A 127 127 ALA CB C 127 19.354 18.405 0.949 1
1 1425 . 24 1 1 A 127 127 ALA N N 127 119.853 119.774 0.079 1
1 1426 . 24 1 1 A 128 128 ALA H H 128 8.936 7.741 1.195 1
1 1427 . 24 1 1 A 128 128 ALA HA H 128 3.928 4.303 -0.375 1
1 1431 . 24 1 1 A 128 128 ALA C C 128 181.031 179.476 1.555 1
1 1432 . 24 1 1 A 128 128 ALA CA C 128 55.502 55.083 0.419 1
1 1433 . 24 1 1 A 128 128 ALA CB C 128 16.609 18.112 -1.503 1
1 1434 . 24 1 1 A 128 128 ALA N N 128 121.355 120.669 0.686 1
1 1435 . 24 1 1 A 129 129 THR H H 129 8.543 7.920 0.623 1
1 1436 . 24 1 1 A 129 129 THR HA H 129 4.015 3.947 0.068 1
1 1441 . 24 1 1 A 129 129 THR C C 129 177.332 176.593 0.739 1
1 1442 . 24 1 1 A 129 129 THR CA C 129 65.893 65.088 0.805 1
1 1443 . 24 1 1 A 129 129 THR CB C 129 68.566 68.325 0.241 1
1 1445 . 24 1 1 A 129 129 THR N N 129 112.709 110.720 1.989 1
1 1446 . 24 1 1 A 130 130 LYS H H 130 8.126 7.666 0.460 1
1 1447 . 24 1 1 A 130 130 LYS HA H 130 4.000 4.021 -0.021 1
1 1456 . 24 1 1 A 130 130 LYS C C 130 179.082 178.562 0.520 1
1 1457 . 24 1 1 A 130 130 LYS CA C 130 60.299 59.275 1.024 1
1 1458 . 24 1 1 A 130 130 LYS CB C 130 32.767 32.399 0.368 1
1 1462 . 24 1 1 A 130 130 LYS N N 130 123.879 121.743 2.136 1
1 1463 . 24 1 1 A 131 131 ALA H H 131 7.184 8.035 -0.851 1
1 1464 . 24 1 1 A 131 131 ALA HA H 131 4.005 4.272 -0.267 1
1 1468 . 24 1 1 A 131 131 ALA C C 131 178.482 179.583 -1.101 1
1 1469 . 24 1 1 A 131 131 ALA CA C 131 55.027 55.402 -0.375 1
1 1470 . 24 1 1 A 131 131 ALA CB C 131 18.669 18.964 -0.295 1
1 1471 . 24 1 1 A 131 131 ALA N N 131 118.590 121.344 -2.754 1
1 1472 . 24 1 1 A 132 132 TRP H H 132 7.977 8.661 -0.684 1
1 1473 . 24 1 1 A 132 132 TRP HA H 132 4.001 4.256 -0.255 1
1 1480 . 24 1 1 A 132 132 TRP C C 132 177.332 175.895 1.437 1
1 1481 . 24 1 1 A 132 132 TRP CA C 132 60.431 57.629 2.802 1
1 1482 . 24 1 1 A 132 132 TRP CB C 132 27.786 27.862 -0.076 1
1 1486 . 24 1 1 A 132 132 TRP N N 132 119.168 117.046 2.122 1
1 1488 . 24 1 1 A 133 133 ARG H H 133 8.006 8.062 -0.056 1
1 1489 . 24 1 1 A 133 133 ARG HA H 133 4.027 4.466 -0.439 1
1 1497 . 24 1 1 A 133 133 ARG C C 133 176.664 178.081 -1.417 1
1 1498 . 24 1 1 A 133 133 ARG CA C 133 59.355 57.318 2.037 1
1 1499 . 24 1 1 A 133 133 ARG CB C 133 30.451 32.603 -2.152 1
1 1502 . 24 1 1 A 133 133 ARG N N 133 113.062 120.646 -7.584 1
1 1504 . 24 1 1 A 134 134 LYS H H 134 7.322 7.852 -0.530 1
1 1505 . 24 1 1 A 134 134 LYS HA H 134 4.313 4.280 0.033 1
1 1514 . 24 1 1 A 134 134 LYS C C 134 176.282 176.216 0.066 1
1 1515 . 24 1 1 A 134 134 LYS CA C 134 54.922 56.988 -2.066 1
1 1516 . 24 1 1 A 134 134 LYS CB C 134 32.633 31.890 0.743 1
1 1520 . 24 1 1 A 134 134 LYS N N 134 118.170 116.518 1.652 1
1 1521 . 24 1 1 A 135 135 LEU H H 135 7.440 7.854 -0.414 1
1 1522 . 24 1 1 A 135 135 LEU HA H 135 4.174 4.525 -0.351 1
1 1532 . 24 1 1 A 135 135 LEU CA C 135 54.408 53.061 1.347 1
1 1533 . 24 1 1 A 135 135 LEU CB C 135 40.407 41.101 -0.694 1
1 1537 . 24 1 1 A 135 135 LEU N N 135 123.358 123.564 -0.206 1
1 1538 . 24 1 1 A 136 136 PRO HA H 136 4.437 4.562 -0.125 1
1 1545 . 24 1 1 A 136 136 PRO C C 136 177.106 176.693 0.413 1
1 1546 . 24 1 1 A 136 136 PRO CA C 136 62.889 62.428 0.461 1
1 1547 . 24 1 1 A 136 136 PRO CB C 136 32.192 32.199 -0.007 1
1 1550 . 24 1 1 A 137 137 VAL H H 137 8.219 8.134 0.085 1
1 1551 . 24 1 1 A 137 137 VAL HA H 137 4.077 4.429 -0.352 1
1 1559 . 24 1 1 A 137 137 VAL C C 137 176.305 177.059 -0.754 1
1 1560 . 24 1 1 A 137 137 VAL CA C 137 61.958 61.772 0.186 1
1 1561 . 24 1 1 A 137 137 VAL CB C 137 32.755 33.261 -0.506 1
1 1564 . 24 1 1 A 137 137 VAL N N 137 120.079 118.810 1.269 1
1 1565 . 24 1 1 A 138 138 LYS H H 138 8.444 9.099 -0.655 1
1 1566 . 24 1 1 A 138 138 LYS HA H 138 4.316 4.126 0.190 1
1 1575 . 24 1 1 A 138 138 LYS C C 138 176.790 176.683 0.107 1
1 1576 . 24 1 1 A 138 138 LYS CA C 138 56.792 56.547 0.245 1
1 1577 . 24 1 1 A 138 138 LYS CB C 138 33.205 33.076 0.129 1
1 1581 . 24 1 1 A 138 138 LYS N N 138 126.449 122.078 4.371 1
1 1582 . 24 1 1 A 139 139 GLY H H 139 8.518 9.107 -0.589 1
1 1583 . 24 1 1 A 139 139 GLY HA2 H 139 4.070 4.021 0.049 1
1 1584 . 24 1 1 A 139 139 GLY HA3 H 139 3.897 4.024 -0.127 1
1 1585 . 24 1 1 A 139 139 GLY C C 139 172.874 172.991 -0.117 1
1 1586 . 24 1 1 A 139 139 GLY CA C 139 45.157 45.387 -0.230 1
1 1587 . 24 1 1 A 139 139 GLY N N 139 112.617 107.283 5.334 1
1 6 . 25 1 1 A 2 2 VAL H H 2 8.992 7.495 1.497 1
1 7 . 25 1 1 A 2 2 VAL HA H 2 5.370 4.894 0.476 1
1 15 . 25 1 1 A 2 2 VAL C C 2 174.325 173.873 0.452 1
1 16 . 25 1 1 A 2 2 VAL CA C 2 61.267 60.614 0.653 1
1 17 . 25 1 1 A 2 2 VAL CB C 2 33.890 35.167 -1.277 1
1 20 . 25 1 1 A 2 2 VAL N N 2 126.939 120.554 6.385 1
1 21 . 25 1 1 A 3 3 THR H H 3 8.912 8.754 0.158 1
1 22 . 25 1 1 A 3 3 THR HA H 3 4.505 5.215 -0.710 1
1 27 . 25 1 1 A 3 3 THR C C 3 172.710 172.882 -0.172 1
1 28 . 25 1 1 A 3 3 THR CA C 3 59.689 59.752 -0.063 1
1 29 . 25 1 1 A 3 3 THR CB C 3 72.398 72.151 0.247 1
1 31 . 25 1 1 A 3 3 THR N N 3 118.091 122.451 -4.360 1
1 32 . 25 1 1 A 4 4 GLU H H 4 8.631 9.003 -0.372 1
1 33 . 25 1 1 A 4 4 GLU HA H 4 5.788 4.968 0.820 1
1 38 . 25 1 1 A 4 4 GLU C C 4 175.758 173.861 1.897 1
1 39 . 25 1 1 A 4 4 GLU CA C 4 54.902 54.574 0.328 1
1 40 . 25 1 1 A 4 4 GLU CB C 4 35.097 32.978 2.119 1
1 42 . 25 1 1 A 4 4 GLU N N 4 120.966 124.992 -4.026 1
1 43 . 25 1 1 A 5 5 THR H H 5 9.188 9.178 0.010 1
1 44 . 25 1 1 A 5 5 THR HA H 5 4.739 4.689 0.050 1
1 49 . 25 1 1 A 5 5 THR C C 5 172.757 172.636 0.121 1
1 50 . 25 1 1 A 5 5 THR CA C 5 60.382 59.204 1.178 1
1 51 . 25 1 1 A 5 5 THR CB C 5 71.558 70.663 0.895 1
1 53 . 25 1 1 A 5 5 THR N N 5 119.366 119.235 0.131 1
1 54 . 25 1 1 A 6 6 VAL H H 6 8.476 8.503 -0.027 1
1 55 . 25 1 1 A 6 6 VAL HA H 6 5.026 5.798 -0.772 1
1 63 . 25 1 1 A 6 6 VAL C C 6 176.674 174.382 2.292 1
1 64 . 25 1 1 A 6 6 VAL CA C 6 61.008 60.573 0.435 1
1 65 . 25 1 1 A 6 6 VAL CB C 6 33.861 35.606 -1.745 1
1 68 . 25 1 1 A 6 6 VAL N N 6 121.384 121.290 0.094 1
1 69 . 25 1 1 A 7 7 ASP H H 7 8.848 8.871 -0.023 1
1 70 . 25 1 1 A 7 7 ASP HA H 7 4.797 4.946 -0.149 1
1 73 . 25 1 1 A 7 7 ASP CA C 7 52.834 53.359 -0.525 1
1 74 . 25 1 1 A 7 7 ASP CB C 7 42.219 42.873 -0.654 1
1 75 . 25 1 1 A 7 7 ASP N N 7 127.061 127.306 -0.245 1
1 76 . 25 1 1 A 8 8 GLY C C 8 175.143 173.854 1.289 1
1 77 . 25 1 1 A 8 8 GLY CA C 8 46.553 47.105 -0.552 1
1 78 . 25 1 1 A 9 9 GLN H H 9 8.408 8.189 0.219 1
1 79 . 25 1 1 A 9 9 GLN HA H 9 4.541 4.568 -0.027 1
1 86 . 25 1 1 A 9 9 GLN C C 9 176.463 174.798 1.665 1
1 87 . 25 1 1 A 9 9 GLN CA C 9 55.167 55.139 0.028 1
1 88 . 25 1 1 A 9 9 GLN CB C 9 29.376 28.670 0.706 1
1 90 . 25 1 1 A 9 9 GLN N N 9 118.300 117.426 0.874 1
1 92 . 25 1 1 A 10 10 GLY H H 10 8.162 8.326 -0.164 1
1 93 . 25 1 1 A 10 10 GLY HA2 H 10 4.174 4.148 0.026 1
1 94 . 25 1 1 A 10 10 GLY HA3 H 10 3.521 4.166 -0.645 1
1 95 . 25 1 1 A 10 10 GLY C C 10 174.092 174.279 -0.187 1
1 96 . 25 1 1 A 10 10 GLY CA C 10 45.558 45.832 -0.274 1
1 97 . 25 1 1 A 10 10 GLY N N 10 108.747 107.709 1.038 1
1 98 . 25 1 1 A 11 11 GLN H H 11 8.507 7.785 0.722 1
1 99 . 25 1 1 A 11 11 GLN HA H 11 4.202 5.017 -0.815 1
1 106 . 25 1 1 A 11 11 GLN C C 11 173.992 174.579 -0.587 1
1 107 . 25 1 1 A 11 11 GLN CA C 11 55.098 54.929 0.169 1
1 108 . 25 1 1 A 11 11 GLN CB C 11 29.097 30.930 -1.833 1
1 110 . 25 1 1 A 11 11 GLN N N 11 122.979 117.649 5.330 1
1 112 . 25 1 1 A 12 12 ALA H H 12 8.259 8.851 -0.592 1
1 113 . 25 1 1 A 12 12 ALA HA H 12 5.156 5.976 -0.820 1
1 117 . 25 1 1 A 12 12 ALA C C 12 177.284 176.508 0.776 1
1 118 . 25 1 1 A 12 12 ALA CA C 12 51.087 50.605 0.482 1
1 119 . 25 1 1 A 12 12 ALA CB C 12 20.500 20.971 -0.471 1
1 120 . 25 1 1 A 12 12 ALA N N 12 127.100 125.124 1.976 1
1 121 . 25 1 1 A 13 13 TRP H H 13 9.245 8.587 0.658 1
1 122 . 25 1 1 A 13 13 TRP HA H 13 4.717 5.462 -0.745 1
1 131 . 25 1 1 A 13 13 TRP C C 13 175.108 174.280 0.828 1
1 132 . 25 1 1 A 13 13 TRP CA C 13 55.966 55.494 0.472 1
1 133 . 25 1 1 A 13 13 TRP CB C 13 31.912 32.703 -0.791 1
1 139 . 25 1 1 A 13 13 TRP N N 13 123.088 119.669 3.419 1
1 141 . 25 1 1 A 14 14 ARG H H 14 8.575 8.760 -0.185 1
1 142 . 25 1 1 A 14 14 ARG HA H 14 5.335 4.504 0.831 1
1 150 . 25 1 1 A 14 14 ARG C C 14 175.191 174.034 1.157 1
1 151 . 25 1 1 A 14 14 ARG CA C 14 53.106 55.185 -2.079 1
1 152 . 25 1 1 A 14 14 ARG CB C 14 32.749 31.351 1.398 1
1 154 . 25 1 1 A 14 14 ARG N N 14 121.163 120.834 0.329 1
1 156 . 25 1 1 A 15 15 HIS H H 15 8.595 7.996 0.599 1
1 157 . 25 1 1 A 15 15 HIS HA H 15 4.790 4.930 -0.140 1
1 161 . 25 1 1 A 15 15 HIS C C 15 173.770 174.074 -0.304 1
1 162 . 25 1 1 A 15 15 HIS CA C 15 55.289 54.721 0.568 1
1 163 . 25 1 1 A 15 15 HIS CB C 15 33.208 33.683 -0.475 1
1 165 . 25 1 1 A 15 15 HIS N N 15 117.643 118.007 -0.364 1
1 166 . 25 1 1 A 16 16 HIS H H 16 8.993 8.766 0.227 1
1 167 . 25 1 1 A 16 16 HIS HA H 16 5.158 5.026 0.132 1
1 171 . 25 1 1 A 16 16 HIS C C 16 173.608 175.034 -1.426 1
1 172 . 25 1 1 A 16 16 HIS CA C 16 56.450 55.667 0.783 1
1 173 . 25 1 1 A 16 16 HIS CB C 16 34.171 30.789 3.382 1
1 175 . 25 1 1 A 16 16 HIS N N 16 123.520 118.773 4.747 1
1 176 . 25 1 1 A 17 17 ASN H H 17 7.829 9.100 -1.271 1
1 177 . 25 1 1 A 17 17 ASN HA H 17 4.713 4.753 -0.040 1
1 182 . 25 1 1 A 17 17 ASN C C 17 173.682 174.200 -0.518 1
1 183 . 25 1 1 A 17 17 ASN CA C 17 51.822 52.523 -0.701 1
1 184 . 25 1 1 A 17 17 ASN CB C 17 43.176 41.389 1.787 1
1 185 . 25 1 1 A 17 17 ASN N N 17 122.213 120.462 1.751 1
1 187 . 25 1 1 A 18 18 GLY H H 18 8.423 8.318 0.105 1
1 188 . 25 1 1 A 18 18 GLY HA2 H 18 3.931 3.923 0.008 1
1 189 . 25 1 1 A 18 18 GLY HA3 H 18 3.707 3.987 -0.280 1
1 190 . 25 1 1 A 18 18 GLY C C 18 173.985 172.482 1.503 1
1 191 . 25 1 1 A 18 18 GLY CA C 18 43.949 44.726 -0.777 1
1 192 . 25 1 1 A 18 18 GLY N N 18 106.991 111.785 -4.794 1
1 193 . 25 1 1 A 19 19 PHE H H 19 8.338 8.544 -0.206 1
1 194 . 25 1 1 A 19 19 PHE HA H 19 4.068 5.347 -1.279 1
1 197 . 25 1 1 A 19 19 PHE C C 19 176.568 174.304 2.264 1
1 198 . 25 1 1 A 19 19 PHE CA C 19 59.338 56.398 2.940 1
1 199 . 25 1 1 A 19 19 PHE CB C 19 40.201 43.688 -3.487 1
1 200 . 25 1 1 A 19 19 PHE N N 19 116.857 120.264 -3.407 1
1 201 . 25 1 1 A 20 20 ASP H H 20 8.794 9.090 -0.296 1
1 202 . 25 1 1 A 20 20 ASP HA H 20 4.485 5.082 -0.597 1
1 205 . 25 1 1 A 20 20 ASP C C 20 177.379 176.455 0.924 1
1 206 . 25 1 1 A 20 20 ASP CA C 20 54.140 53.559 0.581 1
1 207 . 25 1 1 A 20 20 ASP CB C 20 41.915 40.056 1.859 1
1 208 . 25 1 1 A 20 20 ASP N N 20 123.025 124.153 -1.128 1
1 209 . 25 1 1 A 21 21 PHE H H 21 8.862 8.138 0.724 1
1 210 . 25 1 1 A 21 21 PHE HA H 21 4.087 4.210 -0.123 1
1 218 . 25 1 1 A 21 21 PHE C C 21 176.952 177.442 -0.490 1
1 219 . 25 1 1 A 21 21 PHE CA C 21 61.095 61.411 -0.316 1
1 220 . 25 1 1 A 21 21 PHE CB C 21 38.678 39.042 -0.364 1
1 226 . 25 1 1 A 21 21 PHE N N 21 127.163 120.919 6.244 1
1 227 . 25 1 1 A 22 22 ALA H H 22 8.561 8.462 0.099 1
1 228 . 25 1 1 A 22 22 ALA HA H 22 3.878 3.954 -0.076 1
1 232 . 25 1 1 A 22 22 ALA C C 22 180.710 180.177 0.533 1
1 233 . 25 1 1 A 22 22 ALA CA C 22 55.211 55.158 0.053 1
1 234 . 25 1 1 A 22 22 ALA CB C 22 18.321 18.214 0.107 1
1 235 . 25 1 1 A 22 22 ALA N N 22 120.293 121.296 -1.003 1
1 236 . 25 1 1 A 23 23 VAL H H 23 7.241 7.897 -0.656 1
1 237 . 25 1 1 A 23 23 VAL HA H 23 3.684 3.533 0.151 1
1 245 . 25 1 1 A 23 23 VAL C C 23 177.101 178.186 -1.085 1
1 246 . 25 1 1 A 23 23 VAL CA C 23 65.237 67.006 -1.769 1
1 247 . 25 1 1 A 23 23 VAL CB C 23 31.780 31.675 0.105 1
1 250 . 25 1 1 A 23 23 VAL N N 23 118.775 118.145 0.630 1
1 251 . 25 1 1 A 24 24 ILE H H 24 6.761 8.237 -1.476 1
1 252 . 25 1 1 A 24 24 ILE HA H 24 3.196 3.618 -0.422 1
1 262 . 25 1 1 A 24 24 ILE C C 24 177.287 178.584 -1.297 1
1 263 . 25 1 1 A 24 24 ILE CA C 24 63.404 65.497 -2.093 1
1 264 . 25 1 1 A 24 24 ILE CB C 24 36.294 37.407 -1.113 1
1 268 . 25 1 1 A 24 24 ILE N N 24 119.036 119.155 -0.119 1
1 269 . 25 1 1 A 25 25 LYS H H 25 8.032 7.947 0.085 1
1 270 . 25 1 1 A 25 25 LYS HA H 25 3.809 3.776 0.033 1
1 279 . 25 1 1 A 25 25 LYS C C 25 179.450 179.173 0.277 1
1 280 . 25 1 1 A 25 25 LYS CA C 25 59.621 59.553 0.068 1
1 281 . 25 1 1 A 25 25 LYS CB C 25 32.259 31.958 0.301 1
1 285 . 25 1 1 A 25 25 LYS N N 25 118.368 121.067 -2.699 1
1 286 . 25 1 1 A 26 26 GLU H H 26 7.845 8.410 -0.565 1
1 287 . 25 1 1 A 26 26 GLU HA H 26 4.021 4.097 -0.076 1
1 292 . 25 1 1 A 26 26 GLU C C 26 179.191 179.423 -0.232 1
1 293 . 25 1 1 A 26 26 GLU CA C 26 59.530 59.536 -0.006 1
1 294 . 25 1 1 A 26 26 GLU CB C 26 29.449 29.041 0.408 1
1 296 . 25 1 1 A 26 26 GLU N N 26 120.522 118.750 1.772 1
1 297 . 25 1 1 A 27 27 LEU H H 27 8.165 8.387 -0.222 1
1 298 . 25 1 1 A 27 27 LEU HA H 27 4.163 4.189 -0.026 1
1 308 . 25 1 1 A 27 27 LEU C C 27 177.256 178.328 -1.072 1
1 309 . 25 1 1 A 27 27 LEU CA C 27 58.049 57.639 0.410 1
1 310 . 25 1 1 A 27 27 LEU CB C 27 41.365 41.509 -0.144 1
1 314 . 25 1 1 A 27 27 LEU N N 27 120.879 122.448 -1.569 1
1 315 . 25 1 1 A 28 28 LYS H H 28 8.902 7.733 1.169 1
1 316 . 25 1 1 A 28 28 LYS HA H 28 4.199 4.267 -0.068 1
1 317 . 25 1 1 A 28 28 LYS C C 28 179.707 179.198 0.509 1
1 318 . 25 1 1 A 28 28 LYS CA C 28 60.097 59.135 0.962 1
1 319 . 25 1 1 A 28 28 LYS CB C 28 33.420 31.754 1.666 1
1 320 . 25 1 1 A 28 28 LYS N N 28 120.050 119.475 0.575 1
1 321 . 25 1 1 A 29 29 THR H H 29 8.294 7.898 0.396 1
1 322 . 25 1 1 A 29 29 THR HA H 29 3.892 3.923 -0.031 1
1 327 . 25 1 1 A 29 29 THR C C 29 175.711 176.787 -1.076 1
1 328 . 25 1 1 A 29 29 THR CA C 29 66.846 66.665 0.181 1
1 329 . 25 1 1 A 29 29 THR CB C 29 68.794 68.577 0.217 1
1 331 . 25 1 1 A 29 29 THR N N 29 115.933 116.856 -0.923 1
1 332 . 25 1 1 A 30 30 ALA H H 30 8.244 8.895 -0.651 1
1 333 . 25 1 1 A 30 30 ALA HA H 30 4.241 4.244 -0.003 1
1 337 . 25 1 1 A 30 30 ALA C C 30 179.128 179.763 -0.635 1
1 338 . 25 1 1 A 30 30 ALA CA C 30 55.714 55.666 0.048 1
1 339 . 25 1 1 A 30 30 ALA CB C 30 18.955 18.311 0.644 1
1 340 . 25 1 1 A 30 30 ALA N N 30 124.617 123.259 1.358 1
1 341 . 25 1 1 A 31 31 ALA H H 31 8.968 8.548 0.420 1
1 342 . 25 1 1 A 31 31 ALA HA H 31 3.890 4.078 -0.188 1
1 346 . 25 1 1 A 31 31 ALA C C 31 180.352 179.689 0.663 1
1 347 . 25 1 1 A 31 31 ALA CA C 31 55.454 55.336 0.118 1
1 348 . 25 1 1 A 31 31 ALA CB C 31 17.124 18.302 -1.178 1
1 349 . 25 1 1 A 31 31 ALA N N 31 119.327 120.151 -0.824 1
1 350 . 25 1 1 A 32 32 SER H H 32 7.995 7.739 0.256 1
1 351 . 25 1 1 A 32 32 SER HA H 32 4.238 4.289 -0.051 1
1 354 . 25 1 1 A 32 32 SER C C 32 175.612 176.170 -0.558 1
1 355 . 25 1 1 A 32 32 SER CA C 32 61.203 61.547 -0.344 1
1 356 . 25 1 1 A 32 32 SER CB C 32 63.406 63.425 -0.019 1
1 357 . 25 1 1 A 32 32 SER N N 32 111.962 114.292 -2.330 1
1 358 . 25 1 1 A 33 33 GLN H H 33 8.333 7.538 0.795 1
1 359 . 25 1 1 A 33 33 GLN HA H 33 3.992 4.122 -0.130 1
1 366 . 25 1 1 A 33 33 GLN C C 33 177.486 177.326 0.160 1
1 367 . 25 1 1 A 33 33 GLN CA C 33 58.277 58.178 0.099 1
1 368 . 25 1 1 A 33 33 GLN CB C 33 29.140 29.408 -0.268 1
1 370 . 25 1 1 A 33 33 GLN N N 33 119.527 120.596 -1.069 1
1 372 . 25 1 1 A 34 34 TYR H H 34 8.587 8.229 0.358 1
1 373 . 25 1 1 A 34 34 TYR HA H 34 4.792 4.485 0.307 1
1 380 . 25 1 1 A 34 34 TYR C C 34 176.499 176.678 -0.179 1
1 381 . 25 1 1 A 34 34 TYR CA C 34 57.711 59.806 -2.095 1
1 382 . 25 1 1 A 34 34 TYR CB C 34 39.561 39.440 0.121 1
1 387 . 25 1 1 A 34 34 TYR N N 34 114.610 116.217 -1.607 1
1 388 . 25 1 1 A 35 35 GLY H H 35 7.346 8.630 -1.284 1
1 389 . 25 1 1 A 35 35 GLY HA2 H 35 4.785 4.114 0.671 1
1 390 . 25 1 1 A 35 35 GLY HA3 H 35 4.007 4.127 -0.120 1
1 391 . 25 1 1 A 35 35 GLY C C 35 175.796 173.598 2.198 1
1 392 . 25 1 1 A 35 35 GLY CA C 35 44.355 45.214 -0.859 1
1 393 . 25 1 1 A 35 35 GLY N N 35 108.501 107.181 1.320 1
1 394 . 25 1 1 A 36 36 ALA H H 36 9.363 8.298 1.065 1
1 395 . 25 1 1 A 36 36 ALA HA H 36 4.217 4.560 -0.343 1
1 399 . 25 1 1 A 36 36 ALA C C 36 178.039 178.309 -0.270 1
1 400 . 25 1 1 A 36 36 ALA CA C 36 56.114 51.559 4.555 1
1 401 . 25 1 1 A 36 36 ALA CB C 36 19.179 20.071 -0.892 1
1 402 . 25 1 1 A 36 36 ALA N N 36 125.811 125.428 0.383 1
1 403 . 25 1 1 A 37 37 THR H H 37 8.070 8.800 -0.730 1
1 404 . 25 1 1 A 37 37 THR HA H 37 4.570 4.162 0.408 1
1 409 . 25 1 1 A 37 37 THR C C 37 173.685 173.288 0.397 1
1 410 . 25 1 1 A 37 37 THR CA C 37 59.822 63.655 -3.833 1
1 411 . 25 1 1 A 37 37 THR CB C 37 68.267 66.764 1.503 1
1 413 . 25 1 1 A 37 37 THR N N 37 129.410 115.850 13.560 1
1 414 . 25 1 1 A 38 38 ALA H H 38 6.853 7.793 -0.940 1
1 415 . 25 1 1 A 38 38 ALA HA H 38 4.601 4.669 -0.068 1
1 419 . 25 1 1 A 38 38 ALA CA C 38 50.758 49.099 1.659 1
1 420 . 25 1 1 A 38 38 ALA CB C 38 18.325 20.310 -1.985 1
1 421 . 25 1 1 A 38 38 ALA N N 38 124.674 124.973 -0.299 1
1 422 . 25 1 1 A 40 40 TYR HA H 40 4.032 3.951 0.081 1
1 429 . 25 1 1 A 40 40 TYR C C 40 176.456 177.087 -0.631 1
1 430 . 25 1 1 A 40 40 TYR CA C 40 61.010 61.686 -0.676 1
1 431 . 25 1 1 A 40 40 TYR CB C 40 39.286 38.372 0.914 1
1 436 . 25 1 1 A 41 41 THR H H 41 6.874 8.187 -1.313 1
1 437 . 25 1 1 A 41 41 THR HA H 41 3.616 3.998 -0.382 1
1 442 . 25 1 1 A 41 41 THR C C 41 176.930 176.131 0.799 1
1 443 . 25 1 1 A 41 41 THR CA C 41 65.557 66.876 -1.319 1
1 444 . 25 1 1 A 41 41 THR CB C 41 68.228 68.484 -0.256 1
1 446 . 25 1 1 A 41 41 THR N N 41 115.143 113.837 1.306 1
1 447 . 25 1 1 A 42 42 LEU H H 42 8.623 7.825 0.798 1
1 448 . 25 1 1 A 42 42 LEU HA H 42 3.708 4.057 -0.349 1
1 458 . 25 1 1 A 42 42 LEU C C 42 178.206 179.255 -1.049 1
1 459 . 25 1 1 A 42 42 LEU CA C 42 57.417 57.049 0.368 1
1 460 . 25 1 1 A 42 42 LEU CB C 42 41.342 41.411 -0.069 1
1 464 . 25 1 1 A 42 42 LEU N N 42 120.418 119.665 0.753 1
1 465 . 25 1 1 A 43 43 ALA H H 43 7.735 7.691 0.044 1
1 466 . 25 1 1 A 43 43 ALA HA H 43 4.020 4.036 -0.016 1
1 470 . 25 1 1 A 43 43 ALA C C 43 180.826 180.061 0.765 1
1 471 . 25 1 1 A 43 43 ALA CA C 43 54.925 54.646 0.279 1
1 472 . 25 1 1 A 43 43 ALA CB C 43 17.506 18.204 -0.698 1
1 473 . 25 1 1 A 43 43 ALA N N 43 120.203 121.917 -1.714 1
1 474 . 25 1 1 A 44 44 ILE H H 44 7.149 7.479 -0.330 1
1 475 . 25 1 1 A 44 44 ILE HA H 44 3.603 3.521 0.082 1
1 485 . 25 1 1 A 44 44 ILE C C 44 178.594 177.974 0.620 1
1 486 . 25 1 1 A 44 44 ILE CA C 44 64.782 64.537 0.245 1
1 487 . 25 1 1 A 44 44 ILE CB C 44 37.472 37.671 -0.199 1
1 491 . 25 1 1 A 44 44 ILE N N 44 118.881 119.846 -0.965 1
1 492 . 25 1 1 A 45 45 VAL H H 45 7.968 7.584 0.384 1
1 493 . 25 1 1 A 45 45 VAL HA H 45 2.925 3.379 -0.454 1
1 501 . 25 1 1 A 45 45 VAL C C 45 177.023 178.027 -1.004 1
1 502 . 25 1 1 A 45 45 VAL CA C 45 67.081 67.081 0.000 1
1 503 . 25 1 1 A 45 45 VAL CB C 45 30.854 31.328 -0.474 1
1 506 . 25 1 1 A 45 45 VAL N N 45 120.764 119.846 0.918 1
1 507 . 25 1 1 A 46 46 GLU H H 46 8.399 8.261 0.138 1
1 508 . 25 1 1 A 46 46 GLU HA H 46 3.848 3.977 -0.129 1
1 513 . 25 1 1 A 46 46 GLU C C 46 178.656 178.441 0.215 1
1 514 . 25 1 1 A 46 46 GLU CA C 46 59.491 58.598 0.893 1
1 515 . 25 1 1 A 46 46 GLU CB C 46 28.991 27.811 1.180 1
1 517 . 25 1 1 A 46 46 GLU N N 46 116.599 119.558 -2.959 1
1 518 . 25 1 1 A 47 47 SER H H 47 7.273 7.483 -0.210 1
1 519 . 25 1 1 A 47 47 SER HA H 47 4.287 4.208 0.079 1
1 521 . 25 1 1 A 47 47 SER CA C 47 61.047 61.136 -0.089 1
1 522 . 25 1 1 A 47 47 SER CB C 47 63.016 62.717 0.299 1
1 523 . 25 1 1 A 47 47 SER N N 47 113.609 116.293 -2.684 1
1 524 . 25 1 1 A 48 48 VAL H H 48 8.006 8.201 -0.195 1
1 525 . 25 1 1 A 48 48 VAL HA H 48 3.556 3.601 -0.045 1
1 533 . 25 1 1 A 48 48 VAL C C 48 177.257 176.466 0.791 1
1 534 . 25 1 1 A 48 48 VAL CA C 48 65.025 66.332 -1.307 1
1 535 . 25 1 1 A 48 48 VAL CB C 48 31.841 31.373 0.468 1
1 538 . 25 1 1 A 48 48 VAL N N 48 122.327 121.354 0.973 1
1 539 . 25 1 1 A 49 49 ALA H H 49 8.369 7.733 0.636 1
1 540 . 25 1 1 A 49 49 ALA HA H 49 4.115 4.257 -0.142 1
1 544 . 25 1 1 A 49 49 ALA C C 49 177.307 177.070 0.237 1
1 545 . 25 1 1 A 49 49 ALA CA C 49 53.253 52.542 0.711 1
1 546 . 25 1 1 A 49 49 ALA CB C 49 20.131 18.250 1.881 1
1 547 . 25 1 1 A 49 49 ALA N N 49 118.050 120.479 -2.429 1
1 548 . 25 1 1 A 50 50 ASP H H 50 7.052 7.856 -0.804 1
1 549 . 25 1 1 A 50 50 ASP HA H 50 4.788 4.738 0.050 1
1 552 . 25 1 1 A 50 50 ASP C C 50 175.481 175.914 -0.433 1
1 553 . 25 1 1 A 50 50 ASP CA C 50 53.681 54.212 -0.531 1
1 554 . 25 1 1 A 50 50 ASP CB C 50 39.333 41.447 -2.114 1
1 555 . 25 1 1 A 50 50 ASP N N 50 116.997 117.428 -0.431 1
1 556 . 25 1 1 A 51 51 ASN H H 51 8.535 7.299 1.236 1
1 557 . 25 1 1 A 51 51 ASN HA H 51 4.628 4.964 -0.336 1
1 562 . 25 1 1 A 51 51 ASN C C 51 174.077 174.682 -0.605 1
1 563 . 25 1 1 A 51 51 ASN CA C 51 52.315 51.088 1.227 1
1 564 . 25 1 1 A 51 51 ASN CB C 51 41.928 40.620 1.308 1
1 565 . 25 1 1 A 51 51 ASN N N 51 118.626 115.315 3.311 1
1 567 . 25 1 1 A 52 52 TRP H H 52 8.555 8.580 -0.025 1
1 574 . 25 1 1 A 52 52 TRP C C 52 173.269 176.381 -3.112 1
1 575 . 25 1 1 A 52 52 TRP CA C 52 55.031 57.300 -2.269 1
1 576 . 25 1 1 A 52 52 TRP CB C 52 26.801 29.925 -3.124 1
1 582 . 25 1 1 A 52 52 TRP N N 52 120.693 121.655 -0.962 1
1 584 . 25 1 1 A 53 53 LEU H H 53 7.847 8.710 -0.863 1
1 585 . 25 1 1 A 53 53 LEU HA H 53 4.859 4.964 -0.105 1
1 595 . 25 1 1 A 53 53 LEU C C 53 177.397 175.351 2.046 1
1 596 . 25 1 1 A 53 53 LEU CA C 53 53.619 53.087 0.532 1
1 597 . 25 1 1 A 53 53 LEU CB C 53 41.812 45.879 -4.067 1
1 601 . 25 1 1 A 53 53 LEU N N 53 124.741 120.533 4.208 1
1 602 . 25 1 1 A 54 54 THR H H 54 8.850 8.782 0.068 1
1 603 . 25 1 1 A 54 54 THR HA H 54 4.598 5.169 -0.571 1
1 608 . 25 1 1 A 54 54 THR CA C 54 60.531 59.382 1.149 1
1 609 . 25 1 1 A 54 54 THR CB C 54 67.183 69.278 -2.095 1
1 611 . 25 1 1 A 54 54 THR N N 54 113.407 110.924 2.483 1
1 612 . 25 1 1 A 55 55 PRO HA H 55 4.511 4.439 0.072 1
1 619 . 25 1 1 A 55 55 PRO C C 55 179.383 178.772 0.611 1
1 620 . 25 1 1 A 55 55 PRO CA C 55 67.159 64.760 2.399 1
1 621 . 25 1 1 A 55 55 PRO CB C 55 32.095 31.824 0.271 1
1 622 . 25 1 1 A 56 56 THR H H 56 8.575 7.786 0.789 1
1 623 . 25 1 1 A 56 56 THR HA H 56 4.229 4.046 0.183 1
1 628 . 25 1 1 A 56 56 THR C C 56 176.668 176.306 0.362 1
1 629 . 25 1 1 A 56 56 THR CA C 56 66.943 65.923 1.020 1
1 630 . 25 1 1 A 56 56 THR CB C 56 68.129 68.059 0.070 1
1 632 . 25 1 1 A 56 56 THR N N 56 114.855 112.210 2.645 1
1 633 . 25 1 1 A 57 57 ASP H H 57 8.730 8.121 0.609 1
1 634 . 25 1 1 A 57 57 ASP HA H 57 4.425 4.421 0.004 1
1 637 . 25 1 1 A 57 57 ASP C C 57 178.351 179.282 -0.931 1
1 638 . 25 1 1 A 57 57 ASP CA C 57 57.963 57.399 0.564 1
1 639 . 25 1 1 A 57 57 ASP CB C 57 40.134 40.690 -0.556 1
1 640 . 25 1 1 A 57 57 ASP N N 57 126.239 120.793 5.446 1
1 641 . 25 1 1 A 58 58 TRP H H 58 8.244 8.495 -0.251 1
1 642 . 25 1 1 A 58 58 TRP HA H 58 4.030 4.324 -0.294 1
1 650 . 25 1 1 A 58 58 TRP C C 58 177.432 179.350 -1.918 1
1 651 . 25 1 1 A 58 58 TRP CA C 58 62.731 59.989 2.742 1
1 652 . 25 1 1 A 58 58 TRP CB C 58 29.122 29.169 -0.047 1
1 657 . 25 1 1 A 58 58 TRP N N 58 119.241 120.585 -1.344 1
1 659 . 25 1 1 A 59 59 ASN H H 59 8.098 9.061 -0.963 1
1 660 . 25 1 1 A 59 59 ASN HA H 59 4.424 4.513 -0.089 1
1 663 . 25 1 1 A 59 59 ASN C C 59 176.952 178.138 -1.186 1
1 664 . 25 1 1 A 59 59 ASN CA C 59 58.135 56.224 1.911 1
1 665 . 25 1 1 A 59 59 ASN CB C 59 40.168 38.057 2.111 1
1 666 . 25 1 1 A 59 59 ASN N N 59 115.747 118.071 -2.324 1
1 667 . 25 1 1 A 60 60 THR H H 60 8.712 7.915 0.797 1
1 668 . 25 1 1 A 60 60 THR HA H 60 3.717 4.165 -0.448 1
1 673 . 25 1 1 A 60 60 THR C C 60 176.044 177.222 -1.178 1
1 674 . 25 1 1 A 60 60 THR CA C 60 66.576 66.573 0.003 1
1 675 . 25 1 1 A 60 60 THR CB C 60 69.251 68.237 1.014 1
1 677 . 25 1 1 A 60 60 THR N N 60 114.896 118.795 -3.899 1
1 678 . 25 1 1 A 61 61 LEU H H 61 8.485 8.467 0.018 1
1 679 . 25 1 1 A 61 61 LEU HA H 61 3.391 4.022 -0.631 1
1 689 . 25 1 1 A 61 61 LEU C C 61 177.433 178.826 -1.393 1
1 690 . 25 1 1 A 61 61 LEU CA C 61 58.354 58.406 -0.052 1
1 691 . 25 1 1 A 61 61 LEU CB C 61 41.761 41.865 -0.104 1
1 695 . 25 1 1 A 61 61 LEU N N 61 123.433 121.913 1.520 1
1 696 . 25 1 1 A 62 62 VAL H H 62 8.073 8.237 -0.164 1
1 697 . 25 1 1 A 62 62 VAL HA H 62 3.207 3.762 -0.555 1
1 705 . 25 1 1 A 62 62 VAL C C 62 177.585 177.617 -0.032 1
1 706 . 25 1 1 A 62 62 VAL CA C 62 67.345 64.944 2.401 1
1 707 . 25 1 1 A 62 62 VAL CB C 62 30.905 30.738 0.167 1
1 710 . 25 1 1 A 62 62 VAL N N 62 116.018 118.433 -2.415 1
1 711 . 25 1 1 A 63 63 ARG H H 63 7.765 7.866 -0.101 1
1 712 . 25 1 1 A 63 63 ARG HA H 63 3.602 4.053 -0.451 1
1 719 . 25 1 1 A 63 63 ARG C C 63 177.818 178.561 -0.743 1
1 720 . 25 1 1 A 63 63 ARG CA C 63 58.049 59.726 -1.677 1
1 721 . 25 1 1 A 63 63 ARG CB C 63 29.955 30.089 -0.134 1
1 724 . 25 1 1 A 63 63 ARG N N 63 116.700 121.432 -4.732 1
1 725 . 25 1 1 A 64 64 ALA H H 64 7.574 7.893 -0.319 1
1 726 . 25 1 1 A 64 64 ALA HA H 64 4.158 4.389 -0.231 1
1 730 . 25 1 1 A 64 64 ALA C C 64 179.886 179.469 0.417 1
1 731 . 25 1 1 A 64 64 ALA CA C 64 54.007 54.059 -0.052 1
1 732 . 25 1 1 A 64 64 ALA CB C 64 19.147 19.733 -0.586 1
1 733 . 25 1 1 A 64 64 ALA N N 64 117.555 120.406 -2.851 1
1 734 . 25 1 1 A 65 65 VAL H H 65 7.554 8.076 -0.522 1
1 735 . 25 1 1 A 65 65 VAL HA H 65 4.253 3.887 0.366 1
1 743 . 25 1 1 A 65 65 VAL C C 65 174.180 176.045 -1.865 1
1 744 . 25 1 1 A 65 65 VAL CA C 65 62.683 65.313 -2.630 1
1 745 . 25 1 1 A 65 65 VAL CB C 65 33.458 31.609 1.849 1
1 748 . 25 1 1 A 65 65 VAL N N 65 110.013 114.676 -4.663 1
1 749 . 25 1 1 A 66 66 LEU H H 66 7.792 7.475 0.317 1
1 750 . 25 1 1 A 66 66 LEU HA H 66 4.790 4.831 -0.041 1
1 760 . 25 1 1 A 66 66 LEU C C 66 177.537 175.348 2.189 1
1 761 . 25 1 1 A 66 66 LEU CA C 66 52.823 52.800 0.023 1
1 762 . 25 1 1 A 66 66 LEU CB C 66 44.071 45.765 -1.694 1
1 766 . 25 1 1 A 66 66 LEU N N 66 118.967 121.402 -2.435 1
1 767 . 25 1 1 A 67 67 SER H H 67 9.208 8.442 0.766 1
1 768 . 25 1 1 A 67 67 SER HA H 67 4.414 4.893 -0.479 1
1 771 . 25 1 1 A 67 67 SER CA C 67 57.943 57.392 0.551 1
1 772 . 25 1 1 A 67 67 SER CB C 67 64.743 66.689 -1.946 1
1 773 . 25 1 1 A 67 67 SER N N 67 116.378 115.730 0.648 1
1 774 . 25 1 1 A 69 69 GLY HA2 H 69 3.916 3.704 0.212 1
1 775 . 25 1 1 A 69 69 GLY HA3 H 69 3.867 3.743 0.124 1
1 776 . 25 1 1 A 69 69 GLY C C 69 176.783 175.358 1.425 1
1 777 . 25 1 1 A 69 69 GLY CA C 69 46.977 46.991 -0.014 1
1 778 . 25 1 1 A 70 70 ASP H H 70 7.674 8.095 -0.421 1
1 779 . 25 1 1 A 70 70 ASP HA H 70 4.511 3.572 0.939 1
1 782 . 25 1 1 A 70 70 ASP C C 70 178.096 178.225 -0.129 1
1 783 . 25 1 1 A 70 70 ASP CA C 70 57.262 56.400 0.862 1
1 784 . 25 1 1 A 70 70 ASP CB C 70 40.594 39.660 0.934 1
1 785 . 25 1 1 A 70 70 ASP N N 70 123.930 122.229 1.701 1
1 786 . 25 1 1 A 71 71 HIS H H 71 8.729 8.048 0.681 1
1 787 . 25 1 1 A 71 71 HIS HA H 71 4.235 4.247 -0.012 1
1 790 . 25 1 1 A 71 71 HIS C C 71 176.769 177.870 -1.101 1
1 791 . 25 1 1 A 71 71 HIS CA C 71 60.041 58.912 1.129 1
1 792 . 25 1 1 A 71 71 HIS CB C 71 30.682 30.162 0.520 1
1 793 . 25 1 1 A 71 71 HIS N N 71 121.003 117.181 3.822 1
1 794 . 25 1 1 A 72 72 LEU H H 72 7.620 7.945 -0.325 1
1 795 . 25 1 1 A 72 72 LEU HA H 72 3.769 3.937 -0.168 1
1 805 . 25 1 1 A 72 72 LEU C C 72 180.275 179.341 0.934 1
1 806 . 25 1 1 A 72 72 LEU CA C 72 58.192 58.014 0.178 1
1 807 . 25 1 1 A 72 72 LEU CB C 72 41.381 41.237 0.144 1
1 811 . 25 1 1 A 72 72 LEU N N 72 118.569 117.088 1.481 1
1 812 . 25 1 1 A 73 73 LEU H H 73 7.542 7.445 0.097 1
1 813 . 25 1 1 A 73 73 LEU HA H 73 4.107 4.189 -0.082 1
1 823 . 25 1 1 A 73 73 LEU C C 73 179.436 179.200 0.236 1
1 824 . 25 1 1 A 73 73 LEU CA C 73 58.026 57.282 0.744 1
1 825 . 25 1 1 A 73 73 LEU CB C 73 41.638 42.102 -0.464 1
1 829 . 25 1 1 A 73 73 LEU N N 73 121.418 120.908 0.510 1
1 830 . 25 1 1 A 74 74 TRP H H 74 8.786 7.947 0.839 1
1 831 . 25 1 1 A 74 74 TRP HA H 74 3.589 5.397 -1.808 1
1 840 . 25 1 1 A 74 74 TRP C C 74 176.816 178.574 -1.758 1
1 841 . 25 1 1 A 74 74 TRP CA C 74 63.046 59.919 3.127 1
1 842 . 25 1 1 A 74 74 TRP CB C 74 28.065 28.753 -0.688 1
1 848 . 25 1 1 A 74 74 TRP N N 74 121.111 118.058 3.053 1
1 850 . 25 1 1 A 75 75 LYS H H 75 8.939 7.595 1.344 1
1 851 . 25 1 1 A 75 75 LYS HA H 75 3.055 4.026 -0.971 1
1 860 . 25 1 1 A 75 75 LYS C C 75 177.967 179.490 -1.523 1
1 861 . 25 1 1 A 75 75 LYS CA C 75 60.029 58.671 1.358 1
1 862 . 25 1 1 A 75 75 LYS CB C 75 32.533 32.706 -0.173 1
1 866 . 25 1 1 A 75 75 LYS N N 75 119.783 118.550 1.233 1
1 867 . 25 1 1 A 76 76 SER H H 76 7.832 8.107 -0.275 1
1 868 . 25 1 1 A 76 76 SER HA H 76 4.040 4.334 -0.294 1
1 871 . 25 1 1 A 76 76 SER C C 76 177.816 177.119 0.697 1
1 872 . 25 1 1 A 76 76 SER CA C 76 62.105 61.336 0.769 1
1 873 . 25 1 1 A 76 76 SER CB C 76 62.679 62.459 0.220 1
1 874 . 25 1 1 A 76 76 SER N N 76 113.395 114.600 -1.205 1
1 875 . 25 1 1 A 77 77 GLU H H 77 7.590 7.717 -0.127 1
1 876 . 25 1 1 A 77 77 GLU HA H 77 4.042 4.295 -0.253 1
1 881 . 25 1 1 A 77 77 GLU C C 77 177.809 178.489 -0.680 1
1 882 . 25 1 1 A 77 77 GLU CA C 77 58.270 58.592 -0.322 1
1 883 . 25 1 1 A 77 77 GLU CB C 77 29.208 29.323 -0.115 1
1 885 . 25 1 1 A 77 77 GLU N N 77 121.574 122.083 -0.509 1
1 886 . 25 1 1 A 78 78 PHE H H 78 9.081 7.850 1.231 1
1 887 . 25 1 1 A 78 78 PHE HA H 78 3.778 4.109 -0.331 1
1 895 . 25 1 1 A 78 78 PHE C C 78 178.114 177.250 0.864 1
1 896 . 25 1 1 A 78 78 PHE CA C 78 60.629 61.344 -0.715 1
1 897 . 25 1 1 A 78 78 PHE CB C 78 38.295 38.839 -0.544 1
1 902 . 25 1 1 A 78 78 PHE N N 78 122.682 122.563 0.119 1
1 903 . 25 1 1 A 79 79 PHE H H 79 8.890 7.895 0.995 1
1 904 . 25 1 1 A 79 79 PHE HA H 79 3.800 3.941 -0.141 1
1 912 . 25 1 1 A 79 79 PHE C C 79 178.354 178.221 0.133 1
1 913 . 25 1 1 A 79 79 PHE CA C 79 60.704 61.628 -0.924 1
1 914 . 25 1 1 A 79 79 PHE CB C 79 37.184 38.149 -0.965 1
1 920 . 25 1 1 A 79 79 PHE N N 79 121.056 118.108 2.948 1
1 921 . 25 1 1 A 80 80 GLU H H 80 7.793 8.541 -0.748 1
1 922 . 25 1 1 A 80 80 GLU HA H 80 4.082 4.001 0.081 1
1 927 . 25 1 1 A 80 80 GLU C C 80 179.068 178.645 0.423 1
1 928 . 25 1 1 A 80 80 GLU CA C 80 59.735 59.762 -0.027 1
1 929 . 25 1 1 A 80 80 GLU CB C 80 28.722 29.214 -0.492 1
1 931 . 25 1 1 A 80 80 GLU N N 80 120.312 118.636 1.676 1
1 932 . 25 1 1 A 81 81 ASN H H 81 8.624 8.753 -0.129 1
1 933 . 25 1 1 A 81 81 ASN HA H 81 4.521 4.477 0.044 1
1 938 . 25 1 1 A 81 81 ASN C C 81 179.262 177.564 1.698 1
1 939 . 25 1 1 A 81 81 ASN CA C 81 55.504 55.973 -0.469 1
1 940 . 25 1 1 A 81 81 ASN CB C 81 37.517 37.669 -0.152 1
1 941 . 25 1 1 A 81 81 ASN N N 81 119.338 117.070 2.268 1
1 943 . 25 1 1 A 82 82 CYS H H 82 8.554 7.906 0.648 1
1 944 . 25 1 1 A 82 82 CYS HA H 82 3.792 4.016 -0.224 1
1 947 . 25 1 1 A 82 82 CYS C C 82 176.478 176.974 -0.496 1
1 948 . 25 1 1 A 82 82 CYS CA C 82 65.232 63.849 1.383 1
1 949 . 25 1 1 A 82 82 CYS CB C 82 26.762 27.179 -0.417 1
1 950 . 25 1 1 A 82 82 CYS N N 82 120.576 117.483 3.093 1
1 951 . 25 1 1 A 83 83 ARG H H 83 8.522 7.748 0.774 1
1 952 . 25 1 1 A 83 83 ARG HA H 83 3.932 3.894 0.038 1
1 960 . 25 1 1 A 83 83 ARG C C 83 179.138 178.549 0.589 1
1 961 . 25 1 1 A 83 83 ARG CA C 83 60.443 58.783 1.660 1
1 962 . 25 1 1 A 83 83 ARG CB C 83 29.550 29.734 -0.184 1
1 965 . 25 1 1 A 83 83 ARG N N 83 123.035 119.809 3.226 1
1 967 . 25 1 1 A 84 84 ASP H H 84 7.791 8.070 -0.279 1
1 968 . 25 1 1 A 84 84 ASP HA H 84 4.353 4.498 -0.145 1
1 971 . 25 1 1 A 84 84 ASP C C 84 178.649 178.570 0.079 1
1 972 . 25 1 1 A 84 84 ASP CA C 84 57.767 57.384 0.383 1
1 973 . 25 1 1 A 84 84 ASP CB C 84 41.305 41.493 -0.188 1
1 974 . 25 1 1 A 84 84 ASP N N 84 120.332 119.672 0.660 1
1 975 . 25 1 1 A 85 85 THR H H 85 8.370 8.048 0.322 1
1 976 . 25 1 1 A 85 85 THR HA H 85 3.730 3.892 -0.162 1
1 981 . 25 1 1 A 85 85 THR C C 85 175.198 176.218 -1.020 1
1 982 . 25 1 1 A 85 85 THR CA C 85 66.830 66.201 0.629 1
1 983 . 25 1 1 A 85 85 THR CB C 85 68.533 68.421 0.112 1
1 985 . 25 1 1 A 85 85 THR N N 85 117.360 116.029 1.331 1
1 986 . 25 1 1 A 86 86 ALA H H 86 8.845 8.221 0.624 1
1 987 . 25 1 1 A 86 86 ALA HA H 86 3.991 4.080 -0.089 1
1 991 . 25 1 1 A 86 86 ALA C C 86 179.980 179.441 0.539 1
1 992 . 25 1 1 A 86 86 ALA CA C 86 55.769 55.628 0.141 1
1 993 . 25 1 1 A 86 86 ALA CB C 86 17.881 18.451 -0.570 1
1 994 . 25 1 1 A 86 86 ALA N N 86 123.613 123.681 -0.068 1
1 995 . 25 1 1 A 87 87 LYS H H 87 7.686 8.347 -0.661 1
1 996 . 25 1 1 A 87 87 LYS HA H 87 4.099 4.163 -0.064 1
1 1005 . 25 1 1 A 87 87 LYS C C 87 179.592 178.685 0.907 1
1 1006 . 25 1 1 A 87 87 LYS CA C 87 59.708 59.197 0.511 1
1 1007 . 25 1 1 A 87 87 LYS CB C 87 32.054 31.923 0.131 1
1 1011 . 25 1 1 A 87 87 LYS N N 87 119.623 116.686 2.937 1
1 1012 . 25 1 1 A 88 88 ARG H H 88 7.683 7.995 -0.312 1
1 1013 . 25 1 1 A 88 88 ARG HA H 88 4.051 4.176 -0.125 1
1 1020 . 25 1 1 A 88 88 ARG C C 88 180.053 178.663 1.390 1
1 1021 . 25 1 1 A 88 88 ARG CA C 88 59.558 58.914 0.644 1
1 1022 . 25 1 1 A 88 88 ARG CB C 88 29.684 29.771 -0.087 1
1 1025 . 25 1 1 A 88 88 ARG N N 88 120.788 119.519 1.269 1
1 1026 . 25 1 1 A 89 89 ASN H H 89 8.973 8.241 0.732 1
1 1027 . 25 1 1 A 89 89 ASN HA H 89 4.354 4.623 -0.269 1
1 1032 . 25 1 1 A 89 89 ASN C C 89 178.382 178.612 -0.230 1
1 1033 . 25 1 1 A 89 89 ASN CA C 89 55.334 55.955 -0.621 1
1 1034 . 25 1 1 A 89 89 ASN CB C 89 37.864 37.962 -0.098 1
1 1035 . 25 1 1 A 89 89 ASN N N 89 121.012 117.657 3.355 1
1 1037 . 25 1 1 A 90 90 GLN H H 90 8.152 8.032 0.120 1
1 1038 . 25 1 1 A 90 90 GLN HA H 90 4.020 4.169 -0.149 1
1 1045 . 25 1 1 A 90 90 GLN C C 90 179.075 178.851 0.224 1
1 1046 . 25 1 1 A 90 90 GLN CA C 90 59.318 58.963 0.355 1
1 1047 . 25 1 1 A 90 90 GLN CB C 90 28.049 28.415 -0.366 1
1 1049 . 25 1 1 A 90 90 GLN N N 90 122.122 120.778 1.344 1
1 1051 . 25 1 1 A 91 91 GLN H H 91 7.514 8.651 -1.137 1
1 1052 . 25 1 1 A 91 91 GLN HA H 91 4.053 4.069 -0.016 1
1 1059 . 25 1 1 A 91 91 GLN C C 91 177.081 177.997 -0.916 1
1 1060 . 25 1 1 A 91 91 GLN CA C 91 58.031 58.629 -0.598 1
1 1061 . 25 1 1 A 91 91 GLN CB C 91 28.365 28.098 0.267 1
1 1063 . 25 1 1 A 91 91 GLN N N 91 118.124 118.189 -0.065 1
1 1065 . 25 1 1 A 92 92 ALA H H 92 7.704 7.352 0.352 1
1 1066 . 25 1 1 A 92 92 ALA HA H 92 4.246 4.255 -0.009 1
1 1070 . 25 1 1 A 92 92 ALA C C 92 178.450 177.934 0.516 1
1 1071 . 25 1 1 A 92 92 ALA CA C 92 52.671 52.930 -0.259 1
1 1072 . 25 1 1 A 92 92 ALA CB C 92 19.316 19.638 -0.322 1
1 1073 . 25 1 1 A 92 92 ALA N N 92 119.880 118.965 0.915 1
1 1074 . 25 1 1 A 93 93 GLY H H 93 7.693 8.270 -0.577 1
1 1075 . 25 1 1 A 93 93 GLY HA2 H 93 3.941 3.942 -0.001 1
1 1076 . 25 1 1 A 93 93 GLY HA3 H 93 3.744 3.951 -0.207 1
1 1077 . 25 1 1 A 93 93 GLY C C 93 174.344 174.580 -0.236 1
1 1078 . 25 1 1 A 93 93 GLY CA C 93 45.949 46.352 -0.403 1
1 1079 . 25 1 1 A 93 93 GLY N N 93 105.347 107.141 -1.794 1
1 1080 . 25 1 1 A 94 94 ASN H H 94 7.076 8.427 -1.351 1
1 1081 . 25 1 1 A 94 94 ASN HA H 94 4.115 4.850 -0.735 1
1 1085 . 25 1 1 A 94 94 ASN C C 94 175.410 175.801 -0.391 1
1 1086 . 25 1 1 A 94 94 ASN CA C 94 52.651 52.507 0.144 1
1 1087 . 25 1 1 A 94 94 ASN CB C 94 38.330 39.885 -1.555 1
1 1088 . 25 1 1 A 94 94 ASN N N 94 115.747 117.911 -2.164 1
1 1090 . 25 1 1 A 95 95 GLY H H 95 8.236 8.111 0.125 1
1 1091 . 25 1 1 A 95 95 GLY HA2 H 95 3.633 3.587 0.046 1
1 1092 . 25 1 1 A 95 95 GLY HA3 H 95 3.633 3.766 -0.133 1
1 1093 . 25 1 1 A 95 95 GLY C C 95 174.450 174.148 0.302 1
1 1094 . 25 1 1 A 95 95 GLY CA C 95 45.522 45.433 0.089 1
1 1095 . 25 1 1 A 95 95 GLY N N 95 109.166 109.150 0.016 1
1 1096 . 25 1 1 A 96 96 TRP H H 96 7.899 7.387 0.512 1
1 1097 . 25 1 1 A 96 96 TRP HA H 96 5.241 4.781 0.460 1
1 1106 . 25 1 1 A 96 96 TRP C C 96 175.661 175.427 0.234 1
1 1107 . 25 1 1 A 96 96 TRP CA C 96 55.090 57.842 -2.752 1
1 1108 . 25 1 1 A 96 96 TRP CB C 96 27.138 31.206 -4.068 1
1 1114 . 25 1 1 A 96 96 TRP N N 96 122.840 121.610 1.230 1
1 1116 . 25 1 1 A 97 97 ASP H H 97 7.344 8.749 -1.405 1
1 1117 . 25 1 1 A 97 97 ASP HA H 97 4.829 5.303 -0.474 1
1 1120 . 25 1 1 A 97 97 ASP C C 97 175.019 176.516 -1.497 1
1 1121 . 25 1 1 A 97 97 ASP CA C 97 52.149 52.745 -0.596 1
1 1122 . 25 1 1 A 97 97 ASP CB C 97 42.697 43.958 -1.261 1
1 1123 . 25 1 1 A 97 97 ASP N N 97 126.861 123.029 3.832 1
1 1124 . 25 1 1 A 98 98 PHE H H 98 8.566 9.263 -0.697 1
1 1125 . 25 1 1 A 98 98 PHE HA H 98 3.727 4.108 -0.381 1
1 1133 . 25 1 1 A 98 98 PHE C C 98 177.443 177.372 0.071 1
1 1134 . 25 1 1 A 98 98 PHE CA C 98 62.471 61.880 0.591 1
1 1135 . 25 1 1 A 98 98 PHE CB C 98 39.919 39.445 0.474 1
1 1141 . 25 1 1 A 98 98 PHE N N 98 117.781 126.398 -8.617 1
1 1142 . 25 1 1 A 99 99 ASP H H 99 8.259 9.066 -0.807 1
1 1143 . 25 1 1 A 99 99 ASP HA H 99 3.960 4.426 -0.466 1
1 1146 . 25 1 1 A 99 99 ASP C C 99 178.132 178.539 -0.407 1
1 1147 . 25 1 1 A 99 99 ASP CA C 99 57.658 57.153 0.505 1
1 1148 . 25 1 1 A 99 99 ASP CB C 99 38.572 41.040 -2.468 1
1 1149 . 25 1 1 A 99 99 ASP N N 99 121.709 119.186 2.523 1
1 1150 . 25 1 1 A 100 100 MET H H 100 8.008 8.159 -0.151 1
1 1151 . 25 1 1 A 100 100 MET HA H 100 3.644 4.153 -0.509 1
1 1156 . 25 1 1 A 100 100 MET C C 100 180.008 177.088 2.920 1
1 1157 . 25 1 1 A 100 100 MET CA C 100 58.598 58.490 0.108 1
1 1158 . 25 1 1 A 100 100 MET CB C 100 33.423 32.785 0.638 1
1 1160 . 25 1 1 A 100 100 MET N N 100 119.668 117.876 1.792 1
1 1161 . 25 1 1 A 101 101 LEU H H 101 7.961 8.434 -0.473 1
1 1162 . 25 1 1 A 101 101 LEU HA H 101 3.523 4.298 -0.775 1
1 1172 . 25 1 1 A 101 101 LEU C C 101 173.873 176.531 -2.658 1
1 1173 . 25 1 1 A 101 101 LEU CA C 101 58.743 54.193 4.550 1
1 1174 . 25 1 1 A 101 101 LEU CB C 101 42.632 41.266 1.366 1
1 1178 . 25 1 1 A 101 101 LEU N N 101 119.752 119.524 0.228 1
1 1179 . 25 1 1 A 102 102 THR H H 102 6.955 8.143 -1.188 1
1 1180 . 25 1 1 A 102 102 THR HA H 102 4.134 4.254 -0.120 1
1 1185 . 25 1 1 A 102 102 THR C C 102 176.513 175.310 1.203 1
1 1186 . 25 1 1 A 102 102 THR CA C 102 61.125 62.457 -1.332 1
1 1187 . 25 1 1 A 102 102 THR CB C 102 71.415 70.433 0.982 1
1 1189 . 25 1 1 A 102 102 THR N N 102 124.665 116.183 8.482 1
1 1190 . 25 1 1 A 103 103 GLY H H 103 7.816 8.085 -0.269 1
1 1191 . 25 1 1 A 103 103 GLY HA2 H 103 3.824 3.994 -0.170 1
1 1192 . 25 1 1 A 103 103 GLY HA3 H 103 3.824 4.063 -0.239 1
1 1193 . 25 1 1 A 103 103 GLY C C 103 174.126 175.170 -1.044 1
1 1194 . 25 1 1 A 103 103 GLY CA C 103 47.805 46.722 1.083 1
1 1195 . 25 1 1 A 103 103 GLY N N 103 114.191 112.258 1.933 1
1 1196 . 25 1 1 A 104 104 SER H H 104 8.860 8.440 0.420 1
1 1197 . 25 1 1 A 104 104 SER HA H 104 4.758 4.563 0.195 1
1 1200 . 25 1 1 A 104 104 SER C C 104 174.591 175.004 -0.413 1
1 1201 . 25 1 1 A 104 104 SER CA C 104 56.755 59.330 -2.575 1
1 1202 . 25 1 1 A 104 104 SER CB C 104 65.050 63.889 1.161 1
1 1203 . 25 1 1 A 104 104 SER N N 104 114.771 113.207 1.564 1
1 1204 . 25 1 1 A 105 105 GLY H H 105 8.788 7.657 1.131 1
1 1205 . 25 1 1 A 105 105 GLY HA2 H 105 3.733 3.979 -0.246 1
1 1206 . 25 1 1 A 105 105 GLY HA3 H 105 3.733 3.999 -0.266 1
1 1207 . 25 1 1 A 105 105 GLY CA C 105 47.247 46.489 0.758 1
1 1208 . 25 1 1 A 105 105 GLY N N 105 110.394 108.896 1.498 1
1 1209 . 25 1 1 A 106 106 ASN HA H 106 4.454 4.738 -0.284 1
1 1212 . 25 1 1 A 106 106 ASN C C 106 175.180 176.519 -1.339 1
1 1213 . 25 1 1 A 106 106 ASN CA C 106 54.492 55.306 -0.814 1
1 1214 . 25 1 1 A 106 106 ASN CB C 106 37.282 39.676 -2.394 1
1 1215 . 25 1 1 A 107 107 TYR H H 107 8.241 8.287 -0.046 1
1 1216 . 25 1 1 A 107 107 TYR HA H 107 4.335 4.893 -0.558 1
1 1223 . 25 1 1 A 107 107 TYR C C 107 173.954 176.414 -2.460 1
1 1224 . 25 1 1 A 107 107 TYR CA C 107 57.727 57.095 0.632 1
1 1225 . 25 1 1 A 107 107 TYR CB C 107 37.063 39.891 -2.828 1
1 1230 . 25 1 1 A 107 107 TYR N N 107 120.708 112.529 8.179 1
1 1231 . 25 1 1 A 108 108 SER H H 108 7.117 8.023 -0.906 1
1 1232 . 25 1 1 A 108 108 SER HA H 108 4.221 4.276 -0.055 1
1 1235 . 25 1 1 A 108 108 SER C C 108 174.834 174.192 0.642 1
1 1236 . 25 1 1 A 108 108 SER CA C 108 59.859 60.405 -0.546 1
1 1237 . 25 1 1 A 108 108 SER CB C 108 63.846 63.659 0.187 1
1 1238 . 25 1 1 A 108 108 SER N N 108 113.362 115.299 -1.937 1
1 1239 . 25 1 1 A 109 109 SER H H 109 8.053 8.075 -0.022 1
1 1240 . 25 1 1 A 109 109 SER HA H 109 4.560 4.434 0.126 1
1 1243 . 25 1 1 A 109 109 SER CA C 109 57.141 59.167 -2.026 1
1 1244 . 25 1 1 A 109 109 SER CB C 109 64.874 62.914 1.960 1
1 1245 . 25 1 1 A 109 109 SER N N 109 116.657 115.654 1.003 1
1 1246 . 25 1 1 A 110 110 THR HA H 110 3.541 3.978 -0.437 1
1 1251 . 25 1 1 A 110 110 THR C C 110 175.477 176.188 -0.711 1
1 1252 . 25 1 1 A 110 110 THR CA C 110 66.443 65.867 0.576 1
1 1253 . 25 1 1 A 110 110 THR CB C 110 68.091 68.556 -0.465 1
1 1255 . 25 1 1 A 111 111 ASP H H 111 8.224 8.348 -0.124 1
1 1256 . 25 1 1 A 111 111 ASP HA H 111 4.237 4.395 -0.158 1
1 1259 . 25 1 1 A 111 111 ASP C C 111 177.520 178.535 -1.015 1
1 1260 . 25 1 1 A 111 111 ASP CA C 111 57.559 57.115 0.444 1
1 1261 . 25 1 1 A 111 111 ASP CB C 111 40.292 40.655 -0.363 1
1 1262 . 25 1 1 A 111 111 ASP N N 111 119.490 120.310 -0.820 1
1 1263 . 25 1 1 A 112 112 ALA H H 112 7.431 8.201 -0.770 1
1 1264 . 25 1 1 A 112 112 ALA HA H 112 4.191 4.093 0.098 1
1 1268 . 25 1 1 A 112 112 ALA C C 112 180.646 180.067 0.579 1
1 1269 . 25 1 1 A 112 112 ALA CA C 112 54.534 55.022 -0.488 1
1 1270 . 25 1 1 A 112 112 ALA CB C 112 18.992 18.254 0.738 1
1 1271 . 25 1 1 A 112 112 ALA N N 112 119.710 121.713 -2.003 1
1 1272 . 25 1 1 A 113 113 GLN H H 113 7.576 7.742 -0.166 1
1 1273 . 25 1 1 A 113 113 GLN HA H 113 3.562 4.237 -0.675 1
1 1278 . 25 1 1 A 113 113 GLN C C 113 176.756 179.241 -2.485 1
1 1279 . 25 1 1 A 113 113 GLN CA C 113 57.736 59.020 -1.284 1
1 1280 . 25 1 1 A 113 113 GLN CB C 113 29.110 28.812 0.298 1
1 1281 . 25 1 1 A 113 113 GLN N N 113 117.518 118.208 -0.690 1
1 1283 . 25 1 1 A 114 114 MET H H 114 8.192 8.403 -0.211 1
1 1284 . 25 1 1 A 114 114 MET HA H 114 4.231 3.850 0.381 1
1 1289 . 25 1 1 A 114 114 MET C C 114 175.648 178.046 -2.398 1
1 1290 . 25 1 1 A 114 114 MET CA C 114 57.446 57.606 -0.160 1
1 1291 . 25 1 1 A 114 114 MET CB C 114 33.570 32.235 1.335 1
1 1293 . 25 1 1 A 114 114 MET N N 114 111.509 119.150 -7.641 1
1 1294 . 25 1 1 A 115 115 GLN H H 115 6.940 7.900 -0.960 1
1 1295 . 25 1 1 A 115 115 GLN HA H 115 4.307 4.210 0.097 1
1 1302 . 25 1 1 A 115 115 GLN C C 115 176.270 176.301 -0.031 1
1 1303 . 25 1 1 A 115 115 GLN CA C 115 54.680 56.974 -2.294 1
1 1304 . 25 1 1 A 115 115 GLN CB C 115 28.233 29.143 -0.910 1
1 1306 . 25 1 1 A 115 115 GLN N N 115 114.300 117.229 -2.929 1
1 1308 . 25 1 1 A 116 116 TYR H H 116 6.677 8.136 -1.459 1
1 1309 . 25 1 1 A 116 116 TYR HA H 116 4.193 4.503 -0.310 1
1 1312 . 25 1 1 A 116 116 TYR C C 116 175.268 173.825 1.443 1
1 1313 . 25 1 1 A 116 116 TYR CA C 116 54.357 58.992 -4.635 1
1 1314 . 25 1 1 A 116 116 TYR CB C 116 35.498 37.273 -1.775 1
1 1315 . 25 1 1 A 116 116 TYR N N 116 117.919 119.298 -1.379 1
1 1316 . 25 1 1 A 117 117 ASP H H 117 8.081 8.505 -0.424 1
1 1317 . 25 1 1 A 117 117 ASP HA H 117 4.665 4.939 -0.274 1
1 1320 . 25 1 1 A 117 117 ASP CA C 117 52.422 50.359 2.063 1
1 1321 . 25 1 1 A 117 117 ASP CB C 117 42.416 43.750 -1.334 1
1 1322 . 25 1 1 A 117 117 ASP N N 117 120.887 127.487 -6.600 1
1 1323 . 25 1 1 A 118 118 PRO C C 118 179.180 179.044 0.136 1
1 1324 . 25 1 1 A 118 118 PRO CA C 118 65.942 65.801 0.141 1
1 1325 . 25 1 1 A 118 118 PRO CB C 118 32.197 31.768 0.429 1
1 1326 . 25 1 1 A 119 119 GLY H H 119 9.742 8.641 1.101 1
1 1327 . 25 1 1 A 119 119 GLY C C 119 175.622 174.864 0.758 1
1 1328 . 25 1 1 A 119 119 GLY CA C 119 46.785 46.397 0.388 1
1 1329 . 25 1 1 A 119 119 GLY N N 119 106.412 106.605 -0.193 1
1 1330 . 25 1 1 A 120 120 LEU H H 120 6.666 7.435 -0.769 1
1 1331 . 25 1 1 A 120 120 LEU HA H 120 3.365 3.320 0.045 1
1 1341 . 25 1 1 A 120 120 LEU C C 120 179.262 178.350 0.912 1
1 1342 . 25 1 1 A 120 120 LEU CA C 120 56.605 56.980 -0.375 1
1 1343 . 25 1 1 A 120 120 LEU CB C 120 39.262 41.608 -2.346 1
1 1347 . 25 1 1 A 120 120 LEU N N 120 126.226 121.778 4.448 1
1 1348 . 25 1 1 A 121 121 PHE H H 121 7.356 8.392 -1.036 1
1 1349 . 25 1 1 A 121 121 PHE HA H 121 4.459 3.875 0.584 1
1 1352 . 25 1 1 A 121 121 PHE C C 121 179.716 177.871 1.845 1
1 1353 . 25 1 1 A 121 121 PHE CA C 121 62.838 62.010 0.828 1
1 1354 . 25 1 1 A 121 121 PHE CB C 121 37.603 39.190 -1.587 1
1 1355 . 25 1 1 A 121 121 PHE N N 121 117.437 119.442 -2.005 1
1 1356 . 25 1 1 A 122 122 ALA H H 122 7.926 8.541 -0.615 1
1 1357 . 25 1 1 A 122 122 ALA HA H 122 4.523 4.102 0.421 1
1 1361 . 25 1 1 A 122 122 ALA C C 122 180.435 179.636 0.799 1
1 1362 . 25 1 1 A 122 122 ALA CA C 122 55.527 54.903 0.624 1
1 1363 . 25 1 1 A 122 122 ALA CB C 122 17.814 18.141 -0.327 1
1 1364 . 25 1 1 A 122 122 ALA N N 122 121.068 121.312 -0.244 1
1 1365 . 25 1 1 A 123 123 GLN H H 123 7.507 7.405 0.102 1
1 1366 . 25 1 1 A 123 123 GLN HA H 123 4.153 3.926 0.227 1
1 1371 . 25 1 1 A 123 123 GLN C C 123 180.561 178.404 2.157 1
1 1372 . 25 1 1 A 123 123 GLN CA C 123 59.948 58.793 1.155 1
1 1373 . 25 1 1 A 123 123 GLN CB C 123 29.135 28.376 0.759 1
1 1375 . 25 1 1 A 123 123 GLN N N 123 120.324 117.393 2.931 1
1 1376 . 25 1 1 A 124 124 ILE H H 124 8.318 7.974 0.344 1
1 1377 . 25 1 1 A 124 124 ILE HA H 124 3.635 3.771 -0.136 1
1 1387 . 25 1 1 A 124 124 ILE C C 124 176.481 178.049 -1.568 1
1 1388 . 25 1 1 A 124 124 ILE CA C 124 66.432 64.493 1.939 1
1 1389 . 25 1 1 A 124 124 ILE CB C 124 39.168 37.768 1.400 1
1 1393 . 25 1 1 A 124 124 ILE N N 124 123.747 117.859 5.888 1
1 1394 . 25 1 1 A 125 125 GLN H H 125 8.474 8.091 0.383 1
1 1395 . 25 1 1 A 125 125 GLN HA H 125 4.264 3.894 0.370 1
1 1402 . 25 1 1 A 125 125 GLN C C 125 178.947 177.842 1.105 1
1 1403 . 25 1 1 A 125 125 GLN CA C 125 59.651 58.439 1.212 1
1 1404 . 25 1 1 A 125 125 GLN CB C 125 28.880 28.402 0.478 1
1 1406 . 25 1 1 A 125 125 GLN N N 125 120.368 121.199 -0.831 1
1 1408 . 25 1 1 A 126 126 ALA H H 126 8.002 7.692 0.310 1
1 1409 . 25 1 1 A 126 126 ALA HA H 126 4.144 4.011 0.133 1
1 1413 . 25 1 1 A 126 126 ALA C C 126 179.316 180.040 -0.724 1
1 1414 . 25 1 1 A 126 126 ALA CA C 126 55.036 54.732 0.304 1
1 1415 . 25 1 1 A 126 126 ALA CB C 126 18.087 17.942 0.145 1
1 1416 . 25 1 1 A 126 126 ALA N N 126 121.661 121.416 0.245 1
1 1417 . 25 1 1 A 127 127 ALA H H 127 7.823 8.145 -0.322 1
1 1418 . 25 1 1 A 127 127 ALA HA H 127 4.162 4.111 0.051 1
1 1422 . 25 1 1 A 127 127 ALA C C 127 180.707 179.455 1.252 1
1 1423 . 25 1 1 A 127 127 ALA CA C 127 55.080 54.884 0.196 1
1 1424 . 25 1 1 A 127 127 ALA CB C 127 19.354 18.264 1.090 1
1 1425 . 25 1 1 A 127 127 ALA N N 127 119.853 119.792 0.061 1
1 1426 . 25 1 1 A 128 128 ALA H H 128 8.936 7.774 1.162 1
1 1427 . 25 1 1 A 128 128 ALA HA H 128 3.928 3.778 0.150 1
1 1431 . 25 1 1 A 128 128 ALA C C 128 181.031 179.240 1.791 1
1 1432 . 25 1 1 A 128 128 ALA CA C 128 55.502 54.701 0.801 1
1 1433 . 25 1 1 A 128 128 ALA CB C 128 16.609 17.667 -1.058 1
1 1434 . 25 1 1 A 128 128 ALA N N 128 121.355 120.147 1.208 1
1 1435 . 25 1 1 A 129 129 THR H H 129 8.543 7.506 1.037 1
1 1436 . 25 1 1 A 129 129 THR HA H 129 4.015 3.656 0.359 1
1 1441 . 25 1 1 A 129 129 THR C C 129 177.332 175.939 1.393 1
1 1442 . 25 1 1 A 129 129 THR CA C 129 65.893 64.860 1.033 1
1 1443 . 25 1 1 A 129 129 THR CB C 129 68.566 68.519 0.047 1
1 1445 . 25 1 1 A 129 129 THR N N 129 112.709 111.841 0.868 1
1 1446 . 25 1 1 A 130 130 LYS H H 130 8.126 7.567 0.559 1
1 1447 . 25 1 1 A 130 130 LYS HA H 130 4.000 3.995 0.005 1
1 1456 . 25 1 1 A 130 130 LYS C C 130 179.082 178.549 0.533 1
1 1457 . 25 1 1 A 130 130 LYS CA C 130 60.299 58.505 1.794 1
1 1458 . 25 1 1 A 130 130 LYS CB C 130 32.767 31.970 0.797 1
1 1462 . 25 1 1 A 130 130 LYS N N 130 123.879 120.729 3.150 1
1 1463 . 25 1 1 A 131 131 ALA H H 131 7.184 7.771 -0.587 1
1 1464 . 25 1 1 A 131 131 ALA HA H 131 4.005 4.217 -0.212 1
1 1468 . 25 1 1 A 131 131 ALA C C 131 178.482 179.522 -1.040 1
1 1469 . 25 1 1 A 131 131 ALA CA C 131 55.027 55.171 -0.144 1
1 1470 . 25 1 1 A 131 131 ALA CB C 131 18.669 19.477 -0.808 1
1 1471 . 25 1 1 A 131 131 ALA N N 131 118.590 121.171 -2.581 1
1 1472 . 25 1 1 A 132 132 TRP H H 132 7.977 8.620 -0.643 1
1 1473 . 25 1 1 A 132 132 TRP HA H 132 4.001 4.156 -0.155 1
1 1480 . 25 1 1 A 132 132 TRP C C 132 177.332 175.731 1.601 1
1 1481 . 25 1 1 A 132 132 TRP CA C 132 60.431 57.308 3.123 1
1 1482 . 25 1 1 A 132 132 TRP CB C 132 27.786 27.623 0.163 1
1 1486 . 25 1 1 A 132 132 TRP N N 132 119.168 116.966 2.202 1
1 1488 . 25 1 1 A 133 133 ARG H H 133 8.006 8.113 -0.107 1
1 1489 . 25 1 1 A 133 133 ARG HA H 133 4.027 4.380 -0.353 1
1 1497 . 25 1 1 A 133 133 ARG C C 133 176.664 177.867 -1.203 1
1 1498 . 25 1 1 A 133 133 ARG CA C 133 59.355 57.197 2.158 1
1 1499 . 25 1 1 A 133 133 ARG CB C 133 30.451 32.572 -2.121 1
1 1502 . 25 1 1 A 133 133 ARG N N 133 113.062 120.617 -7.555 1
1 1504 . 25 1 1 A 134 134 LYS H H 134 7.322 7.569 -0.247 1
1 1505 . 25 1 1 A 134 134 LYS HA H 134 4.313 4.370 -0.057 1
1 1514 . 25 1 1 A 134 134 LYS C C 134 176.282 176.182 0.100 1
1 1515 . 25 1 1 A 134 134 LYS CA C 134 54.922 56.354 -1.432 1
1 1516 . 25 1 1 A 134 134 LYS CB C 134 32.633 31.986 0.647 1
1 1520 . 25 1 1 A 134 134 LYS N N 134 118.170 116.270 1.900 1
1 1521 . 25 1 1 A 135 135 LEU H H 135 7.440 7.201 0.239 1
1 1522 . 25 1 1 A 135 135 LEU HA H 135 4.174 4.531 -0.357 1
1 1532 . 25 1 1 A 135 135 LEU CA C 135 54.408 53.106 1.302 1
1 1533 . 25 1 1 A 135 135 LEU CB C 135 40.407 40.549 -0.142 1
1 1537 . 25 1 1 A 135 135 LEU N N 135 123.358 122.847 0.511 1
1 1538 . 25 1 1 A 136 136 PRO HA H 136 4.437 4.568 -0.131 1
1 1545 . 25 1 1 A 136 136 PRO C C 136 177.106 176.381 0.725 1
1 1546 . 25 1 1 A 136 136 PRO CA C 136 62.889 62.599 0.290 1
1 1547 . 25 1 1 A 136 136 PRO CB C 136 32.192 32.110 0.082 1
1 1550 . 25 1 1 A 137 137 VAL H H 137 8.219 8.421 -0.202 1
1 1551 . 25 1 1 A 137 137 VAL HA H 137 4.077 4.607 -0.530 1
1 1559 . 25 1 1 A 137 137 VAL C C 137 176.305 176.690 -0.385 1
1 1560 . 25 1 1 A 137 137 VAL CA C 137 61.958 61.909 0.049 1
1 1561 . 25 1 1 A 137 137 VAL CB C 137 32.755 32.641 0.114 1
1 1564 . 25 1 1 A 137 137 VAL N N 137 120.079 121.920 -1.841 1
1 1565 . 25 1 1 A 138 138 LYS H H 138 8.444 8.619 -0.175 1
1 1566 . 25 1 1 A 138 138 LYS HA H 138 4.316 4.140 0.176 1
1 1575 . 25 1 1 A 138 138 LYS C C 138 176.790 177.733 -0.943 1
1 1576 . 25 1 1 A 138 138 LYS CA C 138 56.792 58.543 -1.751 1
1 1577 . 25 1 1 A 138 138 LYS CB C 138 33.205 32.981 0.224 1
1 1581 . 25 1 1 A 138 138 LYS N N 138 126.449 125.532 0.917 1
1 1582 . 25 1 1 A 139 139 GLY H H 139 8.518 7.413 1.105 1
1 1583 . 25 1 1 A 139 139 GLY HA2 H 139 4.070 4.134 -0.064 1
1 1584 . 25 1 1 A 139 139 GLY HA3 H 139 3.897 4.140 -0.243 1
1 1585 . 25 1 1 A 139 139 GLY C C 139 172.874 172.142 0.732 1
1 1586 . 25 1 1 A 139 139 GLY CA C 139 45.157 45.759 -0.602 1
1 1587 . 25 1 1 A 139 139 GLY N N 139 112.617 103.608 9.009 1
1 6 . 26 1 1 A 2 2 VAL H H 2 8.992 8.879 0.113 1
1 7 . 26 1 1 A 2 2 VAL HA H 2 5.370 4.720 0.650 1
1 15 . 26 1 1 A 2 2 VAL C C 2 174.325 174.462 -0.137 1
1 16 . 26 1 1 A 2 2 VAL CA C 2 61.267 60.868 0.399 1
1 17 . 26 1 1 A 2 2 VAL CB C 2 33.890 33.824 0.066 1
1 20 . 26 1 1 A 2 2 VAL N N 2 126.939 119.723 7.216 1
1 21 . 26 1 1 A 3 3 THR H H 3 8.912 8.922 -0.010 1
1 22 . 26 1 1 A 3 3 THR HA H 3 4.505 5.117 -0.612 1
1 27 . 26 1 1 A 3 3 THR C C 3 172.710 173.009 -0.299 1
1 28 . 26 1 1 A 3 3 THR CA C 3 59.689 59.769 -0.080 1
1 29 . 26 1 1 A 3 3 THR CB C 3 72.398 70.815 1.583 1
1 31 . 26 1 1 A 3 3 THR N N 3 118.091 123.307 -5.216 1
1 32 . 26 1 1 A 4 4 GLU H H 4 8.631 9.116 -0.485 1
1 33 . 26 1 1 A 4 4 GLU HA H 4 5.788 4.862 0.926 1
1 38 . 26 1 1 A 4 4 GLU C C 4 175.758 175.436 0.322 1
1 39 . 26 1 1 A 4 4 GLU CA C 4 54.902 54.711 0.191 1
1 40 . 26 1 1 A 4 4 GLU CB C 4 35.097 32.287 2.810 1
1 42 . 26 1 1 A 4 4 GLU N N 4 120.966 128.350 -7.384 1
1 43 . 26 1 1 A 5 5 THR H H 5 9.188 8.425 0.763 1
1 44 . 26 1 1 A 5 5 THR HA H 5 4.739 4.871 -0.132 1
1 49 . 26 1 1 A 5 5 THR C C 5 172.757 172.320 0.437 1
1 50 . 26 1 1 A 5 5 THR CA C 5 60.382 60.074 0.308 1
1 51 . 26 1 1 A 5 5 THR CB C 5 71.558 70.504 1.054 1
1 53 . 26 1 1 A 5 5 THR N N 5 119.366 114.951 4.415 1
1 54 . 26 1 1 A 6 6 VAL H H 6 8.476 8.625 -0.149 1
1 55 . 26 1 1 A 6 6 VAL HA H 6 5.026 5.758 -0.732 1
1 63 . 26 1 1 A 6 6 VAL C C 6 176.674 174.471 2.203 1
1 64 . 26 1 1 A 6 6 VAL CA C 6 61.008 60.842 0.166 1
1 65 . 26 1 1 A 6 6 VAL CB C 6 33.861 35.213 -1.352 1
1 68 . 26 1 1 A 6 6 VAL N N 6 121.384 122.291 -0.907 1
1 69 . 26 1 1 A 7 7 ASP H H 7 8.848 8.723 0.125 1
1 70 . 26 1 1 A 7 7 ASP HA H 7 4.797 4.825 -0.028 1
1 73 . 26 1 1 A 7 7 ASP CA C 7 52.834 54.926 -2.092 1
1 74 . 26 1 1 A 7 7 ASP CB C 7 42.219 42.367 -0.148 1
1 75 . 26 1 1 A 7 7 ASP N N 7 127.061 126.829 0.232 1
1 76 . 26 1 1 A 8 8 GLY C C 8 175.143 174.781 0.362 1
1 77 . 26 1 1 A 8 8 GLY CA C 8 46.553 46.892 -0.339 1
1 78 . 26 1 1 A 9 9 GLN H H 9 8.408 7.733 0.675 1
1 79 . 26 1 1 A 9 9 GLN HA H 9 4.541 4.245 0.296 1
1 86 . 26 1 1 A 9 9 GLN C C 9 176.463 176.760 -0.297 1
1 87 . 26 1 1 A 9 9 GLN CA C 9 55.167 55.252 -0.085 1
1 88 . 26 1 1 A 9 9 GLN CB C 9 29.376 28.045 1.331 1
1 90 . 26 1 1 A 9 9 GLN N N 9 118.300 116.610 1.690 1
1 92 . 26 1 1 A 10 10 GLY H H 10 8.162 8.605 -0.443 1
1 93 . 26 1 1 A 10 10 GLY HA2 H 10 4.174 3.914 0.260 1
1 94 . 26 1 1 A 10 10 GLY HA3 H 10 3.521 3.921 -0.400 1
1 95 . 26 1 1 A 10 10 GLY C C 10 174.092 174.462 -0.370 1
1 96 . 26 1 1 A 10 10 GLY CA C 10 45.558 46.437 -0.879 1
1 97 . 26 1 1 A 10 10 GLY N N 10 108.747 110.933 -2.186 1
1 98 . 26 1 1 A 11 11 GLN H H 11 8.507 7.616 0.891 1
1 99 . 26 1 1 A 11 11 GLN HA H 11 4.202 4.374 -0.172 1
1 106 . 26 1 1 A 11 11 GLN C C 11 173.992 173.832 0.160 1
1 107 . 26 1 1 A 11 11 GLN CA C 11 55.098 54.236 0.862 1
1 108 . 26 1 1 A 11 11 GLN CB C 11 29.097 30.500 -1.403 1
1 110 . 26 1 1 A 11 11 GLN N N 11 122.979 119.585 3.394 1
1 112 . 26 1 1 A 12 12 ALA H H 12 8.259 8.669 -0.410 1
1 113 . 26 1 1 A 12 12 ALA HA H 12 5.156 5.334 -0.178 1
1 117 . 26 1 1 A 12 12 ALA C C 12 177.284 176.073 1.211 1
1 118 . 26 1 1 A 12 12 ALA CA C 12 51.087 50.162 0.925 1
1 119 . 26 1 1 A 12 12 ALA CB C 12 20.500 19.700 0.800 1
1 120 . 26 1 1 A 12 12 ALA N N 12 127.100 127.253 -0.153 1
1 121 . 26 1 1 A 13 13 TRP H H 13 9.245 8.321 0.924 1
1 122 . 26 1 1 A 13 13 TRP HA H 13 4.717 5.596 -0.879 1
1 131 . 26 1 1 A 13 13 TRP C C 13 175.108 174.175 0.933 1
1 132 . 26 1 1 A 13 13 TRP CA C 13 55.966 55.452 0.514 1
1 133 . 26 1 1 A 13 13 TRP CB C 13 31.912 32.596 -0.684 1
1 139 . 26 1 1 A 13 13 TRP N N 13 123.088 119.923 3.165 1
1 141 . 26 1 1 A 14 14 ARG H H 14 8.575 8.459 0.116 1
1 142 . 26 1 1 A 14 14 ARG HA H 14 5.335 4.379 0.956 1
1 150 . 26 1 1 A 14 14 ARG C C 14 175.191 173.977 1.214 1
1 151 . 26 1 1 A 14 14 ARG CA C 14 53.106 55.040 -1.934 1
1 152 . 26 1 1 A 14 14 ARG CB C 14 32.749 31.918 0.831 1
1 154 . 26 1 1 A 14 14 ARG N N 14 121.163 120.656 0.507 1
1 156 . 26 1 1 A 15 15 HIS H H 15 8.595 8.079 0.516 1
1 157 . 26 1 1 A 15 15 HIS HA H 15 4.790 5.192 -0.402 1
1 161 . 26 1 1 A 15 15 HIS C C 15 173.770 173.748 0.022 1
1 162 . 26 1 1 A 15 15 HIS CA C 15 55.289 53.464 1.825 1
1 163 . 26 1 1 A 15 15 HIS CB C 15 33.208 32.280 0.928 1
1 165 . 26 1 1 A 15 15 HIS N N 15 117.643 119.273 -1.630 1
1 166 . 26 1 1 A 16 16 HIS H H 16 8.993 8.815 0.178 1
1 167 . 26 1 1 A 16 16 HIS HA H 16 5.158 5.110 0.048 1
1 171 . 26 1 1 A 16 16 HIS C C 16 173.608 174.340 -0.732 1
1 172 . 26 1 1 A 16 16 HIS CA C 16 56.450 54.591 1.859 1
1 173 . 26 1 1 A 16 16 HIS CB C 16 34.171 31.400 2.771 1
1 175 . 26 1 1 A 16 16 HIS N N 16 123.520 121.565 1.955 1
1 176 . 26 1 1 A 17 17 ASN H H 17 7.829 8.952 -1.123 1
1 177 . 26 1 1 A 17 17 ASN HA H 17 4.713 5.153 -0.440 1
1 182 . 26 1 1 A 17 17 ASN C C 17 173.682 175.692 -2.010 1
1 183 . 26 1 1 A 17 17 ASN CA C 17 51.822 51.486 0.336 1
1 184 . 26 1 1 A 17 17 ASN CB C 17 43.176 40.657 2.519 1
1 185 . 26 1 1 A 17 17 ASN N N 17 122.213 121.558 0.655 1
1 187 . 26 1 1 A 18 18 GLY H H 18 8.423 8.059 0.364 1
1 188 . 26 1 1 A 18 18 GLY HA2 H 18 3.931 3.618 0.313 1
1 189 . 26 1 1 A 18 18 GLY HA3 H 18 3.707 3.776 -0.069 1
1 190 . 26 1 1 A 18 18 GLY C C 18 173.985 172.865 1.120 1
1 191 . 26 1 1 A 18 18 GLY CA C 18 43.949 44.727 -0.778 1
1 192 . 26 1 1 A 18 18 GLY N N 18 106.991 107.942 -0.951 1
1 193 . 26 1 1 A 19 19 PHE H H 19 8.338 7.801 0.537 1
1 194 . 26 1 1 A 19 19 PHE HA H 19 4.068 5.364 -1.296 1
1 197 . 26 1 1 A 19 19 PHE C C 19 176.568 174.404 2.164 1
1 198 . 26 1 1 A 19 19 PHE CA C 19 59.338 56.476 2.862 1
1 199 . 26 1 1 A 19 19 PHE CB C 19 40.201 43.050 -2.849 1
1 200 . 26 1 1 A 19 19 PHE N N 19 116.857 119.128 -2.271 1
1 201 . 26 1 1 A 20 20 ASP H H 20 8.794 8.740 0.054 1
1 202 . 26 1 1 A 20 20 ASP HA H 20 4.485 4.798 -0.313 1
1 205 . 26 1 1 A 20 20 ASP C C 20 177.379 177.198 0.181 1
1 206 . 26 1 1 A 20 20 ASP CA C 20 54.140 54.398 -0.258 1
1 207 . 26 1 1 A 20 20 ASP CB C 20 41.915 42.517 -0.602 1
1 208 . 26 1 1 A 20 20 ASP N N 20 123.025 124.497 -1.472 1
1 209 . 26 1 1 A 21 21 PHE H H 21 8.862 9.089 -0.227 1
1 210 . 26 1 1 A 21 21 PHE HA H 21 4.087 4.161 -0.074 1
1 218 . 26 1 1 A 21 21 PHE C C 21 176.952 177.224 -0.272 1
1 219 . 26 1 1 A 21 21 PHE CA C 21 61.095 61.788 -0.693 1
1 220 . 26 1 1 A 21 21 PHE CB C 21 38.678 39.078 -0.400 1
1 226 . 26 1 1 A 21 21 PHE N N 21 127.163 127.691 -0.528 1
1 227 . 26 1 1 A 22 22 ALA H H 22 8.561 8.472 0.089 1
1 228 . 26 1 1 A 22 22 ALA HA H 22 3.878 3.983 -0.105 1
1 232 . 26 1 1 A 22 22 ALA C C 22 180.710 179.950 0.760 1
1 233 . 26 1 1 A 22 22 ALA CA C 22 55.211 55.113 0.098 1
1 234 . 26 1 1 A 22 22 ALA CB C 22 18.321 18.141 0.180 1
1 235 . 26 1 1 A 22 22 ALA N N 22 120.293 121.361 -1.068 1
1 236 . 26 1 1 A 23 23 VAL H H 23 7.241 8.418 -1.177 1
1 237 . 26 1 1 A 23 23 VAL HA H 23 3.684 3.515 0.169 1
1 245 . 26 1 1 A 23 23 VAL C C 23 177.101 178.221 -1.120 1
1 246 . 26 1 1 A 23 23 VAL CA C 23 65.237 66.970 -1.733 1
1 247 . 26 1 1 A 23 23 VAL CB C 23 31.780 31.577 0.203 1
1 250 . 26 1 1 A 23 23 VAL N N 23 118.775 118.320 0.455 1
1 251 . 26 1 1 A 24 24 ILE H H 24 6.761 7.761 -1.000 1
1 252 . 26 1 1 A 24 24 ILE HA H 24 3.196 3.486 -0.290 1
1 262 . 26 1 1 A 24 24 ILE C C 24 177.287 177.894 -0.607 1
1 263 . 26 1 1 A 24 24 ILE CA C 24 63.404 65.551 -2.147 1
1 264 . 26 1 1 A 24 24 ILE CB C 24 36.294 37.825 -1.531 1
1 268 . 26 1 1 A 24 24 ILE N N 24 119.036 119.519 -0.483 1
1 269 . 26 1 1 A 25 25 LYS H H 25 8.032 8.195 -0.163 1
1 270 . 26 1 1 A 25 25 LYS HA H 25 3.809 3.671 0.138 1
1 279 . 26 1 1 A 25 25 LYS C C 25 179.450 178.765 0.685 1
1 280 . 26 1 1 A 25 25 LYS CA C 25 59.621 59.588 0.033 1
1 281 . 26 1 1 A 25 25 LYS CB C 25 32.259 32.382 -0.123 1
1 285 . 26 1 1 A 25 25 LYS N N 25 118.368 120.677 -2.309 1
1 286 . 26 1 1 A 26 26 GLU H H 26 7.845 8.257 -0.412 1
1 287 . 26 1 1 A 26 26 GLU HA H 26 4.021 4.094 -0.073 1
1 292 . 26 1 1 A 26 26 GLU C C 26 179.191 178.790 0.401 1
1 293 . 26 1 1 A 26 26 GLU CA C 26 59.530 59.097 0.433 1
1 294 . 26 1 1 A 26 26 GLU CB C 26 29.449 29.526 -0.077 1
1 296 . 26 1 1 A 26 26 GLU N N 26 120.522 118.766 1.756 1
1 297 . 26 1 1 A 27 27 LEU H H 27 8.165 7.908 0.257 1
1 298 . 26 1 1 A 27 27 LEU HA H 27 4.163 4.129 0.034 1
1 308 . 26 1 1 A 27 27 LEU C C 27 177.256 178.379 -1.123 1
1 309 . 26 1 1 A 27 27 LEU CA C 27 58.049 57.587 0.462 1
1 310 . 26 1 1 A 27 27 LEU CB C 27 41.365 41.542 -0.177 1
1 314 . 26 1 1 A 27 27 LEU N N 27 120.879 121.146 -0.267 1
1 315 . 26 1 1 A 28 28 LYS H H 28 8.902 8.172 0.730 1
1 316 . 26 1 1 A 28 28 LYS HA H 28 4.199 4.327 -0.128 1
1 317 . 26 1 1 A 28 28 LYS C C 28 179.707 179.282 0.425 1
1 318 . 26 1 1 A 28 28 LYS CA C 28 60.097 59.067 1.030 1
1 319 . 26 1 1 A 28 28 LYS CB C 28 33.420 31.711 1.709 1
1 320 . 26 1 1 A 28 28 LYS N N 28 120.050 119.599 0.451 1
1 321 . 26 1 1 A 29 29 THR H H 29 8.294 7.834 0.460 1
1 322 . 26 1 1 A 29 29 THR HA H 29 3.892 3.924 -0.032 1
1 327 . 26 1 1 A 29 29 THR C C 29 175.711 176.249 -0.538 1
1 328 . 26 1 1 A 29 29 THR CA C 29 66.846 66.346 0.500 1
1 329 . 26 1 1 A 29 29 THR CB C 29 68.794 68.750 0.044 1
1 331 . 26 1 1 A 29 29 THR N N 29 115.933 116.339 -0.406 1
1 332 . 26 1 1 A 30 30 ALA H H 30 8.244 8.548 -0.304 1
1 333 . 26 1 1 A 30 30 ALA HA H 30 4.241 4.330 -0.089 1
1 337 . 26 1 1 A 30 30 ALA C C 30 179.128 179.335 -0.207 1
1 338 . 26 1 1 A 30 30 ALA CA C 30 55.714 55.714 0.000 1
1 339 . 26 1 1 A 30 30 ALA CB C 30 18.955 18.145 0.810 1
1 340 . 26 1 1 A 30 30 ALA N N 30 124.617 123.340 1.277 1
1 341 . 26 1 1 A 31 31 ALA H H 31 8.968 8.662 0.306 1
1 342 . 26 1 1 A 31 31 ALA HA H 31 3.890 4.091 -0.201 1
1 346 . 26 1 1 A 31 31 ALA C C 31 180.352 179.733 0.619 1
1 347 . 26 1 1 A 31 31 ALA CA C 31 55.454 55.257 0.197 1
1 348 . 26 1 1 A 31 31 ALA CB C 31 17.124 18.229 -1.105 1
1 349 . 26 1 1 A 31 31 ALA N N 31 119.327 120.496 -1.169 1
1 350 . 26 1 1 A 32 32 SER H H 32 7.995 7.692 0.303 1
1 351 . 26 1 1 A 32 32 SER HA H 32 4.238 4.425 -0.187 1
1 354 . 26 1 1 A 32 32 SER C C 32 175.612 175.854 -0.242 1
1 355 . 26 1 1 A 32 32 SER CA C 32 61.203 61.113 0.090 1
1 356 . 26 1 1 A 32 32 SER CB C 32 63.406 63.443 -0.037 1
1 357 . 26 1 1 A 32 32 SER N N 32 111.962 114.113 -2.151 1
1 358 . 26 1 1 A 33 33 GLN H H 33 8.333 7.837 0.496 1
1 359 . 26 1 1 A 33 33 GLN HA H 33 3.992 4.132 -0.140 1
1 366 . 26 1 1 A 33 33 GLN C C 33 177.486 176.824 0.662 1
1 367 . 26 1 1 A 33 33 GLN CA C 33 58.277 57.545 0.732 1
1 368 . 26 1 1 A 33 33 GLN CB C 33 29.140 29.236 -0.096 1
1 370 . 26 1 1 A 33 33 GLN N N 33 119.527 120.471 -0.944 1
1 372 . 26 1 1 A 34 34 TYR H H 34 8.587 8.203 0.384 1
1 373 . 26 1 1 A 34 34 TYR HA H 34 4.792 4.714 0.078 1
1 380 . 26 1 1 A 34 34 TYR C C 34 176.499 176.545 -0.046 1
1 381 . 26 1 1 A 34 34 TYR CA C 34 57.711 58.307 -0.596 1
1 382 . 26 1 1 A 34 34 TYR CB C 34 39.561 39.637 -0.076 1
1 387 . 26 1 1 A 34 34 TYR N N 34 114.610 115.272 -0.662 1
1 388 . 26 1 1 A 35 35 GLY H H 35 7.346 8.008 -0.662 1
1 389 . 26 1 1 A 35 35 GLY HA2 H 35 4.785 4.093 0.692 1
1 390 . 26 1 1 A 35 35 GLY HA3 H 35 4.007 4.100 -0.093 1
1 391 . 26 1 1 A 35 35 GLY C C 35 175.796 173.415 2.381 1
1 392 . 26 1 1 A 35 35 GLY CA C 35 44.355 44.738 -0.383 1
1 393 . 26 1 1 A 35 35 GLY N N 35 108.501 107.373 1.128 1
1 394 . 26 1 1 A 36 36 ALA H H 36 9.363 8.739 0.624 1
1 395 . 26 1 1 A 36 36 ALA HA H 36 4.217 4.585 -0.368 1
1 399 . 26 1 1 A 36 36 ALA C C 36 178.039 178.125 -0.086 1
1 400 . 26 1 1 A 36 36 ALA CA C 36 56.114 51.644 4.470 1
1 401 . 26 1 1 A 36 36 ALA CB C 36 19.179 20.284 -1.105 1
1 402 . 26 1 1 A 36 36 ALA N N 36 125.811 123.637 2.174 1
1 403 . 26 1 1 A 37 37 THR H H 37 8.070 8.932 -0.862 1
1 404 . 26 1 1 A 37 37 THR HA H 37 4.570 4.442 0.128 1
1 409 . 26 1 1 A 37 37 THR C C 37 173.685 174.080 -0.395 1
1 410 . 26 1 1 A 37 37 THR CA C 37 59.822 63.717 -3.895 1
1 411 . 26 1 1 A 37 37 THR CB C 37 68.267 67.048 1.219 1
1 413 . 26 1 1 A 37 37 THR N N 37 129.410 116.308 13.102 1
1 414 . 26 1 1 A 38 38 ALA H H 38 6.853 7.816 -0.963 1
1 415 . 26 1 1 A 38 38 ALA HA H 38 4.601 4.551 0.050 1
1 419 . 26 1 1 A 38 38 ALA CA C 38 50.758 50.612 0.146 1
1 420 . 26 1 1 A 38 38 ALA CB C 38 18.325 19.622 -1.297 1
1 421 . 26 1 1 A 38 38 ALA N N 38 124.674 125.296 -0.622 1
1 422 . 26 1 1 A 40 40 TYR HA H 40 4.032 4.014 0.018 1
1 429 . 26 1 1 A 40 40 TYR C C 40 176.456 177.341 -0.885 1
1 430 . 26 1 1 A 40 40 TYR CA C 40 61.010 61.685 -0.675 1
1 431 . 26 1 1 A 40 40 TYR CB C 40 39.286 38.639 0.647 1
1 436 . 26 1 1 A 41 41 THR H H 41 6.874 7.852 -0.978 1
1 437 . 26 1 1 A 41 41 THR HA H 41 3.616 3.739 -0.123 1
1 442 . 26 1 1 A 41 41 THR C C 41 176.930 176.525 0.405 1
1 443 . 26 1 1 A 41 41 THR CA C 41 65.557 65.499 0.058 1
1 444 . 26 1 1 A 41 41 THR CB C 41 68.228 69.108 -0.880 1
1 446 . 26 1 1 A 41 41 THR N N 41 115.143 113.836 1.307 1
1 447 . 26 1 1 A 42 42 LEU H H 42 8.623 7.321 1.302 1
1 448 . 26 1 1 A 42 42 LEU HA H 42 3.708 3.970 -0.262 1
1 458 . 26 1 1 A 42 42 LEU C C 42 178.206 178.769 -0.563 1
1 459 . 26 1 1 A 42 42 LEU CA C 42 57.417 57.806 -0.389 1
1 460 . 26 1 1 A 42 42 LEU CB C 42 41.342 41.149 0.193 1
1 464 . 26 1 1 A 42 42 LEU N N 42 120.418 118.589 1.829 1
1 465 . 26 1 1 A 43 43 ALA H H 43 7.735 7.623 0.112 1
1 466 . 26 1 1 A 43 43 ALA HA H 43 4.020 3.969 0.051 1
1 470 . 26 1 1 A 43 43 ALA C C 43 180.826 180.601 0.225 1
1 471 . 26 1 1 A 43 43 ALA CA C 43 54.925 54.977 -0.052 1
1 472 . 26 1 1 A 43 43 ALA CB C 43 17.506 18.395 -0.889 1
1 473 . 26 1 1 A 43 43 ALA N N 43 120.203 121.742 -1.539 1
1 474 . 26 1 1 A 44 44 ILE H H 44 7.149 7.331 -0.182 1
1 475 . 26 1 1 A 44 44 ILE HA H 44 3.603 3.618 -0.015 1
1 485 . 26 1 1 A 44 44 ILE C C 44 178.594 178.090 0.504 1
1 486 . 26 1 1 A 44 44 ILE CA C 44 64.782 64.328 0.454 1
1 487 . 26 1 1 A 44 44 ILE CB C 44 37.472 37.568 -0.096 1
1 491 . 26 1 1 A 44 44 ILE N N 44 118.881 119.291 -0.410 1
1 492 . 26 1 1 A 45 45 VAL H H 45 7.968 8.052 -0.084 1
1 493 . 26 1 1 A 45 45 VAL HA H 45 2.925 3.352 -0.427 1
1 501 . 26 1 1 A 45 45 VAL C C 45 177.023 177.855 -0.832 1
1 502 . 26 1 1 A 45 45 VAL CA C 45 67.081 67.045 0.036 1
1 503 . 26 1 1 A 45 45 VAL CB C 45 30.854 31.272 -0.418 1
1 506 . 26 1 1 A 45 45 VAL N N 45 120.764 119.949 0.815 1
1 507 . 26 1 1 A 46 46 GLU H H 46 8.399 8.145 0.254 1
1 508 . 26 1 1 A 46 46 GLU HA H 46 3.848 3.897 -0.049 1
1 513 . 26 1 1 A 46 46 GLU C C 46 178.656 178.355 0.301 1
1 514 . 26 1 1 A 46 46 GLU CA C 46 59.491 59.049 0.442 1
1 515 . 26 1 1 A 46 46 GLU CB C 46 28.991 28.781 0.210 1
1 517 . 26 1 1 A 46 46 GLU N N 46 116.599 119.804 -3.205 1
1 518 . 26 1 1 A 47 47 SER H H 47 7.273 7.807 -0.534 1
1 519 . 26 1 1 A 47 47 SER HA H 47 4.287 4.168 0.119 1
1 521 . 26 1 1 A 47 47 SER CA C 47 61.047 62.445 -1.398 1
1 522 . 26 1 1 A 47 47 SER CB C 47 63.016 62.811 0.205 1
1 523 . 26 1 1 A 47 47 SER N N 47 113.609 117.831 -4.222 1
1 524 . 26 1 1 A 48 48 VAL H H 48 8.006 8.291 -0.285 1
1 525 . 26 1 1 A 48 48 VAL HA H 48 3.556 3.561 -0.005 1
1 533 . 26 1 1 A 48 48 VAL C C 48 177.257 177.411 -0.154 1
1 534 . 26 1 1 A 48 48 VAL CA C 48 65.025 66.530 -1.505 1
1 535 . 26 1 1 A 48 48 VAL CB C 48 31.841 31.469 0.372 1
1 538 . 26 1 1 A 48 48 VAL N N 48 122.327 121.349 0.978 1
1 539 . 26 1 1 A 49 49 ALA H H 49 8.369 7.707 0.662 1
1 540 . 26 1 1 A 49 49 ALA HA H 49 4.115 4.293 -0.178 1
1 544 . 26 1 1 A 49 49 ALA C C 49 177.307 177.357 -0.050 1
1 545 . 26 1 1 A 49 49 ALA CA C 49 53.253 53.315 -0.062 1
1 546 . 26 1 1 A 49 49 ALA CB C 49 20.131 18.160 1.971 1
1 547 . 26 1 1 A 49 49 ALA N N 49 118.050 120.669 -2.619 1
1 548 . 26 1 1 A 50 50 ASP H H 50 7.052 7.780 -0.728 1
1 549 . 26 1 1 A 50 50 ASP HA H 50 4.788 4.682 0.106 1
1 552 . 26 1 1 A 50 50 ASP C C 50 175.481 176.182 -0.701 1
1 553 . 26 1 1 A 50 50 ASP CA C 50 53.681 54.721 -1.040 1
1 554 . 26 1 1 A 50 50 ASP CB C 50 39.333 41.162 -1.829 1
1 555 . 26 1 1 A 50 50 ASP N N 50 116.997 117.248 -0.251 1
1 556 . 26 1 1 A 51 51 ASN H H 51 8.535 7.608 0.927 1
1 557 . 26 1 1 A 51 51 ASN HA H 51 4.628 4.870 -0.242 1
1 562 . 26 1 1 A 51 51 ASN C C 51 174.077 175.346 -1.269 1
1 563 . 26 1 1 A 51 51 ASN CA C 51 52.315 52.042 0.273 1
1 564 . 26 1 1 A 51 51 ASN CB C 51 41.928 39.639 2.289 1
1 565 . 26 1 1 A 51 51 ASN N N 51 118.626 117.964 0.662 1
1 567 . 26 1 1 A 52 52 TRP H H 52 8.555 8.245 0.310 1
1 574 . 26 1 1 A 52 52 TRP C C 52 173.269 176.685 -3.416 1
1 575 . 26 1 1 A 52 52 TRP CA C 52 55.031 57.977 -2.946 1
1 576 . 26 1 1 A 52 52 TRP CB C 52 26.801 29.811 -3.010 1
1 582 . 26 1 1 A 52 52 TRP N N 52 120.693 121.526 -0.833 1
1 584 . 26 1 1 A 53 53 LEU H H 53 7.847 8.864 -1.017 1
1 585 . 26 1 1 A 53 53 LEU HA H 53 4.859 5.006 -0.147 1
1 595 . 26 1 1 A 53 53 LEU C C 53 177.397 175.567 1.830 1
1 596 . 26 1 1 A 53 53 LEU CA C 53 53.619 53.559 0.060 1
1 597 . 26 1 1 A 53 53 LEU CB C 53 41.812 45.550 -3.738 1
1 601 . 26 1 1 A 53 53 LEU N N 53 124.741 120.975 3.766 1
1 602 . 26 1 1 A 54 54 THR H H 54 8.850 8.845 0.005 1
1 603 . 26 1 1 A 54 54 THR HA H 54 4.598 4.810 -0.212 1
1 608 . 26 1 1 A 54 54 THR CA C 54 60.531 59.362 1.169 1
1 609 . 26 1 1 A 54 54 THR CB C 54 67.183 69.603 -2.420 1
1 611 . 26 1 1 A 54 54 THR N N 54 113.407 111.083 2.324 1
1 612 . 26 1 1 A 55 55 PRO HA H 55 4.511 4.248 0.263 1
1 619 . 26 1 1 A 55 55 PRO C C 55 179.383 178.238 1.145 1
1 620 . 26 1 1 A 55 55 PRO CA C 55 67.159 64.425 2.734 1
1 621 . 26 1 1 A 55 55 PRO CB C 55 32.095 31.775 0.320 1
1 622 . 26 1 1 A 56 56 THR H H 56 8.575 7.659 0.916 1
1 623 . 26 1 1 A 56 56 THR HA H 56 4.229 4.175 0.054 1
1 628 . 26 1 1 A 56 56 THR C C 56 176.668 176.413 0.255 1
1 629 . 26 1 1 A 56 56 THR CA C 56 66.943 65.781 1.162 1
1 630 . 26 1 1 A 56 56 THR CB C 56 68.129 68.324 -0.195 1
1 632 . 26 1 1 A 56 56 THR N N 56 114.855 111.799 3.056 1
1 633 . 26 1 1 A 57 57 ASP H H 57 8.730 8.504 0.226 1
1 634 . 26 1 1 A 57 57 ASP HA H 57 4.425 4.726 -0.301 1
1 637 . 26 1 1 A 57 57 ASP C C 57 178.351 179.320 -0.969 1
1 638 . 26 1 1 A 57 57 ASP CA C 57 57.963 57.759 0.204 1
1 639 . 26 1 1 A 57 57 ASP CB C 57 40.134 40.931 -0.797 1
1 640 . 26 1 1 A 57 57 ASP N N 57 126.239 121.222 5.017 1
1 641 . 26 1 1 A 58 58 TRP H H 58 8.244 8.402 -0.158 1
1 642 . 26 1 1 A 58 58 TRP HA H 58 4.030 4.530 -0.500 1
1 650 . 26 1 1 A 58 58 TRP C C 58 177.432 179.161 -1.729 1
1 651 . 26 1 1 A 58 58 TRP CA C 58 62.731 60.227 2.504 1
1 652 . 26 1 1 A 58 58 TRP CB C 58 29.122 29.378 -0.256 1
1 657 . 26 1 1 A 58 58 TRP N N 58 119.241 120.574 -1.333 1
1 659 . 26 1 1 A 59 59 ASN H H 59 8.098 8.813 -0.715 1
1 660 . 26 1 1 A 59 59 ASN HA H 59 4.424 4.381 0.043 1
1 663 . 26 1 1 A 59 59 ASN C C 59 176.952 177.544 -0.592 1
1 664 . 26 1 1 A 59 59 ASN CA C 59 58.135 56.480 1.655 1
1 665 . 26 1 1 A 59 59 ASN CB C 59 40.168 38.233 1.935 1
1 666 . 26 1 1 A 59 59 ASN N N 59 115.747 118.057 -2.310 1
1 667 . 26 1 1 A 60 60 THR H H 60 8.712 7.758 0.954 1
1 668 . 26 1 1 A 60 60 THR HA H 60 3.717 3.953 -0.236 1
1 673 . 26 1 1 A 60 60 THR C C 60 176.044 176.638 -0.594 1
1 674 . 26 1 1 A 60 60 THR CA C 60 66.576 65.100 1.476 1
1 675 . 26 1 1 A 60 60 THR CB C 60 69.251 68.184 1.067 1
1 677 . 26 1 1 A 60 60 THR N N 60 114.896 113.042 1.854 1
1 678 . 26 1 1 A 61 61 LEU H H 61 8.485 8.335 0.150 1
1 679 . 26 1 1 A 61 61 LEU HA H 61 3.391 4.043 -0.652 1
1 689 . 26 1 1 A 61 61 LEU C C 61 177.433 178.531 -1.098 1
1 690 . 26 1 1 A 61 61 LEU CA C 61 58.354 58.617 -0.263 1
1 691 . 26 1 1 A 61 61 LEU CB C 61 41.761 42.329 -0.568 1
1 695 . 26 1 1 A 61 61 LEU N N 61 123.433 124.342 -0.909 1
1 696 . 26 1 1 A 62 62 VAL H H 62 8.073 8.318 -0.245 1
1 697 . 26 1 1 A 62 62 VAL HA H 62 3.207 3.775 -0.568 1
1 705 . 26 1 1 A 62 62 VAL C C 62 177.585 177.501 0.084 1
1 706 . 26 1 1 A 62 62 VAL CA C 62 67.345 65.283 2.062 1
1 707 . 26 1 1 A 62 62 VAL CB C 62 30.905 30.611 0.294 1
1 710 . 26 1 1 A 62 62 VAL N N 62 116.018 118.419 -2.401 1
1 711 . 26 1 1 A 63 63 ARG H H 63 7.765 7.997 -0.232 1
1 712 . 26 1 1 A 63 63 ARG HA H 63 3.602 3.995 -0.393 1
1 719 . 26 1 1 A 63 63 ARG C C 63 177.818 178.039 -0.221 1
1 720 . 26 1 1 A 63 63 ARG CA C 63 58.049 57.994 0.055 1
1 721 . 26 1 1 A 63 63 ARG CB C 63 29.955 29.236 0.719 1
1 724 . 26 1 1 A 63 63 ARG N N 63 116.700 120.792 -4.092 1
1 725 . 26 1 1 A 64 64 ALA H H 64 7.574 7.326 0.248 1
1 726 . 26 1 1 A 64 64 ALA HA H 64 4.158 4.356 -0.198 1
1 730 . 26 1 1 A 64 64 ALA C C 64 179.886 178.945 0.941 1
1 731 . 26 1 1 A 64 64 ALA CA C 64 54.007 53.686 0.321 1
1 732 . 26 1 1 A 64 64 ALA CB C 64 19.147 19.892 -0.745 1
1 733 . 26 1 1 A 64 64 ALA N N 64 117.555 121.921 -4.366 1
1 734 . 26 1 1 A 65 65 VAL H H 65 7.554 7.894 -0.340 1
1 735 . 26 1 1 A 65 65 VAL HA H 65 4.253 3.579 0.674 1
1 743 . 26 1 1 A 65 65 VAL C C 65 174.180 176.472 -2.292 1
1 744 . 26 1 1 A 65 65 VAL CA C 65 62.683 66.877 -4.194 1
1 745 . 26 1 1 A 65 65 VAL CB C 65 33.458 31.997 1.461 1
1 748 . 26 1 1 A 65 65 VAL N N 65 110.013 118.024 -8.011 1
1 749 . 26 1 1 A 66 66 LEU H H 66 7.792 7.399 0.393 1
1 750 . 26 1 1 A 66 66 LEU HA H 66 4.790 4.672 0.118 1
1 760 . 26 1 1 A 66 66 LEU C C 66 177.537 175.756 1.781 1
1 761 . 26 1 1 A 66 66 LEU CA C 66 52.823 52.821 0.002 1
1 762 . 26 1 1 A 66 66 LEU CB C 66 44.071 44.056 0.015 1
1 766 . 26 1 1 A 66 66 LEU N N 66 118.967 118.398 0.569 1
1 767 . 26 1 1 A 67 67 SER H H 67 9.208 8.460 0.748 1
1 768 . 26 1 1 A 67 67 SER HA H 67 4.414 4.791 -0.377 1
1 771 . 26 1 1 A 67 67 SER CA C 67 57.943 57.319 0.624 1
1 772 . 26 1 1 A 67 67 SER CB C 67 64.743 65.828 -1.085 1
1 773 . 26 1 1 A 67 67 SER N N 67 116.378 115.476 0.902 1
1 774 . 26 1 1 A 69 69 GLY HA2 H 69 3.916 3.773 0.143 1
1 775 . 26 1 1 A 69 69 GLY HA3 H 69 3.867 3.802 0.065 1
1 776 . 26 1 1 A 69 69 GLY C C 69 176.783 175.535 1.248 1
1 777 . 26 1 1 A 69 69 GLY CA C 69 46.977 46.747 0.230 1
1 778 . 26 1 1 A 70 70 ASP H H 70 7.674 8.117 -0.443 1
1 779 . 26 1 1 A 70 70 ASP HA H 70 4.511 3.725 0.786 1
1 782 . 26 1 1 A 70 70 ASP C C 70 178.096 178.225 -0.129 1
1 783 . 26 1 1 A 70 70 ASP CA C 70 57.262 56.508 0.754 1
1 784 . 26 1 1 A 70 70 ASP CB C 70 40.594 39.681 0.913 1
1 785 . 26 1 1 A 70 70 ASP N N 70 123.930 121.824 2.106 1
1 786 . 26 1 1 A 71 71 HIS H H 71 8.729 7.435 1.294 1
1 787 . 26 1 1 A 71 71 HIS HA H 71 4.235 4.062 0.173 1
1 790 . 26 1 1 A 71 71 HIS C C 71 176.769 176.630 0.139 1
1 791 . 26 1 1 A 71 71 HIS CA C 71 60.041 59.851 0.190 1
1 792 . 26 1 1 A 71 71 HIS CB C 71 30.682 29.838 0.844 1
1 793 . 26 1 1 A 71 71 HIS N N 71 121.003 119.775 1.228 1
1 794 . 26 1 1 A 72 72 LEU H H 72 7.620 7.871 -0.251 1
1 795 . 26 1 1 A 72 72 LEU HA H 72 3.769 3.815 -0.046 1
1 805 . 26 1 1 A 72 72 LEU C C 72 180.275 179.356 0.919 1
1 806 . 26 1 1 A 72 72 LEU CA C 72 58.192 57.973 0.219 1
1 807 . 26 1 1 A 72 72 LEU CB C 72 41.381 41.183 0.198 1
1 811 . 26 1 1 A 72 72 LEU N N 72 118.569 118.436 0.133 1
1 812 . 26 1 1 A 73 73 LEU H H 73 7.542 7.490 0.052 1
1 813 . 26 1 1 A 73 73 LEU HA H 73 4.107 4.166 -0.059 1
1 823 . 26 1 1 A 73 73 LEU C C 73 179.436 179.010 0.426 1
1 824 . 26 1 1 A 73 73 LEU CA C 73 58.026 57.214 0.812 1
1 825 . 26 1 1 A 73 73 LEU CB C 73 41.638 42.237 -0.599 1
1 829 . 26 1 1 A 73 73 LEU N N 73 121.418 120.833 0.585 1
1 830 . 26 1 1 A 74 74 TRP H H 74 8.786 7.912 0.874 1
1 831 . 26 1 1 A 74 74 TRP HA H 74 3.589 5.242 -1.653 1
1 840 . 26 1 1 A 74 74 TRP C C 74 176.816 178.635 -1.819 1
1 841 . 26 1 1 A 74 74 TRP CA C 74 63.046 59.652 3.394 1
1 842 . 26 1 1 A 74 74 TRP CB C 74 28.065 28.957 -0.892 1
1 848 . 26 1 1 A 74 74 TRP N N 74 121.111 118.069 3.042 1
1 850 . 26 1 1 A 75 75 LYS H H 75 8.939 7.469 1.470 1
1 851 . 26 1 1 A 75 75 LYS HA H 75 3.055 3.866 -0.811 1
1 860 . 26 1 1 A 75 75 LYS C C 75 177.967 178.543 -0.576 1
1 861 . 26 1 1 A 75 75 LYS CA C 75 60.029 58.135 1.894 1
1 862 . 26 1 1 A 75 75 LYS CB C 75 32.533 32.786 -0.253 1
1 866 . 26 1 1 A 75 75 LYS N N 75 119.783 118.458 1.325 1
1 867 . 26 1 1 A 76 76 SER H H 76 7.832 7.927 -0.095 1
1 868 . 26 1 1 A 76 76 SER HA H 76 4.040 4.011 0.029 1
1 871 . 26 1 1 A 76 76 SER C C 76 177.816 177.153 0.663 1
1 872 . 26 1 1 A 76 76 SER CA C 76 62.105 60.934 1.171 1
1 873 . 26 1 1 A 76 76 SER CB C 76 62.679 62.273 0.406 1
1 874 . 26 1 1 A 76 76 SER N N 76 113.395 114.389 -0.994 1
1 875 . 26 1 1 A 77 77 GLU H H 77 7.590 7.394 0.196 1
1 876 . 26 1 1 A 77 77 GLU HA H 77 4.042 4.167 -0.125 1
1 881 . 26 1 1 A 77 77 GLU C C 77 177.809 178.463 -0.654 1
1 882 . 26 1 1 A 77 77 GLU CA C 77 58.270 58.685 -0.415 1
1 883 . 26 1 1 A 77 77 GLU CB C 77 29.208 29.431 -0.223 1
1 885 . 26 1 1 A 77 77 GLU N N 77 121.574 122.861 -1.287 1
1 886 . 26 1 1 A 78 78 PHE H H 78 9.081 7.657 1.424 1
1 887 . 26 1 1 A 78 78 PHE HA H 78 3.778 4.210 -0.432 1
1 895 . 26 1 1 A 78 78 PHE C C 78 178.114 177.462 0.652 1
1 896 . 26 1 1 A 78 78 PHE CA C 78 60.629 61.206 -0.577 1
1 897 . 26 1 1 A 78 78 PHE CB C 78 38.295 38.801 -0.506 1
1 902 . 26 1 1 A 78 78 PHE N N 78 122.682 122.013 0.669 1
1 903 . 26 1 1 A 79 79 PHE H H 79 8.890 7.677 1.213 1
1 904 . 26 1 1 A 79 79 PHE HA H 79 3.800 4.015 -0.215 1
1 912 . 26 1 1 A 79 79 PHE C C 79 178.354 178.278 0.076 1
1 913 . 26 1 1 A 79 79 PHE CA C 79 60.704 62.234 -1.530 1
1 914 . 26 1 1 A 79 79 PHE CB C 79 37.184 38.323 -1.139 1
1 920 . 26 1 1 A 79 79 PHE N N 79 121.056 117.906 3.150 1
1 921 . 26 1 1 A 80 80 GLU H H 80 7.793 8.424 -0.631 1
1 922 . 26 1 1 A 80 80 GLU HA H 80 4.082 3.975 0.107 1
1 927 . 26 1 1 A 80 80 GLU C C 80 179.068 179.568 -0.500 1
1 928 . 26 1 1 A 80 80 GLU CA C 80 59.735 59.547 0.188 1
1 929 . 26 1 1 A 80 80 GLU CB C 80 28.722 29.241 -0.519 1
1 931 . 26 1 1 A 80 80 GLU N N 80 120.312 118.547 1.765 1
1 932 . 26 1 1 A 81 81 ASN H H 81 8.624 8.611 0.013 1
1 933 . 26 1 1 A 81 81 ASN HA H 81 4.521 4.516 0.005 1
1 938 . 26 1 1 A 81 81 ASN C C 81 179.262 178.322 0.940 1
1 939 . 26 1 1 A 81 81 ASN CA C 81 55.504 56.381 -0.877 1
1 940 . 26 1 1 A 81 81 ASN CB C 81 37.517 37.611 -0.094 1
1 941 . 26 1 1 A 81 81 ASN N N 81 119.338 118.474 0.864 1
1 943 . 26 1 1 A 82 82 CYS H H 82 8.554 8.035 0.519 1
1 944 . 26 1 1 A 82 82 CYS HA H 82 3.792 4.001 -0.209 1
1 947 . 26 1 1 A 82 82 CYS C C 82 176.478 177.306 -0.828 1
1 948 . 26 1 1 A 82 82 CYS CA C 82 65.232 62.962 2.270 1
1 949 . 26 1 1 A 82 82 CYS CB C 82 26.762 27.481 -0.719 1
1 950 . 26 1 1 A 82 82 CYS N N 82 120.576 118.270 2.306 1
1 951 . 26 1 1 A 83 83 ARG H H 83 8.522 7.984 0.538 1
1 952 . 26 1 1 A 83 83 ARG HA H 83 3.932 4.126 -0.194 1
1 960 . 26 1 1 A 83 83 ARG C C 83 179.138 178.740 0.398 1
1 961 . 26 1 1 A 83 83 ARG CA C 83 60.443 59.017 1.426 1
1 962 . 26 1 1 A 83 83 ARG CB C 83 29.550 29.828 -0.278 1
1 965 . 26 1 1 A 83 83 ARG N N 83 123.035 119.802 3.233 1
1 967 . 26 1 1 A 84 84 ASP H H 84 7.791 8.272 -0.481 1
1 968 . 26 1 1 A 84 84 ASP HA H 84 4.353 4.393 -0.040 1
1 971 . 26 1 1 A 84 84 ASP C C 84 178.649 178.705 -0.056 1
1 972 . 26 1 1 A 84 84 ASP CA C 84 57.767 57.632 0.135 1
1 973 . 26 1 1 A 84 84 ASP CB C 84 41.305 41.668 -0.363 1
1 974 . 26 1 1 A 84 84 ASP N N 84 120.332 119.604 0.728 1
1 975 . 26 1 1 A 85 85 THR H H 85 8.370 8.067 0.303 1
1 976 . 26 1 1 A 85 85 THR HA H 85 3.730 3.912 -0.182 1
1 981 . 26 1 1 A 85 85 THR C C 85 175.198 176.479 -1.281 1
1 982 . 26 1 1 A 85 85 THR CA C 85 66.830 65.881 0.949 1
1 983 . 26 1 1 A 85 85 THR CB C 85 68.533 68.390 0.143 1
1 985 . 26 1 1 A 85 85 THR N N 85 117.360 115.541 1.819 1
1 986 . 26 1 1 A 86 86 ALA H H 86 8.845 8.470 0.375 1
1 987 . 26 1 1 A 86 86 ALA HA H 86 3.991 4.157 -0.166 1
1 991 . 26 1 1 A 86 86 ALA C C 86 179.980 179.571 0.409 1
1 992 . 26 1 1 A 86 86 ALA CA C 86 55.769 55.735 0.034 1
1 993 . 26 1 1 A 86 86 ALA CB C 86 17.881 18.386 -0.505 1
1 994 . 26 1 1 A 86 86 ALA N N 86 123.613 123.038 0.575 1
1 995 . 26 1 1 A 87 87 LYS H H 87 7.686 8.377 -0.691 1
1 996 . 26 1 1 A 87 87 LYS HA H 87 4.099 4.077 0.022 1
1 1005 . 26 1 1 A 87 87 LYS C C 87 179.592 178.566 1.026 1
1 1006 . 26 1 1 A 87 87 LYS CA C 87 59.708 59.503 0.205 1
1 1007 . 26 1 1 A 87 87 LYS CB C 87 32.054 32.166 -0.112 1
1 1011 . 26 1 1 A 87 87 LYS N N 87 119.623 116.900 2.723 1
1 1012 . 26 1 1 A 88 88 ARG H H 88 7.683 7.582 0.101 1
1 1013 . 26 1 1 A 88 88 ARG HA H 88 4.051 4.163 -0.112 1
1 1020 . 26 1 1 A 88 88 ARG C C 88 180.053 178.113 1.940 1
1 1021 . 26 1 1 A 88 88 ARG CA C 88 59.558 58.870 0.688 1
1 1022 . 26 1 1 A 88 88 ARG CB C 88 29.684 29.828 -0.144 1
1 1025 . 26 1 1 A 88 88 ARG N N 88 120.788 119.421 1.367 1
1 1026 . 26 1 1 A 89 89 ASN H H 89 8.973 8.215 0.758 1
1 1027 . 26 1 1 A 89 89 ASN HA H 89 4.354 4.625 -0.271 1
1 1032 . 26 1 1 A 89 89 ASN C C 89 178.382 178.407 -0.025 1
1 1033 . 26 1 1 A 89 89 ASN CA C 89 55.334 55.595 -0.261 1
1 1034 . 26 1 1 A 89 89 ASN CB C 89 37.864 38.477 -0.613 1
1 1035 . 26 1 1 A 89 89 ASN N N 89 121.012 117.241 3.771 1
1 1037 . 26 1 1 A 90 90 GLN H H 90 8.152 8.195 -0.043 1
1 1038 . 26 1 1 A 90 90 GLN HA H 90 4.020 4.136 -0.116 1
1 1045 . 26 1 1 A 90 90 GLN C C 90 179.075 178.674 0.401 1
1 1046 . 26 1 1 A 90 90 GLN CA C 90 59.318 58.817 0.501 1
1 1047 . 26 1 1 A 90 90 GLN CB C 90 28.049 28.349 -0.300 1
1 1049 . 26 1 1 A 90 90 GLN N N 90 122.122 120.381 1.741 1
1 1051 . 26 1 1 A 91 91 GLN H H 91 7.514 8.138 -0.624 1
1 1052 . 26 1 1 A 91 91 GLN HA H 91 4.053 4.176 -0.123 1
1 1059 . 26 1 1 A 91 91 GLN C C 91 177.081 176.899 0.182 1
1 1060 . 26 1 1 A 91 91 GLN CA C 91 58.031 57.323 0.708 1
1 1061 . 26 1 1 A 91 91 GLN CB C 91 28.365 27.499 0.866 1
1 1063 . 26 1 1 A 91 91 GLN N N 91 118.124 117.963 0.161 1
1 1065 . 26 1 1 A 92 92 ALA H H 92 7.704 7.773 -0.069 1
1 1066 . 26 1 1 A 92 92 ALA HA H 92 4.246 4.375 -0.129 1
1 1070 . 26 1 1 A 92 92 ALA C C 92 178.450 177.888 0.562 1
1 1071 . 26 1 1 A 92 92 ALA CA C 92 52.671 52.078 0.593 1
1 1072 . 26 1 1 A 92 92 ALA CB C 92 19.316 20.118 -0.802 1
1 1073 . 26 1 1 A 92 92 ALA N N 92 119.880 121.357 -1.477 1
1 1074 . 26 1 1 A 93 93 GLY H H 93 7.693 7.998 -0.305 1
1 1075 . 26 1 1 A 93 93 GLY HA2 H 93 3.941 3.862 0.079 1
1 1076 . 26 1 1 A 93 93 GLY HA3 H 93 3.744 3.868 -0.124 1
1 1077 . 26 1 1 A 93 93 GLY C C 93 174.344 175.259 -0.915 1
1 1078 . 26 1 1 A 93 93 GLY CA C 93 45.949 46.551 -0.602 1
1 1079 . 26 1 1 A 93 93 GLY N N 93 105.347 107.064 -1.717 1
1 1080 . 26 1 1 A 94 94 ASN H H 94 7.076 9.002 -1.926 1
1 1081 . 26 1 1 A 94 94 ASN HA H 94 4.115 4.459 -0.344 1
1 1085 . 26 1 1 A 94 94 ASN C C 94 175.410 175.877 -0.467 1
1 1086 . 26 1 1 A 94 94 ASN CA C 94 52.651 52.540 0.111 1
1 1087 . 26 1 1 A 94 94 ASN CB C 94 38.330 39.333 -1.003 1
1 1088 . 26 1 1 A 94 94 ASN N N 94 115.747 116.952 -1.205 1
1 1090 . 26 1 1 A 95 95 GLY H H 95 8.236 8.716 -0.480 1
1 1091 . 26 1 1 A 95 95 GLY HA2 H 95 3.633 3.738 -0.105 1
1 1092 . 26 1 1 A 95 95 GLY HA3 H 95 3.633 3.858 -0.225 1
1 1093 . 26 1 1 A 95 95 GLY C C 95 174.450 173.605 0.845 1
1 1094 . 26 1 1 A 95 95 GLY CA C 95 45.522 45.665 -0.143 1
1 1095 . 26 1 1 A 95 95 GLY N N 95 109.166 108.625 0.541 1
1 1096 . 26 1 1 A 96 96 TRP H H 96 7.899 7.952 -0.053 1
1 1097 . 26 1 1 A 96 96 TRP HA H 96 5.241 5.129 0.112 1
1 1106 . 26 1 1 A 96 96 TRP C C 96 175.661 176.030 -0.369 1
1 1107 . 26 1 1 A 96 96 TRP CA C 96 55.090 56.315 -1.225 1
1 1108 . 26 1 1 A 96 96 TRP CB C 96 27.138 32.471 -5.333 1
1 1114 . 26 1 1 A 96 96 TRP N N 96 122.840 120.290 2.550 1
1 1116 . 26 1 1 A 97 97 ASP H H 97 7.344 8.985 -1.641 1
1 1117 . 26 1 1 A 97 97 ASP HA H 97 4.829 4.404 0.425 1
1 1120 . 26 1 1 A 97 97 ASP C C 97 175.019 176.471 -1.452 1
1 1121 . 26 1 1 A 97 97 ASP CA C 97 52.149 56.336 -4.187 1
1 1122 . 26 1 1 A 97 97 ASP CB C 97 42.697 38.666 4.031 1
1 1123 . 26 1 1 A 97 97 ASP N N 97 126.861 117.373 9.488 1
1 1124 . 26 1 1 A 98 98 PHE H H 98 8.566 8.646 -0.080 1
1 1125 . 26 1 1 A 98 98 PHE HA H 98 3.727 4.204 -0.477 1
1 1133 . 26 1 1 A 98 98 PHE C C 98 177.443 177.325 0.118 1
1 1134 . 26 1 1 A 98 98 PHE CA C 98 62.471 61.309 1.162 1
1 1135 . 26 1 1 A 98 98 PHE CB C 98 39.919 39.476 0.443 1
1 1141 . 26 1 1 A 98 98 PHE N N 98 117.781 121.112 -3.331 1
1 1142 . 26 1 1 A 99 99 ASP H H 99 8.259 8.263 -0.004 1
1 1143 . 26 1 1 A 99 99 ASP HA H 99 3.960 4.339 -0.379 1
1 1146 . 26 1 1 A 99 99 ASP C C 99 178.132 178.808 -0.676 1
1 1147 . 26 1 1 A 99 99 ASP CA C 99 57.658 56.442 1.216 1
1 1148 . 26 1 1 A 99 99 ASP CB C 99 38.572 41.250 -2.678 1
1 1149 . 26 1 1 A 99 99 ASP N N 99 121.709 119.287 2.422 1
1 1150 . 26 1 1 A 100 100 MET H H 100 8.008 8.198 -0.190 1
1 1151 . 26 1 1 A 100 100 MET HA H 100 3.644 4.496 -0.852 1
1 1156 . 26 1 1 A 100 100 MET C C 100 180.008 176.682 3.326 1
1 1157 . 26 1 1 A 100 100 MET CA C 100 58.598 58.161 0.437 1
1 1158 . 26 1 1 A 100 100 MET CB C 100 33.423 32.552 0.871 1
1 1160 . 26 1 1 A 100 100 MET N N 100 119.668 117.978 1.690 1
1 1161 . 26 1 1 A 101 101 LEU H H 101 7.961 7.939 0.022 1
1 1162 . 26 1 1 A 101 101 LEU HA H 101 3.523 4.500 -0.977 1
1 1172 . 26 1 1 A 101 101 LEU C C 101 173.873 176.495 -2.622 1
1 1173 . 26 1 1 A 101 101 LEU CA C 101 58.743 53.928 4.815 1
1 1174 . 26 1 1 A 101 101 LEU CB C 101 42.632 41.556 1.076 1
1 1178 . 26 1 1 A 101 101 LEU N N 101 119.752 120.127 -0.375 1
1 1179 . 26 1 1 A 102 102 THR H H 102 6.955 8.189 -1.234 1
1 1180 . 26 1 1 A 102 102 THR HA H 102 4.134 4.284 -0.150 1
1 1185 . 26 1 1 A 102 102 THR C C 102 176.513 175.498 1.015 1
1 1186 . 26 1 1 A 102 102 THR CA C 102 61.125 62.730 -1.605 1
1 1187 . 26 1 1 A 102 102 THR CB C 102 71.415 71.414 0.001 1
1 1189 . 26 1 1 A 102 102 THR N N 102 124.665 117.850 6.815 1
1 1190 . 26 1 1 A 103 103 GLY H H 103 7.816 8.083 -0.267 1
1 1191 . 26 1 1 A 103 103 GLY HA2 H 103 3.824 3.996 -0.172 1
1 1192 . 26 1 1 A 103 103 GLY HA3 H 103 3.824 4.118 -0.294 1
1 1193 . 26 1 1 A 103 103 GLY C C 103 174.126 175.159 -1.033 1
1 1194 . 26 1 1 A 103 103 GLY CA C 103 47.805 46.748 1.057 1
1 1195 . 26 1 1 A 103 103 GLY N N 103 114.191 109.873 4.318 1
1 1196 . 26 1 1 A 104 104 SER H H 104 8.860 8.185 0.675 1
1 1197 . 26 1 1 A 104 104 SER HA H 104 4.758 4.498 0.260 1
1 1200 . 26 1 1 A 104 104 SER C C 104 174.591 174.963 -0.372 1
1 1201 . 26 1 1 A 104 104 SER CA C 104 56.755 59.331 -2.576 1
1 1202 . 26 1 1 A 104 104 SER CB C 104 65.050 63.770 1.280 1
1 1203 . 26 1 1 A 104 104 SER N N 104 114.771 113.163 1.608 1
1 1204 . 26 1 1 A 105 105 GLY H H 105 8.788 7.632 1.156 1
1 1205 . 26 1 1 A 105 105 GLY HA2 H 105 3.733 3.981 -0.248 1
1 1206 . 26 1 1 A 105 105 GLY HA3 H 105 3.733 4.004 -0.271 1
1 1207 . 26 1 1 A 105 105 GLY CA C 105 47.247 45.915 1.332 1
1 1208 . 26 1 1 A 105 105 GLY N N 105 110.394 108.742 1.652 1
1 1209 . 26 1 1 A 106 106 ASN HA H 106 4.454 4.504 -0.050 1
1 1212 . 26 1 1 A 106 106 ASN C C 106 175.180 175.873 -0.693 1
1 1213 . 26 1 1 A 106 106 ASN CA C 106 54.492 55.888 -1.396 1
1 1214 . 26 1 1 A 106 106 ASN CB C 106 37.282 39.309 -2.027 1
1 1215 . 26 1 1 A 107 107 TYR H H 107 8.241 8.080 0.161 1
1 1216 . 26 1 1 A 107 107 TYR HA H 107 4.335 4.817 -0.482 1
1 1223 . 26 1 1 A 107 107 TYR C C 107 173.954 175.832 -1.878 1
1 1224 . 26 1 1 A 107 107 TYR CA C 107 57.727 57.108 0.619 1
1 1225 . 26 1 1 A 107 107 TYR CB C 107 37.063 40.052 -2.989 1
1 1230 . 26 1 1 A 107 107 TYR N N 107 120.708 112.646 8.062 1
1 1231 . 26 1 1 A 108 108 SER H H 108 7.117 7.940 -0.823 1
1 1232 . 26 1 1 A 108 108 SER HA H 108 4.221 4.290 -0.069 1
1 1235 . 26 1 1 A 108 108 SER C C 108 174.834 174.280 0.554 1
1 1236 . 26 1 1 A 108 108 SER CA C 108 59.859 58.276 1.583 1
1 1237 . 26 1 1 A 108 108 SER CB C 108 63.846 63.066 0.780 1
1 1238 . 26 1 1 A 108 108 SER N N 108 113.362 115.409 -2.047 1
1 1239 . 26 1 1 A 109 109 SER H H 109 8.053 7.462 0.591 1
1 1240 . 26 1 1 A 109 109 SER HA H 109 4.560 4.507 0.053 1
1 1243 . 26 1 1 A 109 109 SER CA C 109 57.141 58.232 -1.091 1
1 1244 . 26 1 1 A 109 109 SER CB C 109 64.874 64.712 0.162 1
1 1245 . 26 1 1 A 109 109 SER N N 109 116.657 116.906 -0.249 1
1 1246 . 26 1 1 A 110 110 THR HA H 110 3.541 3.838 -0.297 1
1 1251 . 26 1 1 A 110 110 THR C C 110 175.477 175.867 -0.390 1
1 1252 . 26 1 1 A 110 110 THR CA C 110 66.443 65.832 0.611 1
1 1253 . 26 1 1 A 110 110 THR CB C 110 68.091 68.491 -0.400 1
1 1255 . 26 1 1 A 111 111 ASP H H 111 8.224 8.250 -0.026 1
1 1256 . 26 1 1 A 111 111 ASP HA H 111 4.237 4.233 0.004 1
1 1259 . 26 1 1 A 111 111 ASP C C 111 177.520 178.494 -0.974 1
1 1260 . 26 1 1 A 111 111 ASP CA C 111 57.559 57.265 0.294 1
1 1261 . 26 1 1 A 111 111 ASP CB C 111 40.292 40.619 -0.327 1
1 1262 . 26 1 1 A 111 111 ASP N N 111 119.490 120.156 -0.666 1
1 1263 . 26 1 1 A 112 112 ALA H H 112 7.431 7.765 -0.334 1
1 1264 . 26 1 1 A 112 112 ALA HA H 112 4.191 4.074 0.117 1
1 1268 . 26 1 1 A 112 112 ALA C C 112 180.646 179.767 0.879 1
1 1269 . 26 1 1 A 112 112 ALA CA C 112 54.534 55.047 -0.513 1
1 1270 . 26 1 1 A 112 112 ALA CB C 112 18.992 18.689 0.303 1
1 1271 . 26 1 1 A 112 112 ALA N N 112 119.710 122.300 -2.590 1
1 1272 . 26 1 1 A 113 113 GLN H H 113 7.576 7.746 -0.170 1
1 1273 . 26 1 1 A 113 113 GLN HA H 113 3.562 4.147 -0.585 1
1 1278 . 26 1 1 A 113 113 GLN C C 113 176.756 177.814 -1.058 1
1 1279 . 26 1 1 A 113 113 GLN CA C 113 57.736 58.590 -0.854 1
1 1280 . 26 1 1 A 113 113 GLN CB C 113 29.110 28.147 0.963 1
1 1281 . 26 1 1 A 113 113 GLN N N 113 117.518 117.819 -0.301 1
1 1283 . 26 1 1 A 114 114 MET H H 114 8.192 7.801 0.391 1
1 1284 . 26 1 1 A 114 114 MET HA H 114 4.231 4.046 0.185 1
1 1289 . 26 1 1 A 114 114 MET C C 114 175.648 178.257 -2.609 1
1 1290 . 26 1 1 A 114 114 MET CA C 114 57.446 58.547 -1.101 1
1 1291 . 26 1 1 A 114 114 MET CB C 114 33.570 31.798 1.772 1
1 1293 . 26 1 1 A 114 114 MET N N 114 111.509 119.699 -8.190 1
1 1294 . 26 1 1 A 115 115 GLN H H 115 6.940 7.326 -0.386 1
1 1295 . 26 1 1 A 115 115 GLN HA H 115 4.307 4.178 0.129 1
1 1302 . 26 1 1 A 115 115 GLN C C 115 176.270 175.763 0.507 1
1 1303 . 26 1 1 A 115 115 GLN CA C 115 54.680 58.469 -3.789 1
1 1304 . 26 1 1 A 115 115 GLN CB C 115 28.233 28.947 -0.714 1
1 1306 . 26 1 1 A 115 115 GLN N N 115 114.300 116.713 -2.413 1
1 1308 . 26 1 1 A 116 116 TYR H H 116 6.677 8.009 -1.332 1
1 1309 . 26 1 1 A 116 116 TYR HA H 116 4.193 4.091 0.102 1
1 1312 . 26 1 1 A 116 116 TYR C C 116 175.268 174.241 1.027 1
1 1313 . 26 1 1 A 116 116 TYR CA C 116 54.357 58.701 -4.344 1
1 1314 . 26 1 1 A 116 116 TYR CB C 116 35.498 36.390 -0.892 1
1 1315 . 26 1 1 A 116 116 TYR N N 116 117.919 118.995 -1.076 1
1 1316 . 26 1 1 A 117 117 ASP H H 117 8.081 8.139 -0.058 1
1 1317 . 26 1 1 A 117 117 ASP HA H 117 4.665 4.895 -0.230 1
1 1320 . 26 1 1 A 117 117 ASP CA C 117 52.422 50.428 1.994 1
1 1321 . 26 1 1 A 117 117 ASP CB C 117 42.416 41.133 1.283 1
1 1322 . 26 1 1 A 117 117 ASP N N 117 120.887 121.955 -1.068 1
1 1323 . 26 1 1 A 118 118 PRO C C 118 179.180 177.998 1.182 1
1 1324 . 26 1 1 A 118 118 PRO CA C 118 65.942 64.948 0.994 1
1 1325 . 26 1 1 A 118 118 PRO CB C 118 32.197 31.751 0.446 1
1 1326 . 26 1 1 A 119 119 GLY H H 119 9.742 8.237 1.505 1
1 1327 . 26 1 1 A 119 119 GLY C C 119 175.622 175.318 0.304 1
1 1328 . 26 1 1 A 119 119 GLY CA C 119 46.785 45.990 0.795 1
1 1329 . 26 1 1 A 119 119 GLY N N 119 106.412 105.846 0.566 1
1 1330 . 26 1 1 A 120 120 LEU H H 120 6.666 7.409 -0.743 1
1 1331 . 26 1 1 A 120 120 LEU HA H 120 3.365 3.795 -0.430 1
1 1341 . 26 1 1 A 120 120 LEU C C 120 179.262 178.189 1.073 1
1 1342 . 26 1 1 A 120 120 LEU CA C 120 56.605 56.880 -0.275 1
1 1343 . 26 1 1 A 120 120 LEU CB C 120 39.262 41.039 -1.777 1
1 1347 . 26 1 1 A 120 120 LEU N N 120 126.226 122.632 3.594 1
1 1348 . 26 1 1 A 121 121 PHE H H 121 7.356 8.548 -1.192 1
1 1349 . 26 1 1 A 121 121 PHE HA H 121 4.459 3.920 0.539 1
1 1352 . 26 1 1 A 121 121 PHE C C 121 179.716 177.920 1.796 1
1 1353 . 26 1 1 A 121 121 PHE CA C 121 62.838 62.103 0.735 1
1 1354 . 26 1 1 A 121 121 PHE CB C 121 37.603 39.250 -1.647 1
1 1355 . 26 1 1 A 121 121 PHE N N 121 117.437 119.411 -1.974 1
1 1356 . 26 1 1 A 122 122 ALA H H 122 7.926 7.959 -0.033 1
1 1357 . 26 1 1 A 122 122 ALA HA H 122 4.523 3.882 0.641 1
1 1361 . 26 1 1 A 122 122 ALA C C 122 180.435 179.698 0.737 1
1 1362 . 26 1 1 A 122 122 ALA CA C 122 55.527 55.434 0.093 1
1 1363 . 26 1 1 A 122 122 ALA CB C 122 17.814 18.125 -0.311 1
1 1364 . 26 1 1 A 122 122 ALA N N 122 121.068 121.383 -0.315 1
1 1365 . 26 1 1 A 123 123 GLN H H 123 7.507 7.644 -0.137 1
1 1366 . 26 1 1 A 123 123 GLN HA H 123 4.153 4.009 0.144 1
1 1371 . 26 1 1 A 123 123 GLN C C 123 180.561 178.303 2.258 1
1 1372 . 26 1 1 A 123 123 GLN CA C 123 59.948 59.068 0.880 1
1 1373 . 26 1 1 A 123 123 GLN CB C 123 29.135 28.576 0.559 1
1 1375 . 26 1 1 A 123 123 GLN N N 123 120.324 117.776 2.548 1
1 1376 . 26 1 1 A 124 124 ILE H H 124 8.318 8.174 0.144 1
1 1377 . 26 1 1 A 124 124 ILE HA H 124 3.635 3.862 -0.227 1
1 1387 . 26 1 1 A 124 124 ILE C C 124 176.481 178.134 -1.653 1
1 1388 . 26 1 1 A 124 124 ILE CA C 124 66.432 64.496 1.936 1
1 1389 . 26 1 1 A 124 124 ILE CB C 124 39.168 37.797 1.371 1
1 1393 . 26 1 1 A 124 124 ILE N N 124 123.747 119.134 4.613 1
1 1394 . 26 1 1 A 125 125 GLN H H 125 8.474 8.046 0.428 1
1 1395 . 26 1 1 A 125 125 GLN HA H 125 4.264 3.950 0.314 1
1 1402 . 26 1 1 A 125 125 GLN C C 125 178.947 177.753 1.194 1
1 1403 . 26 1 1 A 125 125 GLN CA C 125 59.651 58.465 1.186 1
1 1404 . 26 1 1 A 125 125 GLN CB C 125 28.880 28.575 0.305 1
1 1406 . 26 1 1 A 125 125 GLN N N 125 120.368 121.140 -0.772 1
1 1408 . 26 1 1 A 126 126 ALA H H 126 8.002 7.905 0.097 1
1 1409 . 26 1 1 A 126 126 ALA HA H 126 4.144 4.005 0.139 1
1 1413 . 26 1 1 A 126 126 ALA C C 126 179.316 179.785 -0.469 1
1 1414 . 26 1 1 A 126 126 ALA CA C 126 55.036 55.004 0.032 1
1 1415 . 26 1 1 A 126 126 ALA CB C 126 18.087 17.838 0.249 1
1 1416 . 26 1 1 A 126 126 ALA N N 126 121.661 121.163 0.498 1
1 1417 . 26 1 1 A 127 127 ALA H H 127 7.823 7.985 -0.162 1
1 1418 . 26 1 1 A 127 127 ALA HA H 127 4.162 4.054 0.108 1
1 1422 . 26 1 1 A 127 127 ALA C C 127 180.707 179.413 1.294 1
1 1423 . 26 1 1 A 127 127 ALA CA C 127 55.080 54.817 0.263 1
1 1424 . 26 1 1 A 127 127 ALA CB C 127 19.354 18.326 1.028 1
1 1425 . 26 1 1 A 127 127 ALA N N 127 119.853 119.613 0.240 1
1 1426 . 26 1 1 A 128 128 ALA H H 128 8.936 7.783 1.153 1
1 1427 . 26 1 1 A 128 128 ALA HA H 128 3.928 3.736 0.192 1
1 1431 . 26 1 1 A 128 128 ALA C C 128 181.031 179.391 1.640 1
1 1432 . 26 1 1 A 128 128 ALA CA C 128 55.502 54.648 0.854 1
1 1433 . 26 1 1 A 128 128 ALA CB C 128 16.609 17.828 -1.219 1
1 1434 . 26 1 1 A 128 128 ALA N N 128 121.355 120.550 0.805 1
1 1435 . 26 1 1 A 129 129 THR H H 129 8.543 7.399 1.144 1
1 1436 . 26 1 1 A 129 129 THR HA H 129 4.015 3.627 0.388 1
1 1441 . 26 1 1 A 129 129 THR C C 129 177.332 175.938 1.394 1
1 1442 . 26 1 1 A 129 129 THR CA C 129 65.893 64.787 1.106 1
1 1443 . 26 1 1 A 129 129 THR CB C 129 68.566 68.543 0.023 1
1 1445 . 26 1 1 A 129 129 THR N N 129 112.709 111.955 0.754 1
1 1446 . 26 1 1 A 130 130 LYS H H 130 8.126 7.489 0.637 1
1 1447 . 26 1 1 A 130 130 LYS HA H 130 4.000 3.996 0.004 1
1 1456 . 26 1 1 A 130 130 LYS C C 130 179.082 178.743 0.339 1
1 1457 . 26 1 1 A 130 130 LYS CA C 130 60.299 58.454 1.845 1
1 1458 . 26 1 1 A 130 130 LYS CB C 130 32.767 31.730 1.037 1
1 1462 . 26 1 1 A 130 130 LYS N N 130 123.879 120.743 3.136 1
1 1463 . 26 1 1 A 131 131 ALA H H 131 7.184 7.721 -0.537 1
1 1464 . 26 1 1 A 131 131 ALA HA H 131 4.005 4.211 -0.206 1
1 1468 . 26 1 1 A 131 131 ALA C C 131 178.482 179.512 -1.030 1
1 1469 . 26 1 1 A 131 131 ALA CA C 131 55.027 55.058 -0.031 1
1 1470 . 26 1 1 A 131 131 ALA CB C 131 18.669 19.527 -0.858 1
1 1471 . 26 1 1 A 131 131 ALA N N 131 118.590 121.166 -2.576 1
1 1472 . 26 1 1 A 132 132 TRP H H 132 7.977 8.630 -0.653 1
1 1473 . 26 1 1 A 132 132 TRP HA H 132 4.001 4.298 -0.297 1
1 1480 . 26 1 1 A 132 132 TRP C C 132 177.332 175.716 1.616 1
1 1481 . 26 1 1 A 132 132 TRP CA C 132 60.431 57.384 3.047 1
1 1482 . 26 1 1 A 132 132 TRP CB C 132 27.786 27.663 0.123 1
1 1486 . 26 1 1 A 132 132 TRP N N 132 119.168 116.987 2.181 1
1 1488 . 26 1 1 A 133 133 ARG H H 133 8.006 8.059 -0.053 1
1 1489 . 26 1 1 A 133 133 ARG HA H 133 4.027 4.339 -0.312 1
1 1497 . 26 1 1 A 133 133 ARG C C 133 176.664 177.652 -0.988 1
1 1498 . 26 1 1 A 133 133 ARG CA C 133 59.355 57.247 2.108 1
1 1499 . 26 1 1 A 133 133 ARG CB C 133 30.451 32.299 -1.848 1
1 1502 . 26 1 1 A 133 133 ARG N N 133 113.062 120.643 -7.581 1
1 1504 . 26 1 1 A 134 134 LYS H H 134 7.322 7.663 -0.341 1
1 1505 . 26 1 1 A 134 134 LYS HA H 134 4.313 4.373 -0.060 1
1 1514 . 26 1 1 A 134 134 LYS C C 134 176.282 175.576 0.706 1
1 1515 . 26 1 1 A 134 134 LYS CA C 134 54.922 56.521 -1.599 1
1 1516 . 26 1 1 A 134 134 LYS CB C 134 32.633 31.887 0.746 1
1 1520 . 26 1 1 A 134 134 LYS N N 134 118.170 118.339 -0.169 1
1 1521 . 26 1 1 A 135 135 LEU H H 135 7.440 7.641 -0.201 1
1 1522 . 26 1 1 A 135 135 LEU HA H 135 4.174 4.881 -0.707 1
1 1532 . 26 1 1 A 135 135 LEU CA C 135 54.408 51.418 2.990 1
1 1533 . 26 1 1 A 135 135 LEU CB C 135 40.407 43.942 -3.535 1
1 1537 . 26 1 1 A 135 135 LEU N N 135 123.358 117.002 6.356 1
1 1538 . 26 1 1 A 136 136 PRO HA H 136 4.437 4.488 -0.051 1
1 1545 . 26 1 1 A 136 136 PRO C C 136 177.106 178.262 -1.156 1
1 1546 . 26 1 1 A 136 136 PRO CA C 136 62.889 64.229 -1.340 1
1 1547 . 26 1 1 A 136 136 PRO CB C 136 32.192 32.091 0.101 1
1 1550 . 26 1 1 A 137 137 VAL H H 137 8.219 7.915 0.304 1
1 1551 . 26 1 1 A 137 137 VAL HA H 137 4.077 3.648 0.429 1
1 1559 . 26 1 1 A 137 137 VAL C C 137 176.305 177.356 -1.051 1
1 1560 . 26 1 1 A 137 137 VAL CA C 137 61.958 66.608 -4.650 1
1 1561 . 26 1 1 A 137 137 VAL CB C 137 32.755 31.623 1.132 1
1 1564 . 26 1 1 A 137 137 VAL N N 137 120.079 117.049 3.030 1
1 1565 . 26 1 1 A 138 138 LYS H H 138 8.444 7.894 0.550 1
1 1566 . 26 1 1 A 138 138 LYS HA H 138 4.316 4.241 0.075 1
1 1575 . 26 1 1 A 138 138 LYS C C 138 176.790 176.593 0.197 1
1 1576 . 26 1 1 A 138 138 LYS CA C 138 56.792 56.402 0.390 1
1 1577 . 26 1 1 A 138 138 LYS CB C 138 33.205 31.806 1.399 1
1 1581 . 26 1 1 A 138 138 LYS N N 138 126.449 120.379 6.070 1
1 1582 . 26 1 1 A 139 139 GLY H H 139 8.518 8.012 0.506 1
1 1583 . 26 1 1 A 139 139 GLY HA2 H 139 4.070 4.027 0.043 1
1 1584 . 26 1 1 A 139 139 GLY HA3 H 139 3.897 4.039 -0.142 1
1 1585 . 26 1 1 A 139 139 GLY C C 139 172.874 174.236 -1.362 1
1 1586 . 26 1 1 A 139 139 GLY CA C 139 45.157 45.963 -0.806 1
1 1587 . 26 1 1 A 139 139 GLY N N 139 112.617 113.158 -0.541 1
1 6 . 27 1 1 A 2 2 VAL H H 2 8.992 8.980 0.012 1
1 7 . 27 1 1 A 2 2 VAL HA H 2 5.370 4.398 0.972 1
1 15 . 27 1 1 A 2 2 VAL C C 2 174.325 174.913 -0.588 1
1 16 . 27 1 1 A 2 2 VAL CA C 2 61.267 62.528 -1.261 1
1 17 . 27 1 1 A 2 2 VAL CB C 2 33.890 32.202 1.688 1
1 20 . 27 1 1 A 2 2 VAL N N 2 126.939 121.948 4.991 1
1 21 . 27 1 1 A 3 3 THR H H 3 8.912 8.724 0.188 1
1 22 . 27 1 1 A 3 3 THR HA H 3 4.505 5.032 -0.527 1
1 27 . 27 1 1 A 3 3 THR C C 3 172.710 172.712 -0.002 1
1 28 . 27 1 1 A 3 3 THR CA C 3 59.689 59.920 -0.231 1
1 29 . 27 1 1 A 3 3 THR CB C 3 72.398 72.037 0.361 1
1 31 . 27 1 1 A 3 3 THR N N 3 118.091 121.291 -3.200 1
1 32 . 27 1 1 A 4 4 GLU H H 4 8.631 8.842 -0.211 1
1 33 . 27 1 1 A 4 4 GLU HA H 4 5.788 5.042 0.746 1
1 38 . 27 1 1 A 4 4 GLU C C 4 175.758 174.464 1.294 1
1 39 . 27 1 1 A 4 4 GLU CA C 4 54.902 54.316 0.586 1
1 40 . 27 1 1 A 4 4 GLU CB C 4 35.097 34.027 1.070 1
1 42 . 27 1 1 A 4 4 GLU N N 4 120.966 125.398 -4.432 1
1 43 . 27 1 1 A 5 5 THR H H 5 9.188 8.925 0.263 1
1 44 . 27 1 1 A 5 5 THR HA H 5 4.739 5.038 -0.299 1
1 49 . 27 1 1 A 5 5 THR C C 5 172.757 172.524 0.233 1
1 50 . 27 1 1 A 5 5 THR CA C 5 60.382 60.000 0.382 1
1 51 . 27 1 1 A 5 5 THR CB C 5 71.558 72.171 -0.613 1
1 53 . 27 1 1 A 5 5 THR N N 5 119.366 114.866 4.500 1
1 54 . 27 1 1 A 6 6 VAL H H 6 8.476 8.888 -0.412 1
1 55 . 27 1 1 A 6 6 VAL HA H 6 5.026 5.278 -0.252 1
1 63 . 27 1 1 A 6 6 VAL C C 6 176.674 175.302 1.372 1
1 64 . 27 1 1 A 6 6 VAL CA C 6 61.008 61.093 -0.085 1
1 65 . 27 1 1 A 6 6 VAL CB C 6 33.861 33.725 0.136 1
1 68 . 27 1 1 A 6 6 VAL N N 6 121.384 125.578 -4.194 1
1 69 . 27 1 1 A 7 7 ASP H H 7 8.848 9.161 -0.313 1
1 70 . 27 1 1 A 7 7 ASP HA H 7 4.797 4.860 -0.063 1
1 73 . 27 1 1 A 7 7 ASP CA C 7 52.834 55.109 -2.275 1
1 74 . 27 1 1 A 7 7 ASP CB C 7 42.219 42.360 -0.141 1
1 75 . 27 1 1 A 7 7 ASP N N 7 127.061 127.465 -0.404 1
1 76 . 27 1 1 A 8 8 GLY C C 8 175.143 174.874 0.269 1
1 77 . 27 1 1 A 8 8 GLY CA C 8 46.553 46.966 -0.413 1
1 78 . 27 1 1 A 9 9 GLN H H 9 8.408 7.828 0.580 1
1 79 . 27 1 1 A 9 9 GLN HA H 9 4.541 4.238 0.303 1
1 86 . 27 1 1 A 9 9 GLN C C 9 176.463 177.021 -0.558 1
1 87 . 27 1 1 A 9 9 GLN CA C 9 55.167 55.346 -0.179 1
1 88 . 27 1 1 A 9 9 GLN CB C 9 29.376 27.822 1.554 1
1 90 . 27 1 1 A 9 9 GLN N N 9 118.300 116.659 1.641 1
1 92 . 27 1 1 A 10 10 GLY H H 10 8.162 8.355 -0.193 1
1 93 . 27 1 1 A 10 10 GLY HA2 H 10 4.174 3.979 0.195 1
1 94 . 27 1 1 A 10 10 GLY HA3 H 10 3.521 3.997 -0.476 1
1 95 . 27 1 1 A 10 10 GLY C C 10 174.092 173.922 0.170 1
1 96 . 27 1 1 A 10 10 GLY CA C 10 45.558 46.442 -0.884 1
1 97 . 27 1 1 A 10 10 GLY N N 10 108.747 111.003 -2.256 1
1 98 . 27 1 1 A 11 11 GLN H H 11 8.507 7.779 0.728 1
1 99 . 27 1 1 A 11 11 GLN HA H 11 4.202 4.808 -0.606 1
1 106 . 27 1 1 A 11 11 GLN C C 11 173.992 174.372 -0.380 1
1 107 . 27 1 1 A 11 11 GLN CA C 11 55.098 54.561 0.537 1
1 108 . 27 1 1 A 11 11 GLN CB C 11 29.097 30.591 -1.494 1
1 110 . 27 1 1 A 11 11 GLN N N 11 122.979 116.518 6.461 1
1 112 . 27 1 1 A 12 12 ALA H H 12 8.259 8.891 -0.632 1
1 113 . 27 1 1 A 12 12 ALA HA H 12 5.156 5.481 -0.325 1
1 117 . 27 1 1 A 12 12 ALA C C 12 177.284 176.823 0.461 1
1 118 . 27 1 1 A 12 12 ALA CA C 12 51.087 51.121 -0.034 1
1 119 . 27 1 1 A 12 12 ALA CB C 12 20.500 20.800 -0.300 1
1 120 . 27 1 1 A 12 12 ALA N N 12 127.100 126.068 1.032 1
1 121 . 27 1 1 A 13 13 TRP H H 13 9.245 8.891 0.354 1
1 122 . 27 1 1 A 13 13 TRP HA H 13 4.717 5.596 -0.879 1
1 131 . 27 1 1 A 13 13 TRP C C 13 175.108 174.435 0.673 1
1 132 . 27 1 1 A 13 13 TRP CA C 13 55.966 55.555 0.411 1
1 133 . 27 1 1 A 13 13 TRP CB C 13 31.912 32.483 -0.571 1
1 139 . 27 1 1 A 13 13 TRP N N 13 123.088 119.530 3.558 1
1 141 . 27 1 1 A 14 14 ARG H H 14 8.575 8.840 -0.265 1
1 142 . 27 1 1 A 14 14 ARG HA H 14 5.335 4.511 0.824 1
1 150 . 27 1 1 A 14 14 ARG C C 14 175.191 174.236 0.955 1
1 151 . 27 1 1 A 14 14 ARG CA C 14 53.106 55.203 -2.097 1
1 152 . 27 1 1 A 14 14 ARG CB C 14 32.749 31.637 1.112 1
1 154 . 27 1 1 A 14 14 ARG N N 14 121.163 120.150 1.013 1
1 156 . 27 1 1 A 15 15 HIS H H 15 8.595 8.045 0.550 1
1 157 . 27 1 1 A 15 15 HIS HA H 15 4.790 5.140 -0.350 1
1 161 . 27 1 1 A 15 15 HIS C C 15 173.770 175.159 -1.389 1
1 162 . 27 1 1 A 15 15 HIS CA C 15 55.289 54.743 0.546 1
1 163 . 27 1 1 A 15 15 HIS CB C 15 33.208 33.131 0.077 1
1 165 . 27 1 1 A 15 15 HIS N N 15 117.643 119.570 -1.927 1
1 166 . 27 1 1 A 16 16 HIS H H 16 8.993 8.941 0.052 1
1 167 . 27 1 1 A 16 16 HIS HA H 16 5.158 4.746 0.412 1
1 171 . 27 1 1 A 16 16 HIS C C 16 173.608 174.304 -0.696 1
1 172 . 27 1 1 A 16 16 HIS CA C 16 56.450 55.457 0.993 1
1 173 . 27 1 1 A 16 16 HIS CB C 16 34.171 30.757 3.414 1
1 175 . 27 1 1 A 16 16 HIS N N 16 123.520 121.041 2.479 1
1 176 . 27 1 1 A 17 17 ASN H H 17 7.829 8.387 -0.558 1
1 177 . 27 1 1 A 17 17 ASN HA H 17 4.713 4.955 -0.242 1
1 182 . 27 1 1 A 17 17 ASN C C 17 173.682 173.864 -0.182 1
1 183 . 27 1 1 A 17 17 ASN CA C 17 51.822 51.643 0.179 1
1 184 . 27 1 1 A 17 17 ASN CB C 17 43.176 42.536 0.640 1
1 185 . 27 1 1 A 17 17 ASN N N 17 122.213 119.474 2.739 1
1 187 . 27 1 1 A 18 18 GLY H H 18 8.423 8.434 -0.011 1
1 188 . 27 1 1 A 18 18 GLY HA2 H 18 3.931 3.553 0.378 1
1 189 . 27 1 1 A 18 18 GLY HA3 H 18 3.707 3.876 -0.169 1
1 190 . 27 1 1 A 18 18 GLY C C 18 173.985 173.102 0.883 1
1 191 . 27 1 1 A 18 18 GLY CA C 18 43.949 45.298 -1.349 1
1 192 . 27 1 1 A 18 18 GLY N N 18 106.991 111.281 -4.290 1
1 193 . 27 1 1 A 19 19 PHE H H 19 8.338 7.737 0.601 1
1 194 . 27 1 1 A 19 19 PHE HA H 19 4.068 4.604 -0.536 1
1 197 . 27 1 1 A 19 19 PHE C C 19 176.568 175.637 0.931 1
1 198 . 27 1 1 A 19 19 PHE CA C 19 59.338 59.344 -0.006 1
1 199 . 27 1 1 A 19 19 PHE CB C 19 40.201 39.654 0.547 1
1 200 . 27 1 1 A 19 19 PHE N N 19 116.857 119.707 -2.850 1
1 201 . 27 1 1 A 20 20 ASP H H 20 8.794 8.642 0.152 1
1 202 . 27 1 1 A 20 20 ASP HA H 20 4.485 4.861 -0.376 1
1 205 . 27 1 1 A 20 20 ASP C C 20 177.379 176.678 0.701 1
1 206 . 27 1 1 A 20 20 ASP CA C 20 54.140 54.052 0.088 1
1 207 . 27 1 1 A 20 20 ASP CB C 20 41.915 41.716 0.199 1
1 208 . 27 1 1 A 20 20 ASP N N 20 123.025 124.108 -1.083 1
1 209 . 27 1 1 A 21 21 PHE H H 21 8.862 9.117 -0.255 1
1 210 . 27 1 1 A 21 21 PHE HA H 21 4.087 4.057 0.030 1
1 218 . 27 1 1 A 21 21 PHE C C 21 176.952 177.207 -0.255 1
1 219 . 27 1 1 A 21 21 PHE CA C 21 61.095 62.341 -1.246 1
1 220 . 27 1 1 A 21 21 PHE CB C 21 38.678 39.459 -0.781 1
1 226 . 27 1 1 A 21 21 PHE N N 21 127.163 127.411 -0.248 1
1 227 . 27 1 1 A 22 22 ALA H H 22 8.561 8.298 0.263 1
1 228 . 27 1 1 A 22 22 ALA HA H 22 3.878 3.996 -0.118 1
1 232 . 27 1 1 A 22 22 ALA C C 22 180.710 180.063 0.647 1
1 233 . 27 1 1 A 22 22 ALA CA C 22 55.211 55.236 -0.025 1
1 234 . 27 1 1 A 22 22 ALA CB C 22 18.321 18.599 -0.278 1
1 235 . 27 1 1 A 22 22 ALA N N 22 120.293 121.068 -0.775 1
1 236 . 27 1 1 A 23 23 VAL H H 23 7.241 7.775 -0.534 1
1 237 . 27 1 1 A 23 23 VAL HA H 23 3.684 3.498 0.186 1
1 245 . 27 1 1 A 23 23 VAL C C 23 177.101 177.728 -0.627 1
1 246 . 27 1 1 A 23 23 VAL CA C 23 65.237 66.952 -1.715 1
1 247 . 27 1 1 A 23 23 VAL CB C 23 31.780 31.467 0.313 1
1 250 . 27 1 1 A 23 23 VAL N N 23 118.775 117.587 1.188 1
1 251 . 27 1 1 A 24 24 ILE H H 24 6.761 8.254 -1.493 1
1 252 . 27 1 1 A 24 24 ILE HA H 24 3.196 3.514 -0.318 1
1 262 . 27 1 1 A 24 24 ILE C C 24 177.287 177.989 -0.702 1
1 263 . 27 1 1 A 24 24 ILE CA C 24 63.404 65.576 -2.172 1
1 264 . 27 1 1 A 24 24 ILE CB C 24 36.294 37.671 -1.377 1
1 268 . 27 1 1 A 24 24 ILE N N 24 119.036 119.675 -0.639 1
1 269 . 27 1 1 A 25 25 LYS H H 25 8.032 8.267 -0.235 1
1 270 . 27 1 1 A 25 25 LYS HA H 25 3.809 3.695 0.114 1
1 279 . 27 1 1 A 25 25 LYS C C 25 179.450 178.521 0.929 1
1 280 . 27 1 1 A 25 25 LYS CA C 25 59.621 59.569 0.052 1
1 281 . 27 1 1 A 25 25 LYS CB C 25 32.259 32.039 0.220 1
1 285 . 27 1 1 A 25 25 LYS N N 25 118.368 120.522 -2.154 1
1 286 . 27 1 1 A 26 26 GLU H H 26 7.845 7.928 -0.083 1
1 287 . 27 1 1 A 26 26 GLU HA H 26 4.021 4.216 -0.195 1
1 292 . 27 1 1 A 26 26 GLU C C 26 179.191 178.824 0.367 1
1 293 . 27 1 1 A 26 26 GLU CA C 26 59.530 58.494 1.036 1
1 294 . 27 1 1 A 26 26 GLU CB C 26 29.449 29.269 0.180 1
1 296 . 27 1 1 A 26 26 GLU N N 26 120.522 118.769 1.753 1
1 297 . 27 1 1 A 27 27 LEU H H 27 8.165 8.215 -0.050 1
1 298 . 27 1 1 A 27 27 LEU HA H 27 4.163 4.171 -0.008 1
1 308 . 27 1 1 A 27 27 LEU C C 27 177.256 178.412 -1.156 1
1 309 . 27 1 1 A 27 27 LEU CA C 27 58.049 57.724 0.325 1
1 310 . 27 1 1 A 27 27 LEU CB C 27 41.365 41.930 -0.565 1
1 314 . 27 1 1 A 27 27 LEU N N 27 120.879 121.239 -0.360 1
1 315 . 27 1 1 A 28 28 LYS H H 28 8.902 8.387 0.515 1
1 316 . 27 1 1 A 28 28 LYS HA H 28 4.199 4.224 -0.025 1
1 317 . 27 1 1 A 28 28 LYS C C 28 179.707 178.886 0.821 1
1 318 . 27 1 1 A 28 28 LYS CA C 28 60.097 59.281 0.816 1
1 319 . 27 1 1 A 28 28 LYS CB C 28 33.420 31.978 1.442 1
1 320 . 27 1 1 A 28 28 LYS N N 28 120.050 119.820 0.230 1
1 321 . 27 1 1 A 29 29 THR H H 29 8.294 7.968 0.326 1
1 322 . 27 1 1 A 29 29 THR HA H 29 3.892 3.805 0.087 1
1 327 . 27 1 1 A 29 29 THR C C 29 175.711 175.969 -0.258 1
1 328 . 27 1 1 A 29 29 THR CA C 29 66.846 66.369 0.477 1
1 329 . 27 1 1 A 29 29 THR CB C 29 68.794 68.369 0.425 1
1 331 . 27 1 1 A 29 29 THR N N 29 115.933 116.720 -0.787 1
1 332 . 27 1 1 A 30 30 ALA H H 30 8.244 8.541 -0.297 1
1 333 . 27 1 1 A 30 30 ALA HA H 30 4.241 4.064 0.177 1
1 337 . 27 1 1 A 30 30 ALA C C 30 179.128 179.728 -0.600 1
1 338 . 27 1 1 A 30 30 ALA CA C 30 55.714 55.700 0.014 1
1 339 . 27 1 1 A 30 30 ALA CB C 30 18.955 18.831 0.124 1
1 340 . 27 1 1 A 30 30 ALA N N 30 124.617 122.712 1.905 1
1 341 . 27 1 1 A 31 31 ALA H H 31 8.968 8.832 0.136 1
1 342 . 27 1 1 A 31 31 ALA HA H 31 3.890 4.152 -0.262 1
1 346 . 27 1 1 A 31 31 ALA C C 31 180.352 179.766 0.586 1
1 347 . 27 1 1 A 31 31 ALA CA C 31 55.454 55.238 0.216 1
1 348 . 27 1 1 A 31 31 ALA CB C 31 17.124 18.370 -1.246 1
1 349 . 27 1 1 A 31 31 ALA N N 31 119.327 120.287 -0.960 1
1 350 . 27 1 1 A 32 32 SER H H 32 7.995 8.001 -0.006 1
1 351 . 27 1 1 A 32 32 SER HA H 32 4.238 4.300 -0.062 1
1 354 . 27 1 1 A 32 32 SER C C 32 175.612 176.155 -0.543 1
1 355 . 27 1 1 A 32 32 SER CA C 32 61.203 60.536 0.667 1
1 356 . 27 1 1 A 32 32 SER CB C 32 63.406 63.385 0.021 1
1 357 . 27 1 1 A 32 32 SER N N 32 111.962 111.958 0.004 1
1 358 . 27 1 1 A 33 33 GLN H H 33 8.333 7.886 0.447 1
1 359 . 27 1 1 A 33 33 GLN HA H 33 3.992 4.116 -0.124 1
1 366 . 27 1 1 A 33 33 GLN C C 33 177.486 177.337 0.149 1
1 367 . 27 1 1 A 33 33 GLN CA C 33 58.277 57.537 0.740 1
1 368 . 27 1 1 A 33 33 GLN CB C 33 29.140 29.078 0.062 1
1 370 . 27 1 1 A 33 33 GLN N N 33 119.527 120.953 -1.426 1
1 372 . 27 1 1 A 34 34 TYR H H 34 8.587 7.880 0.707 1
1 373 . 27 1 1 A 34 34 TYR HA H 34 4.792 4.524 0.268 1
1 380 . 27 1 1 A 34 34 TYR C C 34 176.499 176.617 -0.118 1
1 381 . 27 1 1 A 34 34 TYR CA C 34 57.711 58.885 -1.174 1
1 382 . 27 1 1 A 34 34 TYR CB C 34 39.561 38.958 0.603 1
1 387 . 27 1 1 A 34 34 TYR N N 34 114.610 116.716 -2.106 1
1 388 . 27 1 1 A 35 35 GLY H H 35 7.346 8.217 -0.871 1
1 389 . 27 1 1 A 35 35 GLY HA2 H 35 4.785 4.099 0.686 1
1 390 . 27 1 1 A 35 35 GLY HA3 H 35 4.007 4.121 -0.114 1
1 391 . 27 1 1 A 35 35 GLY C C 35 175.796 173.196 2.600 1
1 392 . 27 1 1 A 35 35 GLY CA C 35 44.355 44.659 -0.304 1
1 393 . 27 1 1 A 35 35 GLY N N 35 108.501 106.307 2.194 1
1 394 . 27 1 1 A 36 36 ALA H H 36 9.363 8.296 1.067 1
1 395 . 27 1 1 A 36 36 ALA HA H 36 4.217 4.677 -0.460 1
1 399 . 27 1 1 A 36 36 ALA C C 36 178.039 177.368 0.671 1
1 400 . 27 1 1 A 36 36 ALA CA C 36 56.114 51.544 4.570 1
1 401 . 27 1 1 A 36 36 ALA CB C 36 19.179 18.940 0.239 1
1 402 . 27 1 1 A 36 36 ALA N N 36 125.811 123.189 2.622 1
1 403 . 27 1 1 A 37 37 THR H H 37 8.070 8.045 0.025 1
1 404 . 27 1 1 A 37 37 THR HA H 37 4.570 4.579 -0.009 1
1 409 . 27 1 1 A 37 37 THR C C 37 173.685 174.658 -0.973 1
1 410 . 27 1 1 A 37 37 THR CA C 37 59.822 62.292 -2.470 1
1 411 . 27 1 1 A 37 37 THR CB C 37 68.267 70.941 -2.674 1
1 413 . 27 1 1 A 37 37 THR N N 37 129.410 113.114 16.296 1
1 414 . 27 1 1 A 38 38 ALA H H 38 6.853 7.378 -0.525 1
1 415 . 27 1 1 A 38 38 ALA HA H 38 4.601 4.498 0.103 1
1 419 . 27 1 1 A 38 38 ALA CA C 38 50.758 50.709 0.049 1
1 420 . 27 1 1 A 38 38 ALA CB C 38 18.325 19.260 -0.935 1
1 421 . 27 1 1 A 38 38 ALA N N 38 124.674 125.441 -0.767 1
1 422 . 27 1 1 A 40 40 TYR HA H 40 4.032 4.116 -0.084 1
1 429 . 27 1 1 A 40 40 TYR C C 40 176.456 177.225 -0.769 1
1 430 . 27 1 1 A 40 40 TYR CA C 40 61.010 61.938 -0.928 1
1 431 . 27 1 1 A 40 40 TYR CB C 40 39.286 38.760 0.526 1
1 436 . 27 1 1 A 41 41 THR H H 41 6.874 8.449 -1.575 1
1 437 . 27 1 1 A 41 41 THR HA H 41 3.616 4.057 -0.441 1
1 442 . 27 1 1 A 41 41 THR C C 41 176.930 177.559 -0.629 1
1 443 . 27 1 1 A 41 41 THR CA C 41 65.557 66.889 -1.332 1
1 444 . 27 1 1 A 41 41 THR CB C 41 68.228 68.492 -0.264 1
1 446 . 27 1 1 A 41 41 THR N N 41 115.143 114.080 1.063 1
1 447 . 27 1 1 A 42 42 LEU H H 42 8.623 7.486 1.137 1
1 448 . 27 1 1 A 42 42 LEU HA H 42 3.708 4.051 -0.343 1
1 458 . 27 1 1 A 42 42 LEU C C 42 178.206 178.955 -0.749 1
1 459 . 27 1 1 A 42 42 LEU CA C 42 57.417 57.920 -0.503 1
1 460 . 27 1 1 A 42 42 LEU CB C 42 41.342 41.228 0.114 1
1 464 . 27 1 1 A 42 42 LEU N N 42 120.418 118.013 2.405 1
1 465 . 27 1 1 A 43 43 ALA H H 43 7.735 7.845 -0.110 1
1 466 . 27 1 1 A 43 43 ALA HA H 43 4.020 4.099 -0.079 1
1 470 . 27 1 1 A 43 43 ALA C C 43 180.826 180.509 0.317 1
1 471 . 27 1 1 A 43 43 ALA CA C 43 54.925 54.997 -0.072 1
1 472 . 27 1 1 A 43 43 ALA CB C 43 17.506 18.215 -0.709 1
1 473 . 27 1 1 A 43 43 ALA N N 43 120.203 121.961 -1.758 1
1 474 . 27 1 1 A 44 44 ILE H H 44 7.149 7.441 -0.292 1
1 475 . 27 1 1 A 44 44 ILE HA H 44 3.603 3.628 -0.025 1
1 485 . 27 1 1 A 44 44 ILE C C 44 178.594 178.275 0.319 1
1 486 . 27 1 1 A 44 44 ILE CA C 44 64.782 64.054 0.728 1
1 487 . 27 1 1 A 44 44 ILE CB C 44 37.472 36.995 0.477 1
1 491 . 27 1 1 A 44 44 ILE N N 44 118.881 119.302 -0.421 1
1 492 . 27 1 1 A 45 45 VAL H H 45 7.968 7.944 0.024 1
1 493 . 27 1 1 A 45 45 VAL HA H 45 2.925 3.404 -0.479 1
1 501 . 27 1 1 A 45 45 VAL C C 45 177.023 178.104 -1.081 1
1 502 . 27 1 1 A 45 45 VAL CA C 45 67.081 66.714 0.367 1
1 503 . 27 1 1 A 45 45 VAL CB C 45 30.854 31.125 -0.271 1
1 506 . 27 1 1 A 45 45 VAL N N 45 120.764 120.283 0.481 1
1 507 . 27 1 1 A 46 46 GLU H H 46 8.399 8.183 0.216 1
1 508 . 27 1 1 A 46 46 GLU HA H 46 3.848 4.005 -0.157 1
1 513 . 27 1 1 A 46 46 GLU C C 46 178.656 179.329 -0.673 1
1 514 . 27 1 1 A 46 46 GLU CA C 46 59.491 59.407 0.084 1
1 515 . 27 1 1 A 46 46 GLU CB C 46 28.991 28.736 0.255 1
1 517 . 27 1 1 A 46 46 GLU N N 46 116.599 120.228 -3.629 1
1 518 . 27 1 1 A 47 47 SER H H 47 7.273 8.016 -0.743 1
1 519 . 27 1 1 A 47 47 SER HA H 47 4.287 4.181 0.106 1
1 521 . 27 1 1 A 47 47 SER CA C 47 61.047 62.604 -1.557 1
1 522 . 27 1 1 A 47 47 SER CB C 47 63.016 63.081 -0.065 1
1 523 . 27 1 1 A 47 47 SER N N 47 113.609 117.843 -4.234 1
1 524 . 27 1 1 A 48 48 VAL H H 48 8.006 8.049 -0.043 1
1 525 . 27 1 1 A 48 48 VAL HA H 48 3.556 3.761 -0.205 1
1 533 . 27 1 1 A 48 48 VAL C C 48 177.257 177.915 -0.658 1
1 534 . 27 1 1 A 48 48 VAL CA C 48 65.025 64.610 0.415 1
1 535 . 27 1 1 A 48 48 VAL CB C 48 31.841 31.610 0.231 1
1 538 . 27 1 1 A 48 48 VAL N N 48 122.327 118.634 3.693 1
1 539 . 27 1 1 A 49 49 ALA H H 49 8.369 7.598 0.771 1
1 540 . 27 1 1 A 49 49 ALA HA H 49 4.115 4.184 -0.069 1
1 544 . 27 1 1 A 49 49 ALA C C 49 177.307 177.774 -0.467 1
1 545 . 27 1 1 A 49 49 ALA CA C 49 53.253 53.529 -0.276 1
1 546 . 27 1 1 A 49 49 ALA CB C 49 20.131 18.346 1.785 1
1 547 . 27 1 1 A 49 49 ALA N N 49 118.050 123.981 -5.931 1
1 548 . 27 1 1 A 50 50 ASP H H 50 7.052 7.971 -0.919 1
1 549 . 27 1 1 A 50 50 ASP HA H 50 4.788 4.794 -0.006 1
1 552 . 27 1 1 A 50 50 ASP C C 50 175.481 175.695 -0.214 1
1 553 . 27 1 1 A 50 50 ASP CA C 50 53.681 53.621 0.060 1
1 554 . 27 1 1 A 50 50 ASP CB C 50 39.333 41.296 -1.963 1
1 555 . 27 1 1 A 50 50 ASP N N 50 116.997 117.312 -0.315 1
1 556 . 27 1 1 A 51 51 ASN H H 51 8.535 7.372 1.163 1
1 557 . 27 1 1 A 51 51 ASN HA H 51 4.628 4.985 -0.357 1
1 562 . 27 1 1 A 51 51 ASN C C 51 174.077 175.432 -1.355 1
1 563 . 27 1 1 A 51 51 ASN CA C 51 52.315 52.254 0.061 1
1 564 . 27 1 1 A 51 51 ASN CB C 51 41.928 41.403 0.525 1
1 565 . 27 1 1 A 51 51 ASN N N 51 118.626 117.847 0.779 1
1 567 . 27 1 1 A 52 52 TRP H H 52 8.555 8.806 -0.251 1
1 574 . 27 1 1 A 52 52 TRP C C 52 173.269 176.153 -2.884 1
1 575 . 27 1 1 A 52 52 TRP CA C 52 55.031 58.188 -3.157 1
1 576 . 27 1 1 A 52 52 TRP CB C 52 26.801 28.300 -1.499 1
1 582 . 27 1 1 A 52 52 TRP N N 52 120.693 122.215 -1.522 1
1 584 . 27 1 1 A 53 53 LEU H H 53 7.847 7.881 -0.034 1
1 585 . 27 1 1 A 53 53 LEU HA H 53 4.859 4.232 0.627 1
1 595 . 27 1 1 A 53 53 LEU C C 53 177.397 176.208 1.189 1
1 596 . 27 1 1 A 53 53 LEU CA C 53 53.619 56.459 -2.840 1
1 597 . 27 1 1 A 53 53 LEU CB C 53 41.812 42.294 -0.482 1
1 601 . 27 1 1 A 53 53 LEU N N 53 124.741 122.267 2.474 1
1 602 . 27 1 1 A 54 54 THR H H 54 8.850 8.808 0.042 1
1 603 . 27 1 1 A 54 54 THR HA H 54 4.598 5.583 -0.985 1
1 608 . 27 1 1 A 54 54 THR CA C 54 60.531 60.610 -0.079 1
1 609 . 27 1 1 A 54 54 THR CB C 54 67.183 69.020 -1.837 1
1 611 . 27 1 1 A 54 54 THR N N 54 113.407 116.674 -3.267 1
1 612 . 27 1 1 A 55 55 PRO HA H 55 4.511 4.385 0.126 1
1 619 . 27 1 1 A 55 55 PRO C C 55 179.383 177.772 1.611 1
1 620 . 27 1 1 A 55 55 PRO CA C 55 67.159 65.368 1.791 1
1 621 . 27 1 1 A 55 55 PRO CB C 55 32.095 31.691 0.404 1
1 622 . 27 1 1 A 56 56 THR H H 56 8.575 7.884 0.691 1
1 623 . 27 1 1 A 56 56 THR HA H 56 4.229 4.232 -0.003 1
1 628 . 27 1 1 A 56 56 THR C C 56 176.668 176.950 -0.282 1
1 629 . 27 1 1 A 56 56 THR CA C 56 66.943 65.289 1.654 1
1 630 . 27 1 1 A 56 56 THR CB C 56 68.129 68.912 -0.783 1
1 632 . 27 1 1 A 56 56 THR N N 56 114.855 111.846 3.009 1
1 633 . 27 1 1 A 57 57 ASP H H 57 8.730 8.407 0.323 1
1 634 . 27 1 1 A 57 57 ASP HA H 57 4.425 4.711 -0.286 1
1 637 . 27 1 1 A 57 57 ASP C C 57 178.351 179.248 -0.897 1
1 638 . 27 1 1 A 57 57 ASP CA C 57 57.963 57.645 0.318 1
1 639 . 27 1 1 A 57 57 ASP CB C 57 40.134 40.760 -0.626 1
1 640 . 27 1 1 A 57 57 ASP N N 57 126.239 122.235 4.004 1
1 641 . 27 1 1 A 58 58 TRP H H 58 8.244 8.387 -0.143 1
1 642 . 27 1 1 A 58 58 TRP HA H 58 4.030 4.432 -0.402 1
1 650 . 27 1 1 A 58 58 TRP C C 58 177.432 179.066 -1.634 1
1 651 . 27 1 1 A 58 58 TRP CA C 58 62.731 59.997 2.734 1
1 652 . 27 1 1 A 58 58 TRP CB C 58 29.122 28.989 0.133 1
1 657 . 27 1 1 A 58 58 TRP N N 58 119.241 120.560 -1.319 1
1 659 . 27 1 1 A 59 59 ASN H H 59 8.098 8.868 -0.770 1
1 660 . 27 1 1 A 59 59 ASN HA H 59 4.424 4.599 -0.175 1
1 663 . 27 1 1 A 59 59 ASN C C 59 176.952 177.747 -0.795 1
1 664 . 27 1 1 A 59 59 ASN CA C 59 58.135 56.601 1.534 1
1 665 . 27 1 1 A 59 59 ASN CB C 59 40.168 39.901 0.267 1
1 666 . 27 1 1 A 59 59 ASN N N 59 115.747 117.823 -2.076 1
1 667 . 27 1 1 A 60 60 THR H H 60 8.712 7.942 0.770 1
1 668 . 27 1 1 A 60 60 THR HA H 60 3.717 3.926 -0.209 1
1 673 . 27 1 1 A 60 60 THR C C 60 176.044 176.923 -0.879 1
1 674 . 27 1 1 A 60 60 THR CA C 60 66.576 66.055 0.521 1
1 675 . 27 1 1 A 60 60 THR CB C 60 69.251 67.789 1.462 1
1 677 . 27 1 1 A 60 60 THR N N 60 114.896 115.943 -1.047 1
1 678 . 27 1 1 A 61 61 LEU H H 61 8.485 8.496 -0.011 1
1 679 . 27 1 1 A 61 61 LEU HA H 61 3.391 3.950 -0.559 1
1 689 . 27 1 1 A 61 61 LEU C C 61 177.433 179.254 -1.821 1
1 690 . 27 1 1 A 61 61 LEU CA C 61 58.354 58.434 -0.080 1
1 691 . 27 1 1 A 61 61 LEU CB C 61 41.761 42.304 -0.543 1
1 695 . 27 1 1 A 61 61 LEU N N 61 123.433 122.252 1.181 1
1 696 . 27 1 1 A 62 62 VAL H H 62 8.073 7.879 0.194 1
1 697 . 27 1 1 A 62 62 VAL HA H 62 3.207 3.673 -0.466 1
1 705 . 27 1 1 A 62 62 VAL C C 62 177.585 178.063 -0.478 1
1 706 . 27 1 1 A 62 62 VAL CA C 62 67.345 65.386 1.959 1
1 707 . 27 1 1 A 62 62 VAL CB C 62 30.905 31.057 -0.152 1
1 710 . 27 1 1 A 62 62 VAL N N 62 116.018 113.890 2.128 1
1 711 . 27 1 1 A 63 63 ARG H H 63 7.765 7.608 0.157 1
1 712 . 27 1 1 A 63 63 ARG HA H 63 3.602 3.922 -0.320 1
1 719 . 27 1 1 A 63 63 ARG C C 63 177.818 177.626 0.192 1
1 720 . 27 1 1 A 63 63 ARG CA C 63 58.049 59.222 -1.173 1
1 721 . 27 1 1 A 63 63 ARG CB C 63 29.955 30.308 -0.353 1
1 724 . 27 1 1 A 63 63 ARG N N 63 116.700 121.509 -4.809 1
1 725 . 27 1 1 A 64 64 ALA H H 64 7.574 7.697 -0.123 1
1 726 . 27 1 1 A 64 64 ALA HA H 64 4.158 4.379 -0.221 1
1 730 . 27 1 1 A 64 64 ALA C C 64 179.886 179.227 0.659 1
1 731 . 27 1 1 A 64 64 ALA CA C 64 54.007 53.845 0.162 1
1 732 . 27 1 1 A 64 64 ALA CB C 64 19.147 19.920 -0.773 1
1 733 . 27 1 1 A 64 64 ALA N N 64 117.555 121.679 -4.124 1
1 734 . 27 1 1 A 65 65 VAL H H 65 7.554 7.963 -0.409 1
1 735 . 27 1 1 A 65 65 VAL HA H 65 4.253 3.851 0.402 1
1 743 . 27 1 1 A 65 65 VAL C C 65 174.180 175.444 -1.264 1
1 744 . 27 1 1 A 65 65 VAL CA C 65 62.683 64.953 -2.270 1
1 745 . 27 1 1 A 65 65 VAL CB C 65 33.458 31.163 2.295 1
1 748 . 27 1 1 A 65 65 VAL N N 65 110.013 115.092 -5.079 1
1 749 . 27 1 1 A 66 66 LEU H H 66 7.792 7.758 0.034 1
1 750 . 27 1 1 A 66 66 LEU HA H 66 4.790 4.739 0.051 1
1 760 . 27 1 1 A 66 66 LEU C C 66 177.537 174.768 2.769 1
1 761 . 27 1 1 A 66 66 LEU CA C 66 52.823 53.503 -0.680 1
1 762 . 27 1 1 A 66 66 LEU CB C 66 44.071 45.472 -1.401 1
1 766 . 27 1 1 A 66 66 LEU N N 66 118.967 122.095 -3.128 1
1 767 . 27 1 1 A 67 67 SER H H 67 9.208 8.512 0.696 1
1 768 . 27 1 1 A 67 67 SER HA H 67 4.414 4.678 -0.264 1
1 771 . 27 1 1 A 67 67 SER CA C 67 57.943 57.314 0.629 1
1 772 . 27 1 1 A 67 67 SER CB C 67 64.743 65.465 -0.722 1
1 773 . 27 1 1 A 67 67 SER N N 67 116.378 119.233 -2.855 1
1 774 . 27 1 1 A 69 69 GLY HA2 H 69 3.916 3.737 0.179 1
1 775 . 27 1 1 A 69 69 GLY HA3 H 69 3.867 3.786 0.081 1
1 776 . 27 1 1 A 69 69 GLY C C 69 176.783 175.391 1.392 1
1 777 . 27 1 1 A 69 69 GLY CA C 69 46.977 46.974 0.003 1
1 778 . 27 1 1 A 70 70 ASP H H 70 7.674 8.119 -0.445 1
1 779 . 27 1 1 A 70 70 ASP HA H 70 4.511 3.675 0.836 1
1 782 . 27 1 1 A 70 70 ASP C C 70 178.096 178.105 -0.009 1
1 783 . 27 1 1 A 70 70 ASP CA C 70 57.262 56.430 0.832 1
1 784 . 27 1 1 A 70 70 ASP CB C 70 40.594 39.741 0.853 1
1 785 . 27 1 1 A 70 70 ASP N N 70 123.930 122.148 1.782 1
1 786 . 27 1 1 A 71 71 HIS H H 71 8.729 7.877 0.852 1
1 787 . 27 1 1 A 71 71 HIS HA H 71 4.235 4.188 0.047 1
1 790 . 27 1 1 A 71 71 HIS C C 71 176.769 176.670 0.099 1
1 791 . 27 1 1 A 71 71 HIS CA C 71 60.041 60.029 0.012 1
1 792 . 27 1 1 A 71 71 HIS CB C 71 30.682 30.110 0.572 1
1 793 . 27 1 1 A 71 71 HIS N N 71 121.003 119.552 1.451 1
1 794 . 27 1 1 A 72 72 LEU H H 72 7.620 7.458 0.162 1
1 795 . 27 1 1 A 72 72 LEU HA H 72 3.769 3.842 -0.073 1
1 805 . 27 1 1 A 72 72 LEU C C 72 180.275 179.209 1.066 1
1 806 . 27 1 1 A 72 72 LEU CA C 72 58.192 57.976 0.216 1
1 807 . 27 1 1 A 72 72 LEU CB C 72 41.381 41.233 0.148 1
1 811 . 27 1 1 A 72 72 LEU N N 72 118.569 117.878 0.691 1
1 812 . 27 1 1 A 73 73 LEU H H 73 7.542 7.580 -0.038 1
1 813 . 27 1 1 A 73 73 LEU HA H 73 4.107 4.210 -0.103 1
1 823 . 27 1 1 A 73 73 LEU C C 73 179.436 179.283 0.153 1
1 824 . 27 1 1 A 73 73 LEU CA C 73 58.026 57.247 0.779 1
1 825 . 27 1 1 A 73 73 LEU CB C 73 41.638 42.185 -0.547 1
1 829 . 27 1 1 A 73 73 LEU N N 73 121.418 120.408 1.010 1
1 830 . 27 1 1 A 74 74 TRP H H 74 8.786 8.012 0.774 1
1 831 . 27 1 1 A 74 74 TRP HA H 74 3.589 5.444 -1.855 1
1 840 . 27 1 1 A 74 74 TRP C C 74 176.816 178.788 -1.972 1
1 841 . 27 1 1 A 74 74 TRP CA C 74 63.046 59.849 3.197 1
1 842 . 27 1 1 A 74 74 TRP CB C 74 28.065 29.026 -0.961 1
1 848 . 27 1 1 A 74 74 TRP N N 74 121.111 118.145 2.966 1
1 850 . 27 1 1 A 75 75 LYS H H 75 8.939 7.756 1.183 1
1 851 . 27 1 1 A 75 75 LYS HA H 75 3.055 4.189 -1.134 1
1 860 . 27 1 1 A 75 75 LYS C C 75 177.967 179.047 -1.080 1
1 861 . 27 1 1 A 75 75 LYS CA C 75 60.029 58.835 1.194 1
1 862 . 27 1 1 A 75 75 LYS CB C 75 32.533 32.737 -0.204 1
1 866 . 27 1 1 A 75 75 LYS N N 75 119.783 118.611 1.172 1
1 867 . 27 1 1 A 76 76 SER H H 76 7.832 7.738 0.094 1
1 868 . 27 1 1 A 76 76 SER HA H 76 4.040 4.254 -0.214 1
1 871 . 27 1 1 A 76 76 SER C C 76 177.816 177.012 0.804 1
1 872 . 27 1 1 A 76 76 SER CA C 76 62.105 61.571 0.534 1
1 873 . 27 1 1 A 76 76 SER CB C 76 62.679 62.846 -0.167 1
1 874 . 27 1 1 A 76 76 SER N N 76 113.395 115.190 -1.795 1
1 875 . 27 1 1 A 77 77 GLU H H 77 7.590 7.828 -0.238 1
1 876 . 27 1 1 A 77 77 GLU HA H 77 4.042 4.324 -0.282 1
1 881 . 27 1 1 A 77 77 GLU C C 77 177.809 178.535 -0.726 1
1 882 . 27 1 1 A 77 77 GLU CA C 77 58.270 58.163 0.107 1
1 883 . 27 1 1 A 77 77 GLU CB C 77 29.208 29.542 -0.334 1
1 885 . 27 1 1 A 77 77 GLU N N 77 121.574 121.922 -0.348 1
1 886 . 27 1 1 A 78 78 PHE H H 78 9.081 7.873 1.208 1
1 887 . 27 1 1 A 78 78 PHE HA H 78 3.778 4.260 -0.482 1
1 895 . 27 1 1 A 78 78 PHE C C 78 178.114 177.262 0.852 1
1 896 . 27 1 1 A 78 78 PHE CA C 78 60.629 61.424 -0.795 1
1 897 . 27 1 1 A 78 78 PHE CB C 78 38.295 38.918 -0.623 1
1 902 . 27 1 1 A 78 78 PHE N N 78 122.682 122.880 -0.198 1
1 903 . 27 1 1 A 79 79 PHE H H 79 8.890 8.015 0.875 1
1 904 . 27 1 1 A 79 79 PHE HA H 79 3.800 3.966 -0.166 1
1 912 . 27 1 1 A 79 79 PHE C C 79 178.354 178.246 0.108 1
1 913 . 27 1 1 A 79 79 PHE CA C 79 60.704 62.122 -1.418 1
1 914 . 27 1 1 A 79 79 PHE CB C 79 37.184 38.466 -1.282 1
1 920 . 27 1 1 A 79 79 PHE N N 79 121.056 118.110 2.946 1
1 921 . 27 1 1 A 80 80 GLU H H 80 7.793 8.148 -0.355 1
1 922 . 27 1 1 A 80 80 GLU HA H 80 4.082 3.945 0.137 1
1 927 . 27 1 1 A 80 80 GLU C C 80 179.068 179.610 -0.542 1
1 928 . 27 1 1 A 80 80 GLU CA C 80 59.735 59.819 -0.084 1
1 929 . 27 1 1 A 80 80 GLU CB C 80 28.722 28.884 -0.162 1
1 931 . 27 1 1 A 80 80 GLU N N 80 120.312 118.842 1.470 1
1 932 . 27 1 1 A 81 81 ASN H H 81 8.624 8.321 0.303 1
1 933 . 27 1 1 A 81 81 ASN HA H 81 4.521 4.541 -0.020 1
1 938 . 27 1 1 A 81 81 ASN C C 81 179.262 177.579 1.683 1
1 939 . 27 1 1 A 81 81 ASN CA C 81 55.504 56.390 -0.886 1
1 940 . 27 1 1 A 81 81 ASN CB C 81 37.517 38.204 -0.687 1
1 941 . 27 1 1 A 81 81 ASN N N 81 119.338 118.006 1.332 1
1 943 . 27 1 1 A 82 82 CYS H H 82 8.554 8.354 0.200 1
1 944 . 27 1 1 A 82 82 CYS HA H 82 3.792 3.947 -0.155 1
1 947 . 27 1 1 A 82 82 CYS C C 82 176.478 176.180 0.298 1
1 948 . 27 1 1 A 82 82 CYS CA C 82 65.232 61.617 3.615 1
1 949 . 27 1 1 A 82 82 CYS CB C 82 26.762 27.094 -0.332 1
1 950 . 27 1 1 A 82 82 CYS N N 82 120.576 118.479 2.097 1
1 951 . 27 1 1 A 83 83 ARG H H 83 8.522 7.468 1.054 1
1 952 . 27 1 1 A 83 83 ARG HA H 83 3.932 4.140 -0.208 1
1 960 . 27 1 1 A 83 83 ARG C C 83 179.138 178.564 0.574 1
1 961 . 27 1 1 A 83 83 ARG CA C 83 60.443 58.256 2.187 1
1 962 . 27 1 1 A 83 83 ARG CB C 83 29.550 29.949 -0.399 1
1 965 . 27 1 1 A 83 83 ARG N N 83 123.035 120.157 2.878 1
1 967 . 27 1 1 A 84 84 ASP H H 84 7.791 8.061 -0.270 1
1 968 . 27 1 1 A 84 84 ASP HA H 84 4.353 4.426 -0.073 1
1 971 . 27 1 1 A 84 84 ASP C C 84 178.649 178.272 0.377 1
1 972 . 27 1 1 A 84 84 ASP CA C 84 57.767 57.504 0.263 1
1 973 . 27 1 1 A 84 84 ASP CB C 84 41.305 41.425 -0.120 1
1 974 . 27 1 1 A 84 84 ASP N N 84 120.332 119.717 0.615 1
1 975 . 27 1 1 A 85 85 THR H H 85 8.370 7.860 0.510 1
1 976 . 27 1 1 A 85 85 THR HA H 85 3.730 3.999 -0.269 1
1 981 . 27 1 1 A 85 85 THR C C 85 175.198 176.582 -1.384 1
1 982 . 27 1 1 A 85 85 THR CA C 85 66.830 64.983 1.847 1
1 983 . 27 1 1 A 85 85 THR CB C 85 68.533 68.653 -0.120 1
1 985 . 27 1 1 A 85 85 THR N N 85 117.360 113.689 3.671 1
1 986 . 27 1 1 A 86 86 ALA H H 86 8.845 8.177 0.668 1
1 987 . 27 1 1 A 86 86 ALA HA H 86 3.991 4.091 -0.100 1
1 991 . 27 1 1 A 86 86 ALA C C 86 179.980 179.723 0.257 1
1 992 . 27 1 1 A 86 86 ALA CA C 86 55.769 55.651 0.118 1
1 993 . 27 1 1 A 86 86 ALA CB C 86 17.881 18.316 -0.435 1
1 994 . 27 1 1 A 86 86 ALA N N 86 123.613 123.313 0.300 1
1 995 . 27 1 1 A 87 87 LYS H H 87 7.686 8.286 -0.600 1
1 996 . 27 1 1 A 87 87 LYS HA H 87 4.099 4.029 0.070 1
1 1005 . 27 1 1 A 87 87 LYS C C 87 179.592 178.866 0.726 1
1 1006 . 27 1 1 A 87 87 LYS CA C 87 59.708 59.248 0.460 1
1 1007 . 27 1 1 A 87 87 LYS CB C 87 32.054 31.969 0.085 1
1 1011 . 27 1 1 A 87 87 LYS N N 87 119.623 116.979 2.644 1
1 1012 . 27 1 1 A 88 88 ARG H H 88 7.683 7.576 0.107 1
1 1013 . 27 1 1 A 88 88 ARG HA H 88 4.051 4.127 -0.076 1
1 1020 . 27 1 1 A 88 88 ARG C C 88 180.053 178.622 1.431 1
1 1021 . 27 1 1 A 88 88 ARG CA C 88 59.558 59.044 0.514 1
1 1022 . 27 1 1 A 88 88 ARG CB C 88 29.684 29.857 -0.173 1
1 1025 . 27 1 1 A 88 88 ARG N N 88 120.788 119.695 1.093 1
1 1026 . 27 1 1 A 89 89 ASN H H 89 8.973 8.405 0.568 1
1 1027 . 27 1 1 A 89 89 ASN HA H 89 4.354 4.602 -0.248 1
1 1032 . 27 1 1 A 89 89 ASN C C 89 178.382 178.467 -0.085 1
1 1033 . 27 1 1 A 89 89 ASN CA C 89 55.334 55.803 -0.469 1
1 1034 . 27 1 1 A 89 89 ASN CB C 89 37.864 38.380 -0.516 1
1 1035 . 27 1 1 A 89 89 ASN N N 89 121.012 117.666 3.346 1
1 1037 . 27 1 1 A 90 90 GLN H H 90 8.152 8.523 -0.371 1
1 1038 . 27 1 1 A 90 90 GLN HA H 90 4.020 4.033 -0.013 1
1 1045 . 27 1 1 A 90 90 GLN C C 90 179.075 178.935 0.140 1
1 1046 . 27 1 1 A 90 90 GLN CA C 90 59.318 58.892 0.426 1
1 1047 . 27 1 1 A 90 90 GLN CB C 90 28.049 28.123 -0.074 1
1 1049 . 27 1 1 A 90 90 GLN N N 90 122.122 120.732 1.390 1
1 1051 . 27 1 1 A 91 91 GLN H H 91 7.514 8.238 -0.724 1
1 1052 . 27 1 1 A 91 91 GLN HA H 91 4.053 4.094 -0.041 1
1 1059 . 27 1 1 A 91 91 GLN C C 91 177.081 177.015 0.066 1
1 1060 . 27 1 1 A 91 91 GLN CA C 91 58.031 58.288 -0.257 1
1 1061 . 27 1 1 A 91 91 GLN CB C 91 28.365 27.538 0.827 1
1 1063 . 27 1 1 A 91 91 GLN N N 91 118.124 117.998 0.126 1
1 1065 . 27 1 1 A 92 92 ALA H H 92 7.704 7.183 0.521 1
1 1066 . 27 1 1 A 92 92 ALA HA H 92 4.246 4.440 -0.194 1
1 1070 . 27 1 1 A 92 92 ALA C C 92 178.450 177.653 0.797 1
1 1071 . 27 1 1 A 92 92 ALA CA C 92 52.671 51.741 0.930 1
1 1072 . 27 1 1 A 92 92 ALA CB C 92 19.316 20.008 -0.692 1
1 1073 . 27 1 1 A 92 92 ALA N N 92 119.880 120.973 -1.093 1
1 1074 . 27 1 1 A 93 93 GLY H H 93 7.693 8.099 -0.406 1
1 1075 . 27 1 1 A 93 93 GLY HA2 H 93 3.941 3.900 0.041 1
1 1076 . 27 1 1 A 93 93 GLY HA3 H 93 3.744 3.903 -0.159 1
1 1077 . 27 1 1 A 93 93 GLY C C 93 174.344 174.587 -0.243 1
1 1078 . 27 1 1 A 93 93 GLY CA C 93 45.949 46.408 -0.459 1
1 1079 . 27 1 1 A 93 93 GLY N N 93 105.347 107.996 -2.649 1
1 1080 . 27 1 1 A 94 94 ASN H H 94 7.076 8.512 -1.436 1
1 1081 . 27 1 1 A 94 94 ASN HA H 94 4.115 4.693 -0.578 1
1 1085 . 27 1 1 A 94 94 ASN C C 94 175.410 175.551 -0.141 1
1 1086 . 27 1 1 A 94 94 ASN CA C 94 52.651 52.384 0.267 1
1 1087 . 27 1 1 A 94 94 ASN CB C 94 38.330 39.483 -1.153 1
1 1088 . 27 1 1 A 94 94 ASN N N 94 115.747 118.715 -2.968 1
1 1090 . 27 1 1 A 95 95 GLY H H 95 8.236 8.448 -0.212 1
1 1091 . 27 1 1 A 95 95 GLY HA2 H 95 3.633 3.528 0.105 1
1 1092 . 27 1 1 A 95 95 GLY HA3 H 95 3.633 3.675 -0.042 1
1 1093 . 27 1 1 A 95 95 GLY C C 95 174.450 173.194 1.256 1
1 1094 . 27 1 1 A 95 95 GLY CA C 95 45.522 46.474 -0.952 1
1 1095 . 27 1 1 A 95 95 GLY N N 95 109.166 109.774 -0.608 1
1 1096 . 27 1 1 A 96 96 TRP H H 96 7.899 7.834 0.065 1
1 1097 . 27 1 1 A 96 96 TRP HA H 96 5.241 5.111 0.130 1
1 1106 . 27 1 1 A 96 96 TRP C C 96 175.661 176.141 -0.480 1
1 1107 . 27 1 1 A 96 96 TRP CA C 96 55.090 55.947 -0.857 1
1 1108 . 27 1 1 A 96 96 TRP CB C 96 27.138 32.478 -5.340 1
1 1114 . 27 1 1 A 96 96 TRP N N 96 122.840 119.203 3.637 1
1 1116 . 27 1 1 A 97 97 ASP H H 97 7.344 9.069 -1.725 1
1 1117 . 27 1 1 A 97 97 ASP HA H 97 4.829 4.232 0.597 1
1 1120 . 27 1 1 A 97 97 ASP C C 97 175.019 176.531 -1.512 1
1 1121 . 27 1 1 A 97 97 ASP CA C 97 52.149 56.683 -4.534 1
1 1122 . 27 1 1 A 97 97 ASP CB C 97 42.697 39.227 3.470 1
1 1123 . 27 1 1 A 97 97 ASP N N 97 126.861 116.990 9.871 1
1 1124 . 27 1 1 A 98 98 PHE H H 98 8.566 8.592 -0.026 1
1 1125 . 27 1 1 A 98 98 PHE HA H 98 3.727 4.017 -0.290 1
1 1133 . 27 1 1 A 98 98 PHE C C 98 177.443 177.084 0.359 1
1 1134 . 27 1 1 A 98 98 PHE CA C 98 62.471 62.007 0.464 1
1 1135 . 27 1 1 A 98 98 PHE CB C 98 39.919 39.440 0.479 1
1 1141 . 27 1 1 A 98 98 PHE N N 98 117.781 120.624 -2.843 1
1 1142 . 27 1 1 A 99 99 ASP H H 99 8.259 8.124 0.135 1
1 1143 . 27 1 1 A 99 99 ASP HA H 99 3.960 4.279 -0.319 1
1 1146 . 27 1 1 A 99 99 ASP C C 99 178.132 178.806 -0.674 1
1 1147 . 27 1 1 A 99 99 ASP CA C 99 57.658 56.543 1.115 1
1 1148 . 27 1 1 A 99 99 ASP CB C 99 38.572 40.601 -2.029 1
1 1149 . 27 1 1 A 99 99 ASP N N 99 121.709 119.965 1.744 1
1 1150 . 27 1 1 A 100 100 MET H H 100 8.008 8.039 -0.031 1
1 1151 . 27 1 1 A 100 100 MET HA H 100 3.644 4.444 -0.800 1
1 1156 . 27 1 1 A 100 100 MET C C 100 180.008 176.660 3.348 1
1 1157 . 27 1 1 A 100 100 MET CA C 100 58.598 58.032 0.566 1
1 1158 . 27 1 1 A 100 100 MET CB C 100 33.423 33.258 0.165 1
1 1160 . 27 1 1 A 100 100 MET N N 100 119.668 118.127 1.541 1
1 1161 . 27 1 1 A 101 101 LEU H H 101 7.961 7.997 -0.036 1
1 1162 . 27 1 1 A 101 101 LEU HA H 101 3.523 4.494 -0.971 1
1 1172 . 27 1 1 A 101 101 LEU C C 101 173.873 175.121 -1.248 1
1 1173 . 27 1 1 A 101 101 LEU CA C 101 58.743 53.666 5.077 1
1 1174 . 27 1 1 A 101 101 LEU CB C 101 42.632 41.760 0.872 1
1 1178 . 27 1 1 A 101 101 LEU N N 101 119.752 119.832 -0.080 1
1 1179 . 27 1 1 A 102 102 THR H H 102 6.955 8.353 -1.398 1
1 1180 . 27 1 1 A 102 102 THR HA H 102 4.134 4.484 -0.350 1
1 1185 . 27 1 1 A 102 102 THR C C 102 176.513 173.052 3.461 1
1 1186 . 27 1 1 A 102 102 THR CA C 102 61.125 60.106 1.019 1
1 1187 . 27 1 1 A 102 102 THR CB C 102 71.415 70.049 1.366 1
1 1189 . 27 1 1 A 102 102 THR N N 102 124.665 118.251 6.414 1
1 1190 . 27 1 1 A 103 103 GLY H H 103 7.816 8.850 -1.034 1
1 1191 . 27 1 1 A 103 103 GLY HA2 H 103 3.824 3.972 -0.148 1
1 1192 . 27 1 1 A 103 103 GLY HA3 H 103 3.824 4.018 -0.194 1
1 1193 . 27 1 1 A 103 103 GLY C C 103 174.126 174.267 -0.141 1
1 1194 . 27 1 1 A 103 103 GLY CA C 103 47.805 46.820 0.985 1
1 1195 . 27 1 1 A 103 103 GLY N N 103 114.191 111.715 2.476 1
1 1196 . 27 1 1 A 104 104 SER H H 104 8.860 7.927 0.933 1
1 1197 . 27 1 1 A 104 104 SER HA H 104 4.758 4.210 0.548 1
1 1200 . 27 1 1 A 104 104 SER C C 104 174.591 173.352 1.239 1
1 1201 . 27 1 1 A 104 104 SER CA C 104 56.755 60.623 -3.868 1
1 1202 . 27 1 1 A 104 104 SER CB C 104 65.050 61.918 3.132 1
1 1203 . 27 1 1 A 104 104 SER N N 104 114.771 111.642 3.129 1
1 1204 . 27 1 1 A 105 105 GLY H H 105 8.788 8.072 0.716 1
1 1205 . 27 1 1 A 105 105 GLY HA2 H 105 3.733 3.927 -0.194 1
1 1206 . 27 1 1 A 105 105 GLY HA3 H 105 3.733 4.051 -0.318 1
1 1207 . 27 1 1 A 105 105 GLY CA C 105 47.247 46.042 1.205 1
1 1208 . 27 1 1 A 105 105 GLY N N 105 110.394 108.571 1.823 1
1 1209 . 27 1 1 A 106 106 ASN HA H 106 4.454 4.888 -0.434 1
1 1212 . 27 1 1 A 106 106 ASN C C 106 175.180 176.615 -1.435 1
1 1213 . 27 1 1 A 106 106 ASN CA C 106 54.492 54.176 0.316 1
1 1214 . 27 1 1 A 106 106 ASN CB C 106 37.282 40.930 -3.648 1
1 1215 . 27 1 1 A 107 107 TYR H H 107 8.241 8.228 0.013 1
1 1216 . 27 1 1 A 107 107 TYR HA H 107 4.335 4.778 -0.443 1
1 1223 . 27 1 1 A 107 107 TYR C C 107 173.954 175.532 -1.578 1
1 1224 . 27 1 1 A 107 107 TYR CA C 107 57.727 57.557 0.170 1
1 1225 . 27 1 1 A 107 107 TYR CB C 107 37.063 40.471 -3.408 1
1 1230 . 27 1 1 A 107 107 TYR N N 107 120.708 113.104 7.604 1
1 1231 . 27 1 1 A 108 108 SER H H 108 7.117 7.885 -0.768 1
1 1232 . 27 1 1 A 108 108 SER HA H 108 4.221 4.381 -0.160 1
1 1235 . 27 1 1 A 108 108 SER C C 108 174.834 172.362 2.472 1
1 1236 . 27 1 1 A 108 108 SER CA C 108 59.859 58.605 1.254 1
1 1237 . 27 1 1 A 108 108 SER CB C 108 63.846 62.599 1.247 1
1 1238 . 27 1 1 A 108 108 SER N N 108 113.362 115.596 -2.234 1
1 1239 . 27 1 1 A 109 109 SER H H 109 8.053 8.287 -0.234 1
1 1240 . 27 1 1 A 109 109 SER HA H 109 4.560 5.040 -0.480 1
1 1243 . 27 1 1 A 109 109 SER CA C 109 57.141 58.055 -0.914 1
1 1244 . 27 1 1 A 109 109 SER CB C 109 64.874 65.158 -0.284 1
1 1245 . 27 1 1 A 109 109 SER N N 109 116.657 118.038 -1.381 1
1 1246 . 27 1 1 A 110 110 THR HA H 110 3.541 4.187 -0.646 1
1 1251 . 27 1 1 A 110 110 THR C C 110 175.477 175.998 -0.521 1
1 1252 . 27 1 1 A 110 110 THR CA C 110 66.443 65.484 0.959 1
1 1253 . 27 1 1 A 110 110 THR CB C 110 68.091 68.831 -0.740 1
1 1255 . 27 1 1 A 111 111 ASP H H 111 8.224 8.225 -0.001 1
1 1256 . 27 1 1 A 111 111 ASP HA H 111 4.237 4.292 -0.055 1
1 1259 . 27 1 1 A 111 111 ASP C C 111 177.520 178.280 -0.760 1
1 1260 . 27 1 1 A 111 111 ASP CA C 111 57.559 57.425 0.134 1
1 1261 . 27 1 1 A 111 111 ASP CB C 111 40.292 41.131 -0.839 1
1 1262 . 27 1 1 A 111 111 ASP N N 111 119.490 122.016 -2.526 1
1 1263 . 27 1 1 A 112 112 ALA H H 112 7.431 8.591 -1.160 1
1 1264 . 27 1 1 A 112 112 ALA HA H 112 4.191 4.086 0.105 1
1 1268 . 27 1 1 A 112 112 ALA C C 112 180.646 179.200 1.446 1
1 1269 . 27 1 1 A 112 112 ALA CA C 112 54.534 54.979 -0.445 1
1 1270 . 27 1 1 A 112 112 ALA CB C 112 18.992 18.594 0.398 1
1 1271 . 27 1 1 A 112 112 ALA N N 112 119.710 121.462 -1.752 1
1 1272 . 27 1 1 A 113 113 GLN H H 113 7.576 8.234 -0.658 1
1 1273 . 27 1 1 A 113 113 GLN HA H 113 3.562 4.095 -0.533 1
1 1278 . 27 1 1 A 113 113 GLN C C 113 176.756 178.015 -1.259 1
1 1279 . 27 1 1 A 113 113 GLN CA C 113 57.736 58.556 -0.820 1
1 1280 . 27 1 1 A 113 113 GLN CB C 113 29.110 28.781 0.329 1
1 1281 . 27 1 1 A 113 113 GLN N N 113 117.518 118.447 -0.929 1
1 1283 . 27 1 1 A 114 114 MET H H 114 8.192 8.082 0.110 1
1 1284 . 27 1 1 A 114 114 MET HA H 114 4.231 4.252 -0.021 1
1 1289 . 27 1 1 A 114 114 MET C C 114 175.648 178.331 -2.683 1
1 1290 . 27 1 1 A 114 114 MET CA C 114 57.446 58.104 -0.658 1
1 1291 . 27 1 1 A 114 114 MET CB C 114 33.570 32.095 1.475 1
1 1293 . 27 1 1 A 114 114 MET N N 114 111.509 119.004 -7.495 1
1 1294 . 27 1 1 A 115 115 GLN H H 115 6.940 7.753 -0.813 1
1 1295 . 27 1 1 A 115 115 GLN HA H 115 4.307 4.209 0.098 1
1 1302 . 27 1 1 A 115 115 GLN C C 115 176.270 176.076 0.194 1
1 1303 . 27 1 1 A 115 115 GLN CA C 115 54.680 56.639 -1.959 1
1 1304 . 27 1 1 A 115 115 GLN CB C 115 28.233 29.101 -0.868 1
1 1306 . 27 1 1 A 115 115 GLN N N 115 114.300 116.379 -2.079 1
1 1308 . 27 1 1 A 116 116 TYR H H 116 6.677 7.917 -1.240 1
1 1309 . 27 1 1 A 116 116 TYR HA H 116 4.193 4.500 -0.307 1
1 1312 . 27 1 1 A 116 116 TYR C C 116 175.268 172.923 2.345 1
1 1313 . 27 1 1 A 116 116 TYR CA C 116 54.357 58.286 -3.929 1
1 1314 . 27 1 1 A 116 116 TYR CB C 116 35.498 36.658 -1.160 1
1 1315 . 27 1 1 A 116 116 TYR N N 116 117.919 118.986 -1.067 1
1 1316 . 27 1 1 A 117 117 ASP H H 117 8.081 8.044 0.037 1
1 1317 . 27 1 1 A 117 117 ASP HA H 117 4.665 4.607 0.058 1
1 1320 . 27 1 1 A 117 117 ASP CA C 117 52.422 50.124 2.298 1
1 1321 . 27 1 1 A 117 117 ASP CB C 117 42.416 43.256 -0.840 1
1 1322 . 27 1 1 A 117 117 ASP N N 117 120.887 126.783 -5.896 1
1 1323 . 27 1 1 A 118 118 PRO C C 118 179.180 178.929 0.251 1
1 1324 . 27 1 1 A 118 118 PRO CA C 118 65.942 65.659 0.283 1
1 1325 . 27 1 1 A 118 118 PRO CB C 118 32.197 31.652 0.545 1
1 1326 . 27 1 1 A 119 119 GLY H H 119 9.742 8.445 1.297 1
1 1327 . 27 1 1 A 119 119 GLY C C 119 175.622 175.302 0.320 1
1 1328 . 27 1 1 A 119 119 GLY CA C 119 46.785 46.924 -0.139 1
1 1329 . 27 1 1 A 119 119 GLY N N 119 106.412 106.669 -0.257 1
1 1330 . 27 1 1 A 120 120 LEU H H 120 6.666 7.438 -0.772 1
1 1331 . 27 1 1 A 120 120 LEU HA H 120 3.365 3.466 -0.101 1
1 1341 . 27 1 1 A 120 120 LEU C C 120 179.262 178.545 0.717 1
1 1342 . 27 1 1 A 120 120 LEU CA C 120 56.605 57.550 -0.945 1
1 1343 . 27 1 1 A 120 120 LEU CB C 120 39.262 41.051 -1.789 1
1 1347 . 27 1 1 A 120 120 LEU N N 120 126.226 122.421 3.805 1
1 1348 . 27 1 1 A 121 121 PHE H H 121 7.356 8.367 -1.011 1
1 1349 . 27 1 1 A 121 121 PHE HA H 121 4.459 3.982 0.477 1
1 1352 . 27 1 1 A 121 121 PHE C C 121 179.716 177.754 1.962 1
1 1353 . 27 1 1 A 121 121 PHE CA C 121 62.838 61.888 0.950 1
1 1354 . 27 1 1 A 121 121 PHE CB C 121 37.603 39.142 -1.539 1
1 1355 . 27 1 1 A 121 121 PHE N N 121 117.437 119.351 -1.914 1
1 1356 . 27 1 1 A 122 122 ALA H H 122 7.926 8.565 -0.639 1
1 1357 . 27 1 1 A 122 122 ALA HA H 122 4.523 3.851 0.672 1
1 1361 . 27 1 1 A 122 122 ALA C C 122 180.435 179.448 0.987 1
1 1362 . 27 1 1 A 122 122 ALA CA C 122 55.527 55.105 0.422 1
1 1363 . 27 1 1 A 122 122 ALA CB C 122 17.814 18.000 -0.186 1
1 1364 . 27 1 1 A 122 122 ALA N N 122 121.068 121.023 0.045 1
1 1365 . 27 1 1 A 123 123 GLN H H 123 7.507 7.645 -0.138 1
1 1366 . 27 1 1 A 123 123 GLN HA H 123 4.153 3.883 0.270 1
1 1371 . 27 1 1 A 123 123 GLN C C 123 180.561 178.430 2.131 1
1 1372 . 27 1 1 A 123 123 GLN CA C 123 59.948 59.094 0.854 1
1 1373 . 27 1 1 A 123 123 GLN CB C 123 29.135 28.255 0.880 1
1 1375 . 27 1 1 A 123 123 GLN N N 123 120.324 117.790 2.534 1
1 1376 . 27 1 1 A 124 124 ILE H H 124 8.318 7.758 0.560 1
1 1377 . 27 1 1 A 124 124 ILE HA H 124 3.635 3.423 0.212 1
1 1387 . 27 1 1 A 124 124 ILE C C 124 176.481 177.607 -1.126 1
1 1388 . 27 1 1 A 124 124 ILE CA C 124 66.432 64.188 2.244 1
1 1389 . 27 1 1 A 124 124 ILE CB C 124 39.168 37.732 1.436 1
1 1393 . 27 1 1 A 124 124 ILE N N 124 123.747 120.865 2.882 1
1 1394 . 27 1 1 A 125 125 GLN H H 125 8.474 8.006 0.468 1
1 1395 . 27 1 1 A 125 125 GLN HA H 125 4.264 4.146 0.118 1
1 1402 . 27 1 1 A 125 125 GLN C C 125 178.947 178.128 0.819 1
1 1403 . 27 1 1 A 125 125 GLN CA C 125 59.651 58.395 1.256 1
1 1404 . 27 1 1 A 125 125 GLN CB C 125 28.880 28.115 0.765 1
1 1406 . 27 1 1 A 125 125 GLN N N 125 120.368 119.502 0.866 1
1 1408 . 27 1 1 A 126 126 ALA H H 126 8.002 7.928 0.074 1
1 1409 . 27 1 1 A 126 126 ALA HA H 126 4.144 4.126 0.018 1
1 1413 . 27 1 1 A 126 126 ALA C C 126 179.316 179.548 -0.232 1
1 1414 . 27 1 1 A 126 126 ALA CA C 126 55.036 54.920 0.116 1
1 1415 . 27 1 1 A 126 126 ALA CB C 126 18.087 18.292 -0.205 1
1 1416 . 27 1 1 A 126 126 ALA N N 126 121.661 121.435 0.226 1
1 1417 . 27 1 1 A 127 127 ALA H H 127 7.823 8.176 -0.353 1
1 1418 . 27 1 1 A 127 127 ALA HA H 127 4.162 4.054 0.108 1
1 1422 . 27 1 1 A 127 127 ALA C C 127 180.707 179.700 1.007 1
1 1423 . 27 1 1 A 127 127 ALA CA C 127 55.080 54.885 0.195 1
1 1424 . 27 1 1 A 127 127 ALA CB C 127 19.354 18.192 1.162 1
1 1425 . 27 1 1 A 127 127 ALA N N 127 119.853 119.565 0.288 1
1 1426 . 27 1 1 A 128 128 ALA H H 128 8.936 7.521 1.415 1
1 1427 . 27 1 1 A 128 128 ALA HA H 128 3.928 4.152 -0.224 1
1 1431 . 27 1 1 A 128 128 ALA C C 128 181.031 179.290 1.741 1
1 1432 . 27 1 1 A 128 128 ALA CA C 128 55.502 54.998 0.504 1
1 1433 . 27 1 1 A 128 128 ALA CB C 128 16.609 18.011 -1.402 1
1 1434 . 27 1 1 A 128 128 ALA N N 128 121.355 120.486 0.869 1
1 1435 . 27 1 1 A 129 129 THR H H 129 8.543 8.146 0.397 1
1 1436 . 27 1 1 A 129 129 THR HA H 129 4.015 3.954 0.061 1
1 1441 . 27 1 1 A 129 129 THR C C 129 177.332 177.042 0.290 1
1 1442 . 27 1 1 A 129 129 THR CA C 129 65.893 65.511 0.382 1
1 1443 . 27 1 1 A 129 129 THR CB C 129 68.566 68.428 0.138 1
1 1445 . 27 1 1 A 129 129 THR N N 129 112.709 111.446 1.263 1
1 1446 . 27 1 1 A 130 130 LYS H H 130 8.126 7.888 0.238 1
1 1447 . 27 1 1 A 130 130 LYS HA H 130 4.000 3.959 0.041 1
1 1456 . 27 1 1 A 130 130 LYS C C 130 179.082 178.494 0.588 1
1 1457 . 27 1 1 A 130 130 LYS CA C 130 60.299 59.608 0.691 1
1 1458 . 27 1 1 A 130 130 LYS CB C 130 32.767 32.447 0.320 1
1 1462 . 27 1 1 A 130 130 LYS N N 130 123.879 122.411 1.468 1
1 1463 . 27 1 1 A 131 131 ALA H H 131 7.184 7.918 -0.734 1
1 1464 . 27 1 1 A 131 131 ALA HA H 131 4.005 4.208 -0.203 1
1 1468 . 27 1 1 A 131 131 ALA C C 131 178.482 179.581 -1.099 1
1 1469 . 27 1 1 A 131 131 ALA CA C 131 55.027 55.318 -0.291 1
1 1470 . 27 1 1 A 131 131 ALA CB C 131 18.669 18.988 -0.319 1
1 1471 . 27 1 1 A 131 131 ALA N N 131 118.590 121.824 -3.234 1
1 1472 . 27 1 1 A 132 132 TRP H H 132 7.977 8.820 -0.843 1
1 1473 . 27 1 1 A 132 132 TRP HA H 132 4.001 4.399 -0.398 1
1 1480 . 27 1 1 A 132 132 TRP C C 132 177.332 175.789 1.543 1
1 1481 . 27 1 1 A 132 132 TRP CA C 132 60.431 57.532 2.899 1
1 1482 . 27 1 1 A 132 132 TRP CB C 132 27.786 27.888 -0.102 1
1 1486 . 27 1 1 A 132 132 TRP N N 132 119.168 117.199 1.969 1
1 1488 . 27 1 1 A 133 133 ARG H H 133 8.006 8.133 -0.127 1
1 1489 . 27 1 1 A 133 133 ARG HA H 133 4.027 4.450 -0.423 1
1 1497 . 27 1 1 A 133 133 ARG C C 133 176.664 177.979 -1.315 1
1 1498 . 27 1 1 A 133 133 ARG CA C 133 59.355 57.097 2.258 1
1 1499 . 27 1 1 A 133 133 ARG CB C 133 30.451 32.293 -1.842 1
1 1502 . 27 1 1 A 133 133 ARG N N 133 113.062 120.646 -7.584 1
1 1504 . 27 1 1 A 134 134 LYS H H 134 7.322 8.510 -1.188 1
1 1505 . 27 1 1 A 134 134 LYS HA H 134 4.313 4.312 0.001 1
1 1514 . 27 1 1 A 134 134 LYS C C 134 176.282 176.292 -0.010 1
1 1515 . 27 1 1 A 134 134 LYS CA C 134 54.922 57.180 -2.258 1
1 1516 . 27 1 1 A 134 134 LYS CB C 134 32.633 31.841 0.792 1
1 1520 . 27 1 1 A 134 134 LYS N N 134 118.170 117.216 0.954 1
1 1521 . 27 1 1 A 135 135 LEU H H 135 7.440 7.603 -0.163 1
1 1522 . 27 1 1 A 135 135 LEU HA H 135 4.174 4.902 -0.728 1
1 1532 . 27 1 1 A 135 135 LEU CA C 135 54.408 51.978 2.430 1
1 1533 . 27 1 1 A 135 135 LEU CB C 135 40.407 42.813 -2.406 1
1 1537 . 27 1 1 A 135 135 LEU N N 135 123.358 117.333 6.025 1
1 1538 . 27 1 1 A 136 136 PRO HA H 136 4.437 4.507 -0.070 1
1 1545 . 27 1 1 A 136 136 PRO C C 136 177.106 176.865 0.241 1
1 1546 . 27 1 1 A 136 136 PRO CA C 136 62.889 64.842 -1.953 1
1 1547 . 27 1 1 A 136 136 PRO CB C 136 32.192 32.301 -0.109 1
1 1550 . 27 1 1 A 137 137 VAL H H 137 8.219 7.592 0.627 1
1 1551 . 27 1 1 A 137 137 VAL HA H 137 4.077 4.748 -0.671 1
1 1559 . 27 1 1 A 137 137 VAL C C 137 176.305 175.529 0.776 1
1 1560 . 27 1 1 A 137 137 VAL CA C 137 61.958 60.430 1.528 1
1 1561 . 27 1 1 A 137 137 VAL CB C 137 32.755 35.545 -2.790 1
1 1564 . 27 1 1 A 137 137 VAL N N 137 120.079 117.482 2.597 1
1 1565 . 27 1 1 A 138 138 LYS H H 138 8.444 8.400 0.044 1
1 1566 . 27 1 1 A 138 138 LYS HA H 138 4.316 4.616 -0.300 1
1 1575 . 27 1 1 A 138 138 LYS C C 138 176.790 177.116 -0.326 1
1 1576 . 27 1 1 A 138 138 LYS CA C 138 56.792 55.628 1.164 1
1 1577 . 27 1 1 A 138 138 LYS CB C 138 33.205 32.835 0.370 1
1 1581 . 27 1 1 A 138 138 LYS N N 138 126.449 120.710 5.739 1
1 1582 . 27 1 1 A 139 139 GLY H H 139 8.518 7.951 0.567 1
1 1583 . 27 1 1 A 139 139 GLY HA2 H 139 4.070 3.929 0.141 1
1 1584 . 27 1 1 A 139 139 GLY HA3 H 139 3.897 3.938 -0.041 1
1 1585 . 27 1 1 A 139 139 GLY C C 139 172.874 172.162 0.712 1
1 1586 . 27 1 1 A 139 139 GLY CA C 139 45.157 45.655 -0.498 1
1 1587 . 27 1 1 A 139 139 GLY N N 139 112.617 108.947 3.670 1
1 6 . 28 1 1 A 2 2 VAL H H 2 8.992 7.479 1.513 1
1 7 . 28 1 1 A 2 2 VAL HA H 2 5.370 4.954 0.416 1
1 15 . 28 1 1 A 2 2 VAL C C 2 174.325 173.987 0.338 1
1 16 . 28 1 1 A 2 2 VAL CA C 2 61.267 60.629 0.638 1
1 17 . 28 1 1 A 2 2 VAL CB C 2 33.890 35.152 -1.262 1
1 20 . 28 1 1 A 2 2 VAL N N 2 126.939 116.390 10.549 1
1 21 . 28 1 1 A 3 3 THR H H 3 8.912 9.151 -0.239 1
1 22 . 28 1 1 A 3 3 THR HA H 3 4.505 4.865 -0.360 1
1 27 . 28 1 1 A 3 3 THR C C 3 172.710 172.884 -0.174 1
1 28 . 28 1 1 A 3 3 THR CA C 3 59.689 59.416 0.273 1
1 29 . 28 1 1 A 3 3 THR CB C 3 72.398 72.035 0.363 1
1 31 . 28 1 1 A 3 3 THR N N 3 118.091 122.390 -4.299 1
1 32 . 28 1 1 A 4 4 GLU H H 4 8.631 8.552 0.079 1
1 33 . 28 1 1 A 4 4 GLU HA H 4 5.788 5.285 0.503 1
1 38 . 28 1 1 A 4 4 GLU C C 4 175.758 174.547 1.211 1
1 39 . 28 1 1 A 4 4 GLU CA C 4 54.902 54.919 -0.017 1
1 40 . 28 1 1 A 4 4 GLU CB C 4 35.097 32.410 2.687 1
1 42 . 28 1 1 A 4 4 GLU N N 4 120.966 123.709 -2.743 1
1 43 . 28 1 1 A 5 5 THR H H 5 9.188 9.244 -0.056 1
1 44 . 28 1 1 A 5 5 THR HA H 5 4.739 5.150 -0.411 1
1 49 . 28 1 1 A 5 5 THR C C 5 172.757 173.094 -0.337 1
1 50 . 28 1 1 A 5 5 THR CA C 5 60.382 59.521 0.861 1
1 51 . 28 1 1 A 5 5 THR CB C 5 71.558 72.067 -0.509 1
1 53 . 28 1 1 A 5 5 THR N N 5 119.366 118.635 0.731 1
1 54 . 28 1 1 A 6 6 VAL H H 6 8.476 9.085 -0.609 1
1 55 . 28 1 1 A 6 6 VAL HA H 6 5.026 5.665 -0.639 1
1 63 . 28 1 1 A 6 6 VAL C C 6 176.674 173.957 2.717 1
1 64 . 28 1 1 A 6 6 VAL CA C 6 61.008 59.638 1.370 1
1 65 . 28 1 1 A 6 6 VAL CB C 6 33.861 34.967 -1.106 1
1 68 . 28 1 1 A 6 6 VAL N N 6 121.384 120.525 0.859 1
1 69 . 28 1 1 A 7 7 ASP H H 7 8.848 8.935 -0.087 1
1 70 . 28 1 1 A 7 7 ASP HA H 7 4.797 4.928 -0.131 1
1 73 . 28 1 1 A 7 7 ASP CA C 7 52.834 54.040 -1.206 1
1 74 . 28 1 1 A 7 7 ASP CB C 7 42.219 42.314 -0.095 1
1 75 . 28 1 1 A 7 7 ASP N N 7 127.061 125.800 1.261 1
1 76 . 28 1 1 A 8 8 GLY C C 8 175.143 175.104 0.039 1
1 77 . 28 1 1 A 8 8 GLY CA C 8 46.553 47.383 -0.830 1
1 78 . 28 1 1 A 9 9 GLN H H 9 8.408 9.060 -0.652 1
1 79 . 28 1 1 A 9 9 GLN HA H 9 4.541 4.471 0.070 1
1 86 . 28 1 1 A 9 9 GLN C C 9 176.463 176.067 0.396 1
1 87 . 28 1 1 A 9 9 GLN CA C 9 55.167 54.941 0.226 1
1 88 . 28 1 1 A 9 9 GLN CB C 9 29.376 29.999 -0.623 1
1 90 . 28 1 1 A 9 9 GLN N N 9 118.300 119.622 -1.322 1
1 92 . 28 1 1 A 10 10 GLY H H 10 8.162 7.821 0.341 1
1 93 . 28 1 1 A 10 10 GLY HA2 H 10 4.174 3.961 0.213 1
1 94 . 28 1 1 A 10 10 GLY HA3 H 10 3.521 3.967 -0.446 1
1 95 . 28 1 1 A 10 10 GLY C C 10 174.092 174.295 -0.203 1
1 96 . 28 1 1 A 10 10 GLY CA C 10 45.558 46.159 -0.601 1
1 97 . 28 1 1 A 10 10 GLY N N 10 108.747 111.057 -2.310 1
1 98 . 28 1 1 A 11 11 GLN H H 11 8.507 7.649 0.858 1
1 99 . 28 1 1 A 11 11 GLN HA H 11 4.202 4.641 -0.439 1
1 106 . 28 1 1 A 11 11 GLN C C 11 173.992 174.357 -0.365 1
1 107 . 28 1 1 A 11 11 GLN CA C 11 55.098 54.514 0.584 1
1 108 . 28 1 1 A 11 11 GLN CB C 11 29.097 31.098 -2.001 1
1 110 . 28 1 1 A 11 11 GLN N N 11 122.979 119.040 3.939 1
1 112 . 28 1 1 A 12 12 ALA H H 12 8.259 8.934 -0.675 1
1 113 . 28 1 1 A 12 12 ALA HA H 12 5.156 5.722 -0.566 1
1 117 . 28 1 1 A 12 12 ALA C C 12 177.284 176.175 1.109 1
1 118 . 28 1 1 A 12 12 ALA CA C 12 51.087 50.197 0.890 1
1 119 . 28 1 1 A 12 12 ALA CB C 12 20.500 21.422 -0.922 1
1 120 . 28 1 1 A 12 12 ALA N N 12 127.100 124.756 2.344 1
1 121 . 28 1 1 A 13 13 TRP H H 13 9.245 9.877 -0.632 1
1 122 . 28 1 1 A 13 13 TRP HA H 13 4.717 5.415 -0.698 1
1 131 . 28 1 1 A 13 13 TRP C C 13 175.108 175.846 -0.738 1
1 132 . 28 1 1 A 13 13 TRP CA C 13 55.966 55.836 0.130 1
1 133 . 28 1 1 A 13 13 TRP CB C 13 31.912 32.896 -0.984 1
1 139 . 28 1 1 A 13 13 TRP N N 13 123.088 122.334 0.754 1
1 141 . 28 1 1 A 14 14 ARG H H 14 8.575 8.833 -0.258 1
1 142 . 28 1 1 A 14 14 ARG HA H 14 5.335 5.391 -0.056 1
1 150 . 28 1 1 A 14 14 ARG C C 14 175.191 175.461 -0.270 1
1 151 . 28 1 1 A 14 14 ARG CA C 14 53.106 54.591 -1.485 1
1 152 . 28 1 1 A 14 14 ARG CB C 14 32.749 34.644 -1.895 1
1 154 . 28 1 1 A 14 14 ARG N N 14 121.163 120.856 0.307 1
1 156 . 28 1 1 A 15 15 HIS H H 15 8.595 9.182 -0.587 1
1 157 . 28 1 1 A 15 15 HIS HA H 15 4.790 4.916 -0.126 1
1 161 . 28 1 1 A 15 15 HIS C C 15 173.770 174.045 -0.275 1
1 162 . 28 1 1 A 15 15 HIS CA C 15 55.289 54.753 0.536 1
1 163 . 28 1 1 A 15 15 HIS CB C 15 33.208 33.826 -0.618 1
1 165 . 28 1 1 A 15 15 HIS N N 15 117.643 118.921 -1.278 1
1 166 . 28 1 1 A 16 16 HIS H H 16 8.993 8.946 0.047 1
1 167 . 28 1 1 A 16 16 HIS HA H 16 5.158 5.296 -0.138 1
1 171 . 28 1 1 A 16 16 HIS C C 16 173.608 173.912 -0.304 1
1 172 . 28 1 1 A 16 16 HIS CA C 16 56.450 54.719 1.731 1
1 173 . 28 1 1 A 16 16 HIS CB C 16 34.171 32.787 1.384 1
1 175 . 28 1 1 A 16 16 HIS N N 16 123.520 122.924 0.596 1
1 176 . 28 1 1 A 17 17 ASN H H 17 7.829 9.230 -1.401 1
1 177 . 28 1 1 A 17 17 ASN HA H 17 4.713 5.221 -0.508 1
1 182 . 28 1 1 A 17 17 ASN C C 17 173.682 175.101 -1.419 1
1 183 . 28 1 1 A 17 17 ASN CA C 17 51.822 51.386 0.436 1
1 184 . 28 1 1 A 17 17 ASN CB C 17 43.176 41.860 1.316 1
1 185 . 28 1 1 A 17 17 ASN N N 17 122.213 124.080 -1.867 1
1 187 . 28 1 1 A 18 18 GLY H H 18 8.423 8.259 0.164 1
1 188 . 28 1 1 A 18 18 GLY HA2 H 18 3.931 3.827 0.104 1
1 189 . 28 1 1 A 18 18 GLY HA3 H 18 3.707 4.055 -0.348 1
1 190 . 28 1 1 A 18 18 GLY C C 18 173.985 173.203 0.782 1
1 191 . 28 1 1 A 18 18 GLY CA C 18 43.949 44.062 -0.113 1
1 192 . 28 1 1 A 18 18 GLY N N 18 106.991 107.413 -0.422 1
1 193 . 28 1 1 A 19 19 PHE H H 19 8.338 8.412 -0.074 1
1 194 . 28 1 1 A 19 19 PHE HA H 19 4.068 5.085 -1.017 1
1 197 . 28 1 1 A 19 19 PHE C C 19 176.568 175.451 1.117 1
1 198 . 28 1 1 A 19 19 PHE CA C 19 59.338 56.906 2.432 1
1 199 . 28 1 1 A 19 19 PHE CB C 19 40.201 41.987 -1.786 1
1 200 . 28 1 1 A 19 19 PHE N N 19 116.857 119.520 -2.663 1
1 201 . 28 1 1 A 20 20 ASP H H 20 8.794 9.156 -0.362 1
1 202 . 28 1 1 A 20 20 ASP HA H 20 4.485 4.822 -0.337 1
1 205 . 28 1 1 A 20 20 ASP C C 20 177.379 177.391 -0.012 1
1 206 . 28 1 1 A 20 20 ASP CA C 20 54.140 54.819 -0.679 1
1 207 . 28 1 1 A 20 20 ASP CB C 20 41.915 41.080 0.835 1
1 208 . 28 1 1 A 20 20 ASP N N 20 123.025 123.206 -0.181 1
1 209 . 28 1 1 A 21 21 PHE H H 21 8.862 9.061 -0.199 1
1 210 . 28 1 1 A 21 21 PHE HA H 21 4.087 4.108 -0.021 1
1 218 . 28 1 1 A 21 21 PHE C C 21 176.952 177.193 -0.241 1
1 219 . 28 1 1 A 21 21 PHE CA C 21 61.095 62.430 -1.335 1
1 220 . 28 1 1 A 21 21 PHE CB C 21 38.678 39.427 -0.749 1
1 226 . 28 1 1 A 21 21 PHE N N 21 127.163 125.478 1.685 1
1 227 . 28 1 1 A 22 22 ALA H H 22 8.561 8.329 0.232 1
1 228 . 28 1 1 A 22 22 ALA HA H 22 3.878 3.980 -0.102 1
1 232 . 28 1 1 A 22 22 ALA C C 22 180.710 180.242 0.468 1
1 233 . 28 1 1 A 22 22 ALA CA C 22 55.211 55.173 0.038 1
1 234 . 28 1 1 A 22 22 ALA CB C 22 18.321 18.264 0.057 1
1 235 . 28 1 1 A 22 22 ALA N N 22 120.293 121.150 -0.857 1
1 236 . 28 1 1 A 23 23 VAL H H 23 7.241 7.664 -0.423 1
1 237 . 28 1 1 A 23 23 VAL HA H 23 3.684 3.515 0.169 1
1 245 . 28 1 1 A 23 23 VAL C C 23 177.101 178.178 -1.077 1
1 246 . 28 1 1 A 23 23 VAL CA C 23 65.237 66.950 -1.713 1
1 247 . 28 1 1 A 23 23 VAL CB C 23 31.780 31.704 0.076 1
1 250 . 28 1 1 A 23 23 VAL N N 23 118.775 117.970 0.805 1
1 251 . 28 1 1 A 24 24 ILE H H 24 6.761 7.713 -0.952 1
1 252 . 28 1 1 A 24 24 ILE HA H 24 3.196 3.410 -0.214 1
1 262 . 28 1 1 A 24 24 ILE C C 24 177.287 177.691 -0.404 1
1 263 . 28 1 1 A 24 24 ILE CA C 24 63.404 65.484 -2.080 1
1 264 . 28 1 1 A 24 24 ILE CB C 24 36.294 37.570 -1.276 1
1 268 . 28 1 1 A 24 24 ILE N N 24 119.036 119.650 -0.614 1
1 269 . 28 1 1 A 25 25 LYS H H 25 8.032 8.029 0.003 1
1 270 . 28 1 1 A 25 25 LYS HA H 25 3.809 3.581 0.228 1
1 279 . 28 1 1 A 25 25 LYS C C 25 179.450 178.791 0.659 1
1 280 . 28 1 1 A 25 25 LYS CA C 25 59.621 59.493 0.128 1
1 281 . 28 1 1 A 25 25 LYS CB C 25 32.259 32.153 0.106 1
1 285 . 28 1 1 A 25 25 LYS N N 25 118.368 120.099 -1.731 1
1 286 . 28 1 1 A 26 26 GLU H H 26 7.845 8.007 -0.162 1
1 287 . 28 1 1 A 26 26 GLU HA H 26 4.021 4.196 -0.175 1
1 292 . 28 1 1 A 26 26 GLU C C 26 179.191 178.751 0.440 1
1 293 . 28 1 1 A 26 26 GLU CA C 26 59.530 59.054 0.476 1
1 294 . 28 1 1 A 26 26 GLU CB C 26 29.449 29.238 0.211 1
1 296 . 28 1 1 A 26 26 GLU N N 26 120.522 118.785 1.737 1
1 297 . 28 1 1 A 27 27 LEU H H 27 8.165 7.974 0.191 1
1 298 . 28 1 1 A 27 27 LEU HA H 27 4.163 4.180 -0.017 1
1 308 . 28 1 1 A 27 27 LEU C C 27 177.256 178.347 -1.091 1
1 309 . 28 1 1 A 27 27 LEU CA C 27 58.049 57.450 0.599 1
1 310 . 28 1 1 A 27 27 LEU CB C 27 41.365 41.414 -0.049 1
1 314 . 28 1 1 A 27 27 LEU N N 27 120.879 120.932 -0.053 1
1 315 . 28 1 1 A 28 28 LYS H H 28 8.902 8.149 0.753 1
1 316 . 28 1 1 A 28 28 LYS HA H 28 4.199 4.570 -0.371 1
1 317 . 28 1 1 A 28 28 LYS C C 28 179.707 179.317 0.390 1
1 318 . 28 1 1 A 28 28 LYS CA C 28 60.097 59.019 1.078 1
1 319 . 28 1 1 A 28 28 LYS CB C 28 33.420 31.746 1.674 1
1 320 . 28 1 1 A 28 28 LYS N N 28 120.050 119.471 0.579 1
1 321 . 28 1 1 A 29 29 THR H H 29 8.294 8.217 0.077 1
1 322 . 28 1 1 A 29 29 THR HA H 29 3.892 3.985 -0.093 1
1 327 . 28 1 1 A 29 29 THR C C 29 175.711 176.543 -0.832 1
1 328 . 28 1 1 A 29 29 THR CA C 29 66.846 66.462 0.384 1
1 329 . 28 1 1 A 29 29 THR CB C 29 68.794 68.969 -0.175 1
1 331 . 28 1 1 A 29 29 THR N N 29 115.933 116.806 -0.873 1
1 332 . 28 1 1 A 30 30 ALA H H 30 8.244 8.961 -0.717 1
1 333 . 28 1 1 A 30 30 ALA HA H 30 4.241 4.231 0.010 1
1 337 . 28 1 1 A 30 30 ALA C C 30 179.128 179.050 0.078 1
1 338 . 28 1 1 A 30 30 ALA CA C 30 55.714 55.770 -0.056 1
1 339 . 28 1 1 A 30 30 ALA CB C 30 18.955 18.162 0.793 1
1 340 . 28 1 1 A 30 30 ALA N N 30 124.617 123.232 1.385 1
1 341 . 28 1 1 A 31 31 ALA H H 31 8.968 8.624 0.344 1
1 342 . 28 1 1 A 31 31 ALA HA H 31 3.890 4.045 -0.155 1
1 346 . 28 1 1 A 31 31 ALA C C 31 180.352 179.416 0.936 1
1 347 . 28 1 1 A 31 31 ALA CA C 31 55.454 55.479 -0.025 1
1 348 . 28 1 1 A 31 31 ALA CB C 31 17.124 18.283 -1.159 1
1 349 . 28 1 1 A 31 31 ALA N N 31 119.327 120.615 -1.288 1
1 350 . 28 1 1 A 32 32 SER H H 32 7.995 7.819 0.176 1
1 351 . 28 1 1 A 32 32 SER HA H 32 4.238 4.171 0.067 1
1 354 . 28 1 1 A 32 32 SER C C 32 175.612 177.198 -1.586 1
1 355 . 28 1 1 A 32 32 SER CA C 32 61.203 61.480 -0.277 1
1 356 . 28 1 1 A 32 32 SER CB C 32 63.406 62.939 0.467 1
1 357 . 28 1 1 A 32 32 SER N N 32 111.962 113.286 -1.324 1
1 358 . 28 1 1 A 33 33 GLN H H 33 8.333 8.210 0.123 1
1 359 . 28 1 1 A 33 33 GLN HA H 33 3.992 4.170 -0.178 1
1 366 . 28 1 1 A 33 33 GLN C C 33 177.486 177.082 0.404 1
1 367 . 28 1 1 A 33 33 GLN CA C 33 58.277 58.115 0.162 1
1 368 . 28 1 1 A 33 33 GLN CB C 33 29.140 29.683 -0.543 1
1 370 . 28 1 1 A 33 33 GLN N N 33 119.527 120.643 -1.116 1
1 372 . 28 1 1 A 34 34 TYR H H 34 8.587 8.250 0.337 1
1 373 . 28 1 1 A 34 34 TYR HA H 34 4.792 4.708 0.084 1
1 380 . 28 1 1 A 34 34 TYR C C 34 176.499 176.544 -0.045 1
1 381 . 28 1 1 A 34 34 TYR CA C 34 57.711 58.363 -0.652 1
1 382 . 28 1 1 A 34 34 TYR CB C 34 39.561 39.884 -0.323 1
1 387 . 28 1 1 A 34 34 TYR N N 34 114.610 113.917 0.693 1
1 388 . 28 1 1 A 35 35 GLY H H 35 7.346 8.698 -1.352 1
1 389 . 28 1 1 A 35 35 GLY HA2 H 35 4.785 4.114 0.671 1
1 390 . 28 1 1 A 35 35 GLY HA3 H 35 4.007 4.126 -0.119 1
1 391 . 28 1 1 A 35 35 GLY C C 35 175.796 173.439 2.357 1
1 392 . 28 1 1 A 35 35 GLY CA C 35 44.355 44.907 -0.552 1
1 393 . 28 1 1 A 35 35 GLY N N 35 108.501 107.046 1.455 1
1 394 . 28 1 1 A 36 36 ALA H H 36 9.363 8.243 1.120 1
1 395 . 28 1 1 A 36 36 ALA HA H 36 4.217 4.914 -0.697 1
1 399 . 28 1 1 A 36 36 ALA C C 36 178.039 177.990 0.049 1
1 400 . 28 1 1 A 36 36 ALA CA C 36 56.114 51.193 4.921 1
1 401 . 28 1 1 A 36 36 ALA CB C 36 19.179 20.864 -1.685 1
1 402 . 28 1 1 A 36 36 ALA N N 36 125.811 124.408 1.403 1
1 403 . 28 1 1 A 37 37 THR H H 37 8.070 8.712 -0.642 1
1 404 . 28 1 1 A 37 37 THR HA H 37 4.570 4.216 0.354 1
1 409 . 28 1 1 A 37 37 THR C C 37 173.685 173.993 -0.308 1
1 410 . 28 1 1 A 37 37 THR CA C 37 59.822 65.450 -5.628 1
1 411 . 28 1 1 A 37 37 THR CB C 37 68.267 66.794 1.473 1
1 413 . 28 1 1 A 37 37 THR N N 37 129.410 109.698 19.712 1
1 414 . 28 1 1 A 38 38 ALA H H 38 6.853 7.844 -0.991 1
1 415 . 28 1 1 A 38 38 ALA HA H 38 4.601 4.519 0.082 1
1 419 . 28 1 1 A 38 38 ALA CA C 38 50.758 50.763 -0.005 1
1 420 . 28 1 1 A 38 38 ALA CB C 38 18.325 19.292 -0.967 1
1 421 . 28 1 1 A 38 38 ALA N N 38 124.674 125.208 -0.534 1
1 422 . 28 1 1 A 40 40 TYR HA H 40 4.032 4.021 0.011 1
1 429 . 28 1 1 A 40 40 TYR C C 40 176.456 177.400 -0.944 1
1 430 . 28 1 1 A 40 40 TYR CA C 40 61.010 61.614 -0.604 1
1 431 . 28 1 1 A 40 40 TYR CB C 40 39.286 38.408 0.878 1
1 436 . 28 1 1 A 41 41 THR H H 41 6.874 8.261 -1.387 1
1 437 . 28 1 1 A 41 41 THR HA H 41 3.616 3.924 -0.308 1
1 442 . 28 1 1 A 41 41 THR C C 41 176.930 176.590 0.340 1
1 443 . 28 1 1 A 41 41 THR CA C 41 65.557 65.698 -0.141 1
1 444 . 28 1 1 A 41 41 THR CB C 41 68.228 69.434 -1.206 1
1 446 . 28 1 1 A 41 41 THR N N 41 115.143 113.990 1.153 1
1 447 . 28 1 1 A 42 42 LEU H H 42 8.623 7.373 1.250 1
1 448 . 28 1 1 A 42 42 LEU HA H 42 3.708 4.023 -0.315 1
1 458 . 28 1 1 A 42 42 LEU C C 42 178.206 178.875 -0.669 1
1 459 . 28 1 1 A 42 42 LEU CA C 42 57.417 57.841 -0.424 1
1 460 . 28 1 1 A 42 42 LEU CB C 42 41.342 41.185 0.157 1
1 464 . 28 1 1 A 42 42 LEU N N 42 120.418 118.245 2.173 1
1 465 . 28 1 1 A 43 43 ALA H H 43 7.735 7.526 0.209 1
1 466 . 28 1 1 A 43 43 ALA HA H 43 4.020 3.996 0.024 1
1 470 . 28 1 1 A 43 43 ALA C C 43 180.826 180.537 0.289 1
1 471 . 28 1 1 A 43 43 ALA CA C 43 54.925 55.020 -0.095 1
1 472 . 28 1 1 A 43 43 ALA CB C 43 17.506 18.282 -0.776 1
1 473 . 28 1 1 A 43 43 ALA N N 43 120.203 121.786 -1.583 1
1 474 . 28 1 1 A 44 44 ILE H H 44 7.149 7.358 -0.209 1
1 475 . 28 1 1 A 44 44 ILE HA H 44 3.603 3.602 0.001 1
1 485 . 28 1 1 A 44 44 ILE C C 44 178.594 178.087 0.507 1
1 486 . 28 1 1 A 44 44 ILE CA C 44 64.782 64.560 0.222 1
1 487 . 28 1 1 A 44 44 ILE CB C 44 37.472 37.794 -0.322 1
1 491 . 28 1 1 A 44 44 ILE N N 44 118.881 119.376 -0.495 1
1 492 . 28 1 1 A 45 45 VAL H H 45 7.968 7.871 0.097 1
1 493 . 28 1 1 A 45 45 VAL HA H 45 2.925 3.478 -0.553 1
1 501 . 28 1 1 A 45 45 VAL C C 45 177.023 177.487 -0.464 1
1 502 . 28 1 1 A 45 45 VAL CA C 45 67.081 66.521 0.560 1
1 503 . 28 1 1 A 45 45 VAL CB C 45 30.854 31.209 -0.355 1
1 506 . 28 1 1 A 45 45 VAL N N 45 120.764 119.470 1.294 1
1 507 . 28 1 1 A 46 46 GLU H H 46 8.399 8.450 -0.051 1
1 508 . 28 1 1 A 46 46 GLU HA H 46 3.848 3.908 -0.060 1
1 513 . 28 1 1 A 46 46 GLU C C 46 178.656 179.032 -0.376 1
1 514 . 28 1 1 A 46 46 GLU CA C 46 59.491 59.452 0.039 1
1 515 . 28 1 1 A 46 46 GLU CB C 46 28.991 29.318 -0.327 1
1 517 . 28 1 1 A 46 46 GLU N N 46 116.599 119.905 -3.306 1
1 518 . 28 1 1 A 47 47 SER H H 47 7.273 7.782 -0.509 1
1 519 . 28 1 1 A 47 47 SER HA H 47 4.287 4.287 0.000 1
1 521 . 28 1 1 A 47 47 SER CA C 47 61.047 61.951 -0.904 1
1 522 . 28 1 1 A 47 47 SER CB C 47 63.016 63.317 -0.301 1
1 523 . 28 1 1 A 47 47 SER N N 47 113.609 117.086 -3.477 1
1 524 . 28 1 1 A 48 48 VAL H H 48 8.006 7.829 0.177 1
1 525 . 28 1 1 A 48 48 VAL HA H 48 3.556 3.958 -0.402 1
1 533 . 28 1 1 A 48 48 VAL C C 48 177.257 177.528 -0.271 1
1 534 . 28 1 1 A 48 48 VAL CA C 48 65.025 64.474 0.551 1
1 535 . 28 1 1 A 48 48 VAL CB C 48 31.841 31.620 0.221 1
1 538 . 28 1 1 A 48 48 VAL N N 48 122.327 118.838 3.489 1
1 539 . 28 1 1 A 49 49 ALA H H 49 8.369 7.697 0.672 1
1 540 . 28 1 1 A 49 49 ALA HA H 49 4.115 4.340 -0.225 1
1 544 . 28 1 1 A 49 49 ALA C C 49 177.307 177.588 -0.281 1
1 545 . 28 1 1 A 49 49 ALA CA C 49 53.253 53.002 0.251 1
1 546 . 28 1 1 A 49 49 ALA CB C 49 20.131 18.707 1.424 1
1 547 . 28 1 1 A 49 49 ALA N N 49 118.050 123.974 -5.924 1
1 548 . 28 1 1 A 50 50 ASP H H 50 7.052 7.790 -0.738 1
1 549 . 28 1 1 A 50 50 ASP HA H 50 4.788 4.853 -0.065 1
1 552 . 28 1 1 A 50 50 ASP C C 50 175.481 176.381 -0.900 1
1 553 . 28 1 1 A 50 50 ASP CA C 50 53.681 53.868 -0.187 1
1 554 . 28 1 1 A 50 50 ASP CB C 50 39.333 41.142 -1.809 1
1 555 . 28 1 1 A 50 50 ASP N N 50 116.997 116.921 0.076 1
1 556 . 28 1 1 A 51 51 ASN H H 51 8.535 7.552 0.983 1
1 557 . 28 1 1 A 51 51 ASN HA H 51 4.628 5.247 -0.619 1
1 562 . 28 1 1 A 51 51 ASN C C 51 174.077 175.601 -1.524 1
1 563 . 28 1 1 A 51 51 ASN CA C 51 52.315 52.156 0.159 1
1 564 . 28 1 1 A 51 51 ASN CB C 51 41.928 40.161 1.767 1
1 565 . 28 1 1 A 51 51 ASN N N 51 118.626 117.731 0.895 1
1 567 . 28 1 1 A 52 52 TRP H H 52 8.555 8.809 -0.254 1
1 574 . 28 1 1 A 52 52 TRP C C 52 173.269 176.488 -3.219 1
1 575 . 28 1 1 A 52 52 TRP CA C 52 55.031 57.110 -2.079 1
1 576 . 28 1 1 A 52 52 TRP CB C 52 26.801 30.231 -3.430 1
1 582 . 28 1 1 A 52 52 TRP N N 52 120.693 121.475 -0.782 1
1 584 . 28 1 1 A 53 53 LEU H H 53 7.847 8.903 -1.056 1
1 585 . 28 1 1 A 53 53 LEU HA H 53 4.859 4.990 -0.131 1
1 595 . 28 1 1 A 53 53 LEU C C 53 177.397 174.984 2.413 1
1 596 . 28 1 1 A 53 53 LEU CA C 53 53.619 53.479 0.140 1
1 597 . 28 1 1 A 53 53 LEU CB C 53 41.812 45.614 -3.802 1
1 601 . 28 1 1 A 53 53 LEU N N 53 124.741 120.668 4.073 1
1 602 . 28 1 1 A 54 54 THR H H 54 8.850 8.354 0.496 1
1 603 . 28 1 1 A 54 54 THR HA H 54 4.598 4.548 0.050 1
1 608 . 28 1 1 A 54 54 THR CA C 54 60.531 58.418 2.113 1
1 609 . 28 1 1 A 54 54 THR CB C 54 67.183 70.216 -3.033 1
1 611 . 28 1 1 A 54 54 THR N N 54 113.407 109.611 3.796 1
1 612 . 28 1 1 A 55 55 PRO HA H 55 4.511 4.480 0.031 1
1 619 . 28 1 1 A 55 55 PRO C C 55 179.383 177.637 1.746 1
1 620 . 28 1 1 A 55 55 PRO CA C 55 67.159 65.565 1.594 1
1 621 . 28 1 1 A 55 55 PRO CB C 55 32.095 31.737 0.358 1
1 622 . 28 1 1 A 56 56 THR H H 56 8.575 7.623 0.952 1
1 623 . 28 1 1 A 56 56 THR HA H 56 4.229 4.156 0.073 1
1 628 . 28 1 1 A 56 56 THR C C 56 176.668 176.479 0.189 1
1 629 . 28 1 1 A 56 56 THR CA C 56 66.943 65.103 1.840 1
1 630 . 28 1 1 A 56 56 THR CB C 56 68.129 68.788 -0.659 1
1 632 . 28 1 1 A 56 56 THR N N 56 114.855 111.437 3.418 1
1 633 . 28 1 1 A 57 57 ASP H H 57 8.730 7.795 0.935 1
1 634 . 28 1 1 A 57 57 ASP HA H 57 4.425 4.538 -0.113 1
1 637 . 28 1 1 A 57 57 ASP C C 57 178.351 179.406 -1.055 1
1 638 . 28 1 1 A 57 57 ASP CA C 57 57.963 57.709 0.254 1
1 639 . 28 1 1 A 57 57 ASP CB C 57 40.134 40.688 -0.554 1
1 640 . 28 1 1 A 57 57 ASP N N 57 126.239 121.816 4.423 1
1 641 . 28 1 1 A 58 58 TRP H H 58 8.244 8.638 -0.394 1
1 642 . 28 1 1 A 58 58 TRP HA H 58 4.030 4.616 -0.586 1
1 650 . 28 1 1 A 58 58 TRP C C 58 177.432 179.030 -1.598 1
1 651 . 28 1 1 A 58 58 TRP CA C 58 62.731 60.000 2.731 1
1 652 . 28 1 1 A 58 58 TRP CB C 58 29.122 29.455 -0.333 1
1 657 . 28 1 1 A 58 58 TRP N N 58 119.241 120.597 -1.356 1
1 659 . 28 1 1 A 59 59 ASN H H 59 8.098 8.776 -0.678 1
1 660 . 28 1 1 A 59 59 ASN HA H 59 4.424 4.437 -0.013 1
1 663 . 28 1 1 A 59 59 ASN C C 59 176.952 178.172 -1.220 1
1 664 . 28 1 1 A 59 59 ASN CA C 59 58.135 56.403 1.732 1
1 665 . 28 1 1 A 59 59 ASN CB C 59 40.168 39.345 0.823 1
1 666 . 28 1 1 A 59 59 ASN N N 59 115.747 117.803 -2.056 1
1 667 . 28 1 1 A 60 60 THR H H 60 8.712 8.151 0.561 1
1 668 . 28 1 1 A 60 60 THR HA H 60 3.717 4.088 -0.371 1
1 673 . 28 1 1 A 60 60 THR C C 60 176.044 176.833 -0.789 1
1 674 . 28 1 1 A 60 60 THR CA C 60 66.576 67.537 -0.961 1
1 675 . 28 1 1 A 60 60 THR CB C 60 69.251 68.071 1.180 1
1 677 . 28 1 1 A 60 60 THR N N 60 114.896 116.204 -1.308 1
1 678 . 28 1 1 A 61 61 LEU H H 61 8.485 8.467 0.018 1
1 679 . 28 1 1 A 61 61 LEU HA H 61 3.391 3.741 -0.350 1
1 689 . 28 1 1 A 61 61 LEU C C 61 177.433 178.642 -1.209 1
1 690 . 28 1 1 A 61 61 LEU CA C 61 58.354 58.535 -0.181 1
1 691 . 28 1 1 A 61 61 LEU CB C 61 41.761 42.137 -0.376 1
1 695 . 28 1 1 A 61 61 LEU N N 61 123.433 121.979 1.454 1
1 696 . 28 1 1 A 62 62 VAL H H 62 8.073 8.320 -0.247 1
1 697 . 28 1 1 A 62 62 VAL HA H 62 3.207 3.763 -0.556 1
1 705 . 28 1 1 A 62 62 VAL C C 62 177.585 177.302 0.283 1
1 706 . 28 1 1 A 62 62 VAL CA C 62 67.345 65.215 2.130 1
1 707 . 28 1 1 A 62 62 VAL CB C 62 30.905 30.459 0.446 1
1 710 . 28 1 1 A 62 62 VAL N N 62 116.018 118.423 -2.405 1
1 711 . 28 1 1 A 63 63 ARG H H 63 7.765 7.972 -0.207 1
1 712 . 28 1 1 A 63 63 ARG HA H 63 3.602 3.972 -0.370 1
1 719 . 28 1 1 A 63 63 ARG C C 63 177.818 178.253 -0.435 1
1 720 . 28 1 1 A 63 63 ARG CA C 63 58.049 57.919 0.130 1
1 721 . 28 1 1 A 63 63 ARG CB C 63 29.955 29.113 0.842 1
1 724 . 28 1 1 A 63 63 ARG N N 63 116.700 120.427 -3.727 1
1 725 . 28 1 1 A 64 64 ALA H H 64 7.574 7.529 0.045 1
1 726 . 28 1 1 A 64 64 ALA HA H 64 4.158 4.374 -0.216 1
1 730 . 28 1 1 A 64 64 ALA C C 64 179.886 179.299 0.587 1
1 731 . 28 1 1 A 64 64 ALA CA C 64 54.007 54.035 -0.028 1
1 732 . 28 1 1 A 64 64 ALA CB C 64 19.147 19.604 -0.457 1
1 733 . 28 1 1 A 64 64 ALA N N 64 117.555 121.825 -4.270 1
1 734 . 28 1 1 A 65 65 VAL H H 65 7.554 7.976 -0.422 1
1 735 . 28 1 1 A 65 65 VAL HA H 65 4.253 3.834 0.419 1
1 743 . 28 1 1 A 65 65 VAL C C 65 174.180 176.339 -2.159 1
1 744 . 28 1 1 A 65 65 VAL CA C 65 62.683 65.483 -2.800 1
1 745 . 28 1 1 A 65 65 VAL CB C 65 33.458 31.176 2.282 1
1 748 . 28 1 1 A 65 65 VAL N N 65 110.013 115.759 -5.746 1
1 749 . 28 1 1 A 66 66 LEU H H 66 7.792 7.219 0.573 1
1 750 . 28 1 1 A 66 66 LEU HA H 66 4.790 4.753 0.037 1
1 760 . 28 1 1 A 66 66 LEU C C 66 177.537 175.377 2.160 1
1 761 . 28 1 1 A 66 66 LEU CA C 66 52.823 52.630 0.193 1
1 762 . 28 1 1 A 66 66 LEU CB C 66 44.071 45.394 -1.323 1
1 766 . 28 1 1 A 66 66 LEU N N 66 118.967 121.286 -2.319 1
1 767 . 28 1 1 A 67 67 SER H H 67 9.208 8.412 0.796 1
1 768 . 28 1 1 A 67 67 SER HA H 67 4.414 4.987 -0.573 1
1 771 . 28 1 1 A 67 67 SER CA C 67 57.943 57.112 0.831 1
1 772 . 28 1 1 A 67 67 SER CB C 67 64.743 66.844 -2.101 1
1 773 . 28 1 1 A 67 67 SER N N 67 116.378 115.558 0.820 1
1 774 . 28 1 1 A 69 69 GLY HA2 H 69 3.916 3.755 0.161 1
1 775 . 28 1 1 A 69 69 GLY HA3 H 69 3.867 3.779 0.088 1
1 776 . 28 1 1 A 69 69 GLY C C 69 176.783 175.605 1.178 1
1 777 . 28 1 1 A 69 69 GLY CA C 69 46.977 46.680 0.297 1
1 778 . 28 1 1 A 70 70 ASP H H 70 7.674 8.208 -0.534 1
1 779 . 28 1 1 A 70 70 ASP HA H 70 4.511 3.795 0.716 1
1 782 . 28 1 1 A 70 70 ASP C C 70 178.096 178.122 -0.026 1
1 783 . 28 1 1 A 70 70 ASP CA C 70 57.262 56.473 0.789 1
1 784 . 28 1 1 A 70 70 ASP CB C 70 40.594 39.861 0.733 1
1 785 . 28 1 1 A 70 70 ASP N N 70 123.930 121.647 2.283 1
1 786 . 28 1 1 A 71 71 HIS H H 71 8.729 8.036 0.693 1
1 787 . 28 1 1 A 71 71 HIS HA H 71 4.235 4.179 0.056 1
1 790 . 28 1 1 A 71 71 HIS C C 71 176.769 178.065 -1.296 1
1 791 . 28 1 1 A 71 71 HIS CA C 71 60.041 58.945 1.096 1
1 792 . 28 1 1 A 71 71 HIS CB C 71 30.682 30.151 0.531 1
1 793 . 28 1 1 A 71 71 HIS N N 71 121.003 117.297 3.706 1
1 794 . 28 1 1 A 72 72 LEU H H 72 7.620 8.004 -0.384 1
1 795 . 28 1 1 A 72 72 LEU HA H 72 3.769 3.947 -0.178 1
1 805 . 28 1 1 A 72 72 LEU C C 72 180.275 179.268 1.007 1
1 806 . 28 1 1 A 72 72 LEU CA C 72 58.192 57.978 0.214 1
1 807 . 28 1 1 A 72 72 LEU CB C 72 41.381 41.290 0.091 1
1 811 . 28 1 1 A 72 72 LEU N N 72 118.569 116.909 1.660 1
1 812 . 28 1 1 A 73 73 LEU H H 73 7.542 7.682 -0.140 1
1 813 . 28 1 1 A 73 73 LEU HA H 73 4.107 4.152 -0.045 1
1 823 . 28 1 1 A 73 73 LEU C C 73 179.436 179.206 0.230 1
1 824 . 28 1 1 A 73 73 LEU CA C 73 58.026 57.394 0.632 1
1 825 . 28 1 1 A 73 73 LEU CB C 73 41.638 42.076 -0.438 1
1 829 . 28 1 1 A 73 73 LEU N N 73 121.418 120.429 0.989 1
1 830 . 28 1 1 A 74 74 TRP H H 74 8.786 7.952 0.834 1
1 831 . 28 1 1 A 74 74 TRP HA H 74 3.589 5.406 -1.817 1
1 840 . 28 1 1 A 74 74 TRP C C 74 176.816 178.635 -1.819 1
1 841 . 28 1 1 A 74 74 TRP CA C 74 63.046 59.819 3.227 1
1 842 . 28 1 1 A 74 74 TRP CB C 74 28.065 28.916 -0.851 1
1 848 . 28 1 1 A 74 74 TRP N N 74 121.111 118.157 2.954 1
1 850 . 28 1 1 A 75 75 LYS H H 75 8.939 7.523 1.416 1
1 851 . 28 1 1 A 75 75 LYS HA H 75 3.055 4.187 -1.132 1
1 860 . 28 1 1 A 75 75 LYS C C 75 177.967 179.481 -1.514 1
1 861 . 28 1 1 A 75 75 LYS CA C 75 60.029 58.727 1.302 1
1 862 . 28 1 1 A 75 75 LYS CB C 75 32.533 32.926 -0.393 1
1 866 . 28 1 1 A 75 75 LYS N N 75 119.783 118.599 1.184 1
1 867 . 28 1 1 A 76 76 SER H H 76 7.832 8.189 -0.357 1
1 868 . 28 1 1 A 76 76 SER HA H 76 4.040 4.402 -0.362 1
1 871 . 28 1 1 A 76 76 SER C C 76 177.816 177.343 0.473 1
1 872 . 28 1 1 A 76 76 SER CA C 76 62.105 61.483 0.622 1
1 873 . 28 1 1 A 76 76 SER CB C 76 62.679 62.447 0.232 1
1 874 . 28 1 1 A 76 76 SER N N 76 113.395 114.663 -1.268 1
1 875 . 28 1 1 A 77 77 GLU H H 77 7.590 7.550 0.040 1
1 876 . 28 1 1 A 77 77 GLU HA H 77 4.042 4.204 -0.162 1
1 881 . 28 1 1 A 77 77 GLU C C 77 177.809 178.611 -0.802 1
1 882 . 28 1 1 A 77 77 GLU CA C 77 58.270 58.843 -0.573 1
1 883 . 28 1 1 A 77 77 GLU CB C 77 29.208 29.460 -0.252 1
1 885 . 28 1 1 A 77 77 GLU N N 77 121.574 122.614 -1.040 1
1 886 . 28 1 1 A 78 78 PHE H H 78 9.081 7.842 1.239 1
1 887 . 28 1 1 A 78 78 PHE HA H 78 3.778 4.220 -0.442 1
1 895 . 28 1 1 A 78 78 PHE C C 78 178.114 177.387 0.727 1
1 896 . 28 1 1 A 78 78 PHE CA C 78 60.629 61.212 -0.583 1
1 897 . 28 1 1 A 78 78 PHE CB C 78 38.295 38.765 -0.470 1
1 902 . 28 1 1 A 78 78 PHE N N 78 122.682 121.849 0.833 1
1 903 . 28 1 1 A 79 79 PHE H H 79 8.890 7.939 0.951 1
1 904 . 28 1 1 A 79 79 PHE HA H 79 3.800 3.932 -0.132 1
1 912 . 28 1 1 A 79 79 PHE C C 79 178.354 178.261 0.093 1
1 913 . 28 1 1 A 79 79 PHE CA C 79 60.704 62.010 -1.306 1
1 914 . 28 1 1 A 79 79 PHE CB C 79 37.184 38.446 -1.262 1
1 920 . 28 1 1 A 79 79 PHE N N 79 121.056 117.550 3.506 1
1 921 . 28 1 1 A 80 80 GLU H H 80 7.793 8.262 -0.469 1
1 922 . 28 1 1 A 80 80 GLU HA H 80 4.082 3.956 0.126 1
1 927 . 28 1 1 A 80 80 GLU C C 80 179.068 179.434 -0.366 1
1 928 . 28 1 1 A 80 80 GLU CA C 80 59.735 59.750 -0.015 1
1 929 . 28 1 1 A 80 80 GLU CB C 80 28.722 29.080 -0.358 1
1 931 . 28 1 1 A 80 80 GLU N N 80 120.312 118.349 1.963 1
1 932 . 28 1 1 A 81 81 ASN H H 81 8.624 8.586 0.038 1
1 933 . 28 1 1 A 81 81 ASN HA H 81 4.521 4.479 0.042 1
1 938 . 28 1 1 A 81 81 ASN C C 81 179.262 178.116 1.146 1
1 939 . 28 1 1 A 81 81 ASN CA C 81 55.504 56.318 -0.814 1
1 940 . 28 1 1 A 81 81 ASN CB C 81 37.517 37.963 -0.446 1
1 941 . 28 1 1 A 81 81 ASN N N 81 119.338 118.633 0.705 1
1 943 . 28 1 1 A 82 82 CYS H H 82 8.554 7.867 0.687 1
1 944 . 28 1 1 A 82 82 CYS HA H 82 3.792 3.906 -0.114 1
1 947 . 28 1 1 A 82 82 CYS C C 82 176.478 177.092 -0.614 1
1 948 . 28 1 1 A 82 82 CYS CA C 82 65.232 63.166 2.066 1
1 949 . 28 1 1 A 82 82 CYS CB C 82 26.762 26.642 0.120 1
1 950 . 28 1 1 A 82 82 CYS N N 82 120.576 117.669 2.907 1
1 951 . 28 1 1 A 83 83 ARG H H 83 8.522 7.953 0.569 1
1 952 . 28 1 1 A 83 83 ARG HA H 83 3.932 4.072 -0.140 1
1 960 . 28 1 1 A 83 83 ARG C C 83 179.138 178.755 0.383 1
1 961 . 28 1 1 A 83 83 ARG CA C 83 60.443 59.446 0.997 1
1 962 . 28 1 1 A 83 83 ARG CB C 83 29.550 29.595 -0.045 1
1 965 . 28 1 1 A 83 83 ARG N N 83 123.035 119.716 3.319 1
1 967 . 28 1 1 A 84 84 ASP H H 84 7.791 8.169 -0.378 1
1 968 . 28 1 1 A 84 84 ASP HA H 84 4.353 4.386 -0.033 1
1 971 . 28 1 1 A 84 84 ASP C C 84 178.649 178.679 -0.030 1
1 972 . 28 1 1 A 84 84 ASP CA C 84 57.767 57.561 0.206 1
1 973 . 28 1 1 A 84 84 ASP CB C 84 41.305 41.624 -0.319 1
1 974 . 28 1 1 A 84 84 ASP N N 84 120.332 119.094 1.238 1
1 975 . 28 1 1 A 85 85 THR H H 85 8.370 8.077 0.293 1
1 976 . 28 1 1 A 85 85 THR HA H 85 3.730 3.859 -0.129 1
1 981 . 28 1 1 A 85 85 THR C C 85 175.198 176.301 -1.103 1
1 982 . 28 1 1 A 85 85 THR CA C 85 66.830 65.841 0.989 1
1 983 . 28 1 1 A 85 85 THR CB C 85 68.533 68.463 0.070 1
1 985 . 28 1 1 A 85 85 THR N N 85 117.360 115.785 1.575 1
1 986 . 28 1 1 A 86 86 ALA H H 86 8.845 8.315 0.530 1
1 987 . 28 1 1 A 86 86 ALA HA H 86 3.991 3.925 0.066 1
1 991 . 28 1 1 A 86 86 ALA C C 86 179.980 179.767 0.213 1
1 992 . 28 1 1 A 86 86 ALA CA C 86 55.769 55.467 0.302 1
1 993 . 28 1 1 A 86 86 ALA CB C 86 17.881 18.359 -0.478 1
1 994 . 28 1 1 A 86 86 ALA N N 86 123.613 123.466 0.147 1
1 995 . 28 1 1 A 87 87 LYS H H 87 7.686 8.502 -0.816 1
1 996 . 28 1 1 A 87 87 LYS HA H 87 4.099 4.008 0.091 1
1 1005 . 28 1 1 A 87 87 LYS C C 87 179.592 179.735 -0.143 1
1 1006 . 28 1 1 A 87 87 LYS CA C 87 59.708 59.843 -0.135 1
1 1007 . 28 1 1 A 87 87 LYS CB C 87 32.054 32.230 -0.176 1
1 1011 . 28 1 1 A 87 87 LYS N N 87 119.623 117.479 2.144 1
1 1012 . 28 1 1 A 88 88 ARG H H 88 7.683 7.645 0.038 1
1 1013 . 28 1 1 A 88 88 ARG HA H 88 4.051 4.101 -0.050 1
1 1020 . 28 1 1 A 88 88 ARG C C 88 180.053 178.542 1.511 1
1 1021 . 28 1 1 A 88 88 ARG CA C 88 59.558 59.200 0.358 1
1 1022 . 28 1 1 A 88 88 ARG CB C 88 29.684 29.914 -0.230 1
1 1025 . 28 1 1 A 88 88 ARG N N 88 120.788 119.435 1.353 1
1 1026 . 28 1 1 A 89 89 ASN H H 89 8.973 7.716 1.257 1
1 1027 . 28 1 1 A 89 89 ASN HA H 89 4.354 4.629 -0.275 1
1 1032 . 28 1 1 A 89 89 ASN C C 89 178.382 178.213 0.169 1
1 1033 . 28 1 1 A 89 89 ASN CA C 89 55.334 55.336 -0.002 1
1 1034 . 28 1 1 A 89 89 ASN CB C 89 37.864 38.413 -0.549 1
1 1035 . 28 1 1 A 89 89 ASN N N 89 121.012 116.750 4.262 1
1 1037 . 28 1 1 A 90 90 GLN H H 90 8.152 8.433 -0.281 1
1 1038 . 28 1 1 A 90 90 GLN HA H 90 4.020 4.127 -0.107 1
1 1045 . 28 1 1 A 90 90 GLN C C 90 179.075 178.903 0.172 1
1 1046 . 28 1 1 A 90 90 GLN CA C 90 59.318 59.017 0.301 1
1 1047 . 28 1 1 A 90 90 GLN CB C 90 28.049 28.042 0.007 1
1 1049 . 28 1 1 A 90 90 GLN N N 90 122.122 120.280 1.842 1
1 1051 . 28 1 1 A 91 91 GLN H H 91 7.514 8.176 -0.662 1
1 1052 . 28 1 1 A 91 91 GLN HA H 91 4.053 4.045 0.008 1
1 1059 . 28 1 1 A 91 91 GLN C C 91 177.081 178.136 -1.055 1
1 1060 . 28 1 1 A 91 91 GLN CA C 91 58.031 58.959 -0.928 1
1 1061 . 28 1 1 A 91 91 GLN CB C 91 28.365 28.162 0.203 1
1 1063 . 28 1 1 A 91 91 GLN N N 91 118.124 119.544 -1.420 1
1 1065 . 28 1 1 A 92 92 ALA H H 92 7.704 7.251 0.453 1
1 1066 . 28 1 1 A 92 92 ALA HA H 92 4.246 4.343 -0.097 1
1 1070 . 28 1 1 A 92 92 ALA C C 92 178.450 177.984 0.466 1
1 1071 . 28 1 1 A 92 92 ALA CA C 92 52.671 52.218 0.453 1
1 1072 . 28 1 1 A 92 92 ALA CB C 92 19.316 19.734 -0.418 1
1 1073 . 28 1 1 A 92 92 ALA N N 92 119.880 119.055 0.825 1
1 1074 . 28 1 1 A 93 93 GLY H H 93 7.693 8.048 -0.355 1
1 1075 . 28 1 1 A 93 93 GLY HA2 H 93 3.941 3.918 0.023 1
1 1076 . 28 1 1 A 93 93 GLY HA3 H 93 3.744 3.928 -0.184 1
1 1077 . 28 1 1 A 93 93 GLY C C 93 174.344 175.338 -0.994 1
1 1078 . 28 1 1 A 93 93 GLY CA C 93 45.949 46.618 -0.669 1
1 1079 . 28 1 1 A 93 93 GLY N N 93 105.347 107.090 -1.743 1
1 1080 . 28 1 1 A 94 94 ASN H H 94 7.076 8.192 -1.116 1
1 1081 . 28 1 1 A 94 94 ASN HA H 94 4.115 4.760 -0.645 1
1 1085 . 28 1 1 A 94 94 ASN C C 94 175.410 176.235 -0.825 1
1 1086 . 28 1 1 A 94 94 ASN CA C 94 52.651 52.980 -0.329 1
1 1087 . 28 1 1 A 94 94 ASN CB C 94 38.330 39.511 -1.181 1
1 1088 . 28 1 1 A 94 94 ASN N N 94 115.747 116.589 -0.842 1
1 1090 . 28 1 1 A 95 95 GLY H H 95 8.236 8.717 -0.481 1
1 1091 . 28 1 1 A 95 95 GLY HA2 H 95 3.633 3.998 -0.365 1
1 1092 . 28 1 1 A 95 95 GLY HA3 H 95 3.633 4.032 -0.399 1
1 1093 . 28 1 1 A 95 95 GLY C C 95 174.450 173.699 0.751 1
1 1094 . 28 1 1 A 95 95 GLY CA C 95 45.522 46.718 -1.196 1
1 1095 . 28 1 1 A 95 95 GLY N N 95 109.166 108.388 0.778 1
1 1096 . 28 1 1 A 96 96 TRP H H 96 7.899 7.808 0.091 1
1 1097 . 28 1 1 A 96 96 TRP HA H 96 5.241 4.903 0.338 1
1 1106 . 28 1 1 A 96 96 TRP C C 96 175.661 175.109 0.552 1
1 1107 . 28 1 1 A 96 96 TRP CA C 96 55.090 57.191 -2.101 1
1 1108 . 28 1 1 A 96 96 TRP CB C 96 27.138 32.805 -5.667 1
1 1114 . 28 1 1 A 96 96 TRP N N 96 122.840 120.025 2.815 1
1 1116 . 28 1 1 A 97 97 ASP H H 97 7.344 8.832 -1.488 1
1 1117 . 28 1 1 A 97 97 ASP HA H 97 4.829 4.073 0.756 1
1 1120 . 28 1 1 A 97 97 ASP C C 97 175.019 176.504 -1.485 1
1 1121 . 28 1 1 A 97 97 ASP CA C 97 52.149 56.841 -4.692 1
1 1122 . 28 1 1 A 97 97 ASP CB C 97 42.697 38.632 4.065 1
1 1123 . 28 1 1 A 97 97 ASP N N 97 126.861 124.076 2.785 1
1 1124 . 28 1 1 A 98 98 PHE H H 98 8.566 8.604 -0.038 1
1 1125 . 28 1 1 A 98 98 PHE HA H 98 3.727 3.945 -0.218 1
1 1133 . 28 1 1 A 98 98 PHE C C 98 177.443 177.190 0.253 1
1 1134 . 28 1 1 A 98 98 PHE CA C 98 62.471 62.137 0.334 1
1 1135 . 28 1 1 A 98 98 PHE CB C 98 39.919 39.151 0.768 1
1 1141 . 28 1 1 A 98 98 PHE N N 98 117.781 120.749 -2.968 1
1 1142 . 28 1 1 A 99 99 ASP H H 99 8.259 8.141 0.118 1
1 1143 . 28 1 1 A 99 99 ASP HA H 99 3.960 4.234 -0.274 1
1 1146 . 28 1 1 A 99 99 ASP C C 99 178.132 178.794 -0.662 1
1 1147 . 28 1 1 A 99 99 ASP CA C 99 57.658 56.439 1.219 1
1 1148 . 28 1 1 A 99 99 ASP CB C 99 38.572 40.685 -2.113 1
1 1149 . 28 1 1 A 99 99 ASP N N 99 121.709 119.769 1.940 1
1 1150 . 28 1 1 A 100 100 MET H H 100 8.008 8.024 -0.016 1
1 1151 . 28 1 1 A 100 100 MET HA H 100 3.644 4.199 -0.555 1
1 1156 . 28 1 1 A 100 100 MET C C 100 180.008 177.538 2.470 1
1 1157 . 28 1 1 A 100 100 MET CA C 100 58.598 58.268 0.330 1
1 1158 . 28 1 1 A 100 100 MET CB C 100 33.423 33.469 -0.046 1
1 1160 . 28 1 1 A 100 100 MET N N 100 119.668 117.647 2.021 1
1 1161 . 28 1 1 A 101 101 LEU H H 101 7.961 8.450 -0.489 1
1 1162 . 28 1 1 A 101 101 LEU HA H 101 3.523 4.387 -0.864 1
1 1172 . 28 1 1 A 101 101 LEU C C 101 173.873 175.813 -1.940 1
1 1173 . 28 1 1 A 101 101 LEU CA C 101 58.743 54.487 4.256 1
1 1174 . 28 1 1 A 101 101 LEU CB C 101 42.632 41.163 1.469 1
1 1178 . 28 1 1 A 101 101 LEU N N 101 119.752 118.763 0.989 1
1 1179 . 28 1 1 A 102 102 THR H H 102 6.955 8.319 -1.364 1
1 1180 . 28 1 1 A 102 102 THR HA H 102 4.134 4.173 -0.039 1
1 1185 . 28 1 1 A 102 102 THR C C 102 176.513 175.819 0.694 1
1 1186 . 28 1 1 A 102 102 THR CA C 102 61.125 62.487 -1.362 1
1 1187 . 28 1 1 A 102 102 THR CB C 102 71.415 70.116 1.299 1
1 1189 . 28 1 1 A 102 102 THR N N 102 124.665 117.091 7.574 1
1 1190 . 28 1 1 A 103 103 GLY H H 103 7.816 8.118 -0.302 1
1 1191 . 28 1 1 A 103 103 GLY HA2 H 103 3.824 4.109 -0.285 1
1 1192 . 28 1 1 A 103 103 GLY HA3 H 103 3.824 4.208 -0.384 1
1 1193 . 28 1 1 A 103 103 GLY C C 103 174.126 175.249 -1.123 1
1 1194 . 28 1 1 A 103 103 GLY CA C 103 47.805 45.810 1.995 1
1 1195 . 28 1 1 A 103 103 GLY N N 103 114.191 111.066 3.125 1
1 1196 . 28 1 1 A 104 104 SER H H 104 8.860 8.171 0.689 1
1 1197 . 28 1 1 A 104 104 SER HA H 104 4.758 4.232 0.526 1
1 1200 . 28 1 1 A 104 104 SER C C 104 174.591 174.681 -0.090 1
1 1201 . 28 1 1 A 104 104 SER CA C 104 56.755 59.184 -2.429 1
1 1202 . 28 1 1 A 104 104 SER CB C 104 65.050 63.882 1.168 1
1 1203 . 28 1 1 A 104 104 SER N N 104 114.771 116.704 -1.933 1
1 1204 . 28 1 1 A 105 105 GLY H H 105 8.788 7.782 1.006 1
1 1205 . 28 1 1 A 105 105 GLY HA2 H 105 3.733 4.013 -0.280 1
1 1206 . 28 1 1 A 105 105 GLY HA3 H 105 3.733 4.016 -0.283 1
1 1207 . 28 1 1 A 105 105 GLY CA C 105 47.247 45.543 1.704 1
1 1208 . 28 1 1 A 105 105 GLY N N 105 110.394 108.606 1.788 1
1 1209 . 28 1 1 A 106 106 ASN HA H 106 4.454 4.544 -0.090 1
1 1212 . 28 1 1 A 106 106 ASN C C 106 175.180 176.544 -1.364 1
1 1213 . 28 1 1 A 106 106 ASN CA C 106 54.492 55.904 -1.412 1
1 1214 . 28 1 1 A 106 106 ASN CB C 106 37.282 38.821 -1.539 1
1 1215 . 28 1 1 A 107 107 TYR H H 107 8.241 7.734 0.507 1
1 1216 . 28 1 1 A 107 107 TYR HA H 107 4.335 4.698 -0.363 1
1 1223 . 28 1 1 A 107 107 TYR C C 107 173.954 176.727 -2.773 1
1 1224 . 28 1 1 A 107 107 TYR CA C 107 57.727 58.190 -0.463 1
1 1225 . 28 1 1 A 107 107 TYR CB C 107 37.063 39.752 -2.689 1
1 1230 . 28 1 1 A 107 107 TYR N N 107 120.708 115.643 5.065 1
1 1231 . 28 1 1 A 108 108 SER H H 108 7.117 7.054 0.063 1
1 1232 . 28 1 1 A 108 108 SER HA H 108 4.221 3.799 0.422 1
1 1235 . 28 1 1 A 108 108 SER C C 108 174.834 173.542 1.292 1
1 1236 . 28 1 1 A 108 108 SER CA C 108 59.859 58.888 0.971 1
1 1237 . 28 1 1 A 108 108 SER CB C 108 63.846 60.734 3.112 1
1 1238 . 28 1 1 A 108 108 SER N N 108 113.362 112.278 1.084 1
1 1239 . 28 1 1 A 109 109 SER H H 109 8.053 8.011 0.042 1
1 1240 . 28 1 1 A 109 109 SER HA H 109 4.560 4.374 0.186 1
1 1243 . 28 1 1 A 109 109 SER CA C 109 57.141 60.112 -2.971 1
1 1244 . 28 1 1 A 109 109 SER CB C 109 64.874 63.864 1.010 1
1 1245 . 28 1 1 A 109 109 SER N N 109 116.657 116.088 0.569 1
1 1246 . 28 1 1 A 110 110 THR HA H 110 3.541 3.806 -0.265 1
1 1251 . 28 1 1 A 110 110 THR C C 110 175.477 175.641 -0.164 1
1 1252 . 28 1 1 A 110 110 THR CA C 110 66.443 66.646 -0.203 1
1 1253 . 28 1 1 A 110 110 THR CB C 110 68.091 68.657 -0.566 1
1 1255 . 28 1 1 A 111 111 ASP H H 111 8.224 8.478 -0.254 1
1 1256 . 28 1 1 A 111 111 ASP HA H 111 4.237 4.325 -0.088 1
1 1259 . 28 1 1 A 111 111 ASP C C 111 177.520 178.623 -1.103 1
1 1260 . 28 1 1 A 111 111 ASP CA C 111 57.559 57.290 0.269 1
1 1261 . 28 1 1 A 111 111 ASP CB C 111 40.292 40.439 -0.147 1
1 1262 . 28 1 1 A 111 111 ASP N N 111 119.490 120.137 -0.647 1
1 1263 . 28 1 1 A 112 112 ALA H H 112 7.431 7.866 -0.435 1
1 1264 . 28 1 1 A 112 112 ALA HA H 112 4.191 4.130 0.061 1
1 1268 . 28 1 1 A 112 112 ALA C C 112 180.646 179.832 0.814 1
1 1269 . 28 1 1 A 112 112 ALA CA C 112 54.534 55.556 -1.022 1
1 1270 . 28 1 1 A 112 112 ALA CB C 112 18.992 18.224 0.768 1
1 1271 . 28 1 1 A 112 112 ALA N N 112 119.710 121.912 -2.202 1
1 1272 . 28 1 1 A 113 113 GLN H H 113 7.576 7.993 -0.417 1
1 1273 . 28 1 1 A 113 113 GLN HA H 113 3.562 4.210 -0.648 1
1 1278 . 28 1 1 A 113 113 GLN C C 113 176.756 178.794 -2.038 1
1 1279 . 28 1 1 A 113 113 GLN CA C 113 57.736 58.374 -0.638 1
1 1280 . 28 1 1 A 113 113 GLN CB C 113 29.110 27.796 1.314 1
1 1281 . 28 1 1 A 113 113 GLN N N 113 117.518 117.349 0.169 1
1 1283 . 28 1 1 A 114 114 MET H H 114 8.192 8.027 0.165 1
1 1284 . 28 1 1 A 114 114 MET HA H 114 4.231 4.382 -0.151 1
1 1289 . 28 1 1 A 114 114 MET C C 114 175.648 177.896 -2.248 1
1 1290 . 28 1 1 A 114 114 MET CA C 114 57.446 58.020 -0.574 1
1 1291 . 28 1 1 A 114 114 MET CB C 114 33.570 32.530 1.040 1
1 1293 . 28 1 1 A 114 114 MET N N 114 111.509 119.975 -8.466 1
1 1294 . 28 1 1 A 115 115 GLN H H 115 6.940 7.373 -0.433 1
1 1295 . 28 1 1 A 115 115 GLN HA H 115 4.307 4.408 -0.101 1
1 1302 . 28 1 1 A 115 115 GLN C C 115 176.270 175.056 1.214 1
1 1303 . 28 1 1 A 115 115 GLN CA C 115 54.680 55.416 -0.736 1
1 1304 . 28 1 1 A 115 115 GLN CB C 115 28.233 28.767 -0.534 1
1 1306 . 28 1 1 A 115 115 GLN N N 115 114.300 116.193 -1.893 1
1 1308 . 28 1 1 A 116 116 TYR H H 116 6.677 8.136 -1.459 1
1 1309 . 28 1 1 A 116 116 TYR HA H 116 4.193 3.936 0.257 1
1 1312 . 28 1 1 A 116 116 TYR C C 116 175.268 174.289 0.979 1
1 1313 . 28 1 1 A 116 116 TYR CA C 116 54.357 58.573 -4.216 1
1 1314 . 28 1 1 A 116 116 TYR CB C 116 35.498 36.254 -0.756 1
1 1315 . 28 1 1 A 116 116 TYR N N 116 117.919 118.873 -0.954 1
1 1316 . 28 1 1 A 117 117 ASP H H 117 8.081 8.596 -0.515 1
1 1317 . 28 1 1 A 117 117 ASP HA H 117 4.665 4.893 -0.228 1
1 1320 . 28 1 1 A 117 117 ASP CA C 117 52.422 50.505 1.917 1
1 1321 . 28 1 1 A 117 117 ASP CB C 117 42.416 41.628 0.788 1
1 1322 . 28 1 1 A 117 117 ASP N N 117 120.887 125.498 -4.611 1
1 1323 . 28 1 1 A 118 118 PRO C C 118 179.180 178.486 0.694 1
1 1324 . 28 1 1 A 118 118 PRO CA C 118 65.942 64.447 1.495 1
1 1325 . 28 1 1 A 118 118 PRO CB C 118 32.197 31.714 0.483 1
1 1326 . 28 1 1 A 119 119 GLY H H 119 9.742 8.437 1.305 1
1 1327 . 28 1 1 A 119 119 GLY C C 119 175.622 175.559 0.063 1
1 1328 . 28 1 1 A 119 119 GLY CA C 119 46.785 46.839 -0.054 1
1 1329 . 28 1 1 A 119 119 GLY N N 119 106.412 106.631 -0.219 1
1 1330 . 28 1 1 A 120 120 LEU H H 120 6.666 8.406 -1.740 1
1 1331 . 28 1 1 A 120 120 LEU HA H 120 3.365 3.501 -0.136 1
1 1341 . 28 1 1 A 120 120 LEU C C 120 179.262 178.571 0.691 1
1 1342 . 28 1 1 A 120 120 LEU CA C 120 56.605 57.075 -0.470 1
1 1343 . 28 1 1 A 120 120 LEU CB C 120 39.262 41.734 -2.472 1
1 1347 . 28 1 1 A 120 120 LEU N N 120 126.226 122.594 3.632 1
1 1348 . 28 1 1 A 121 121 PHE H H 121 7.356 8.558 -1.202 1
1 1349 . 28 1 1 A 121 121 PHE HA H 121 4.459 3.877 0.582 1
1 1352 . 28 1 1 A 121 121 PHE C C 121 179.716 177.174 2.542 1
1 1353 . 28 1 1 A 121 121 PHE CA C 121 62.838 62.072 0.766 1
1 1354 . 28 1 1 A 121 121 PHE CB C 121 37.603 39.007 -1.404 1
1 1355 . 28 1 1 A 121 121 PHE N N 121 117.437 119.238 -1.801 1
1 1356 . 28 1 1 A 122 122 ALA H H 122 7.926 7.876 0.050 1
1 1357 . 28 1 1 A 122 122 ALA HA H 122 4.523 3.841 0.682 1
1 1361 . 28 1 1 A 122 122 ALA C C 122 180.435 179.818 0.617 1
1 1362 . 28 1 1 A 122 122 ALA CA C 122 55.527 55.247 0.280 1
1 1363 . 28 1 1 A 122 122 ALA CB C 122 17.814 17.844 -0.030 1
1 1364 . 28 1 1 A 122 122 ALA N N 122 121.068 121.214 -0.146 1
1 1365 . 28 1 1 A 123 123 GLN H H 123 7.507 8.013 -0.506 1
1 1366 . 28 1 1 A 123 123 GLN HA H 123 4.153 3.770 0.383 1
1 1371 . 28 1 1 A 123 123 GLN C C 123 180.561 178.333 2.228 1
1 1372 . 28 1 1 A 123 123 GLN CA C 123 59.948 59.008 0.940 1
1 1373 . 28 1 1 A 123 123 GLN CB C 123 29.135 28.126 1.009 1
1 1375 . 28 1 1 A 123 123 GLN N N 123 120.324 117.104 3.220 1
1 1376 . 28 1 1 A 124 124 ILE H H 124 8.318 8.114 0.204 1
1 1377 . 28 1 1 A 124 124 ILE HA H 124 3.635 3.878 -0.243 1
1 1387 . 28 1 1 A 124 124 ILE C C 124 176.481 178.120 -1.639 1
1 1388 . 28 1 1 A 124 124 ILE CA C 124 66.432 64.591 1.841 1
1 1389 . 28 1 1 A 124 124 ILE CB C 124 39.168 37.779 1.389 1
1 1393 . 28 1 1 A 124 124 ILE N N 124 123.747 118.065 5.682 1
1 1394 . 28 1 1 A 125 125 GLN H H 125 8.474 8.015 0.459 1
1 1395 . 28 1 1 A 125 125 GLN HA H 125 4.264 3.935 0.329 1
1 1402 . 28 1 1 A 125 125 GLN C C 125 178.947 177.859 1.088 1
1 1403 . 28 1 1 A 125 125 GLN CA C 125 59.651 58.432 1.219 1
1 1404 . 28 1 1 A 125 125 GLN CB C 125 28.880 28.547 0.333 1
1 1406 . 28 1 1 A 125 125 GLN N N 125 120.368 121.098 -0.730 1
1 1408 . 28 1 1 A 126 126 ALA H H 126 8.002 7.945 0.057 1
1 1409 . 28 1 1 A 126 126 ALA HA H 126 4.144 4.018 0.126 1
1 1413 . 28 1 1 A 126 126 ALA C C 126 179.316 179.861 -0.545 1
1 1414 . 28 1 1 A 126 126 ALA CA C 126 55.036 54.873 0.163 1
1 1415 . 28 1 1 A 126 126 ALA CB C 126 18.087 17.873 0.214 1
1 1416 . 28 1 1 A 126 126 ALA N N 126 121.661 121.166 0.495 1
1 1417 . 28 1 1 A 127 127 ALA H H 127 7.823 8.183 -0.360 1
1 1418 . 28 1 1 A 127 127 ALA HA H 127 4.162 4.018 0.144 1
1 1422 . 28 1 1 A 127 127 ALA C C 127 180.707 179.391 1.316 1
1 1423 . 28 1 1 A 127 127 ALA CA C 127 55.080 54.808 0.272 1
1 1424 . 28 1 1 A 127 127 ALA CB C 127 19.354 18.259 1.095 1
1 1425 . 28 1 1 A 127 127 ALA N N 127 119.853 119.683 0.170 1
1 1426 . 28 1 1 A 128 128 ALA H H 128 8.936 7.654 1.282 1
1 1427 . 28 1 1 A 128 128 ALA HA H 128 3.928 3.644 0.284 1
1 1431 . 28 1 1 A 128 128 ALA C C 128 181.031 179.393 1.638 1
1 1432 . 28 1 1 A 128 128 ALA CA C 128 55.502 54.622 0.880 1
1 1433 . 28 1 1 A 128 128 ALA CB C 128 16.609 17.902 -1.293 1
1 1434 . 28 1 1 A 128 128 ALA N N 128 121.355 120.293 1.062 1
1 1435 . 28 1 1 A 129 129 THR H H 129 8.543 7.640 0.903 1
1 1436 . 28 1 1 A 129 129 THR HA H 129 4.015 3.627 0.388 1
1 1441 . 28 1 1 A 129 129 THR C C 129 177.332 176.301 1.031 1
1 1442 . 28 1 1 A 129 129 THR CA C 129 65.893 65.062 0.831 1
1 1443 . 28 1 1 A 129 129 THR CB C 129 68.566 68.553 0.013 1
1 1445 . 28 1 1 A 129 129 THR N N 129 112.709 112.186 0.523 1
1 1446 . 28 1 1 A 130 130 LYS H H 130 8.126 7.392 0.734 1
1 1447 . 28 1 1 A 130 130 LYS HA H 130 4.000 4.008 -0.008 1
1 1456 . 28 1 1 A 130 130 LYS C C 130 179.082 178.575 0.507 1
1 1457 . 28 1 1 A 130 130 LYS CA C 130 60.299 58.425 1.874 1
1 1458 . 28 1 1 A 130 130 LYS CB C 130 32.767 31.781 0.986 1
1 1462 . 28 1 1 A 130 130 LYS N N 130 123.879 120.551 3.328 1
1 1463 . 28 1 1 A 131 131 ALA H H 131 7.184 7.745 -0.561 1
1 1464 . 28 1 1 A 131 131 ALA HA H 131 4.005 4.232 -0.227 1
1 1468 . 28 1 1 A 131 131 ALA C C 131 178.482 179.545 -1.063 1
1 1469 . 28 1 1 A 131 131 ALA CA C 131 55.027 55.153 -0.126 1
1 1470 . 28 1 1 A 131 131 ALA CB C 131 18.669 19.487 -0.818 1
1 1471 . 28 1 1 A 131 131 ALA N N 131 118.590 121.227 -2.637 1
1 1472 . 28 1 1 A 132 132 TRP H H 132 7.977 8.636 -0.659 1
1 1473 . 28 1 1 A 132 132 TRP HA H 132 4.001 4.205 -0.204 1
1 1480 . 28 1 1 A 132 132 TRP C C 132 177.332 175.726 1.606 1
1 1481 . 28 1 1 A 132 132 TRP CA C 132 60.431 57.308 3.123 1
1 1482 . 28 1 1 A 132 132 TRP CB C 132 27.786 27.698 0.088 1
1 1486 . 28 1 1 A 132 132 TRP N N 132 119.168 116.978 2.190 1
1 1488 . 28 1 1 A 133 133 ARG H H 133 8.006 7.899 0.107 1
1 1489 . 28 1 1 A 133 133 ARG HA H 133 4.027 4.410 -0.383 1
1 1497 . 28 1 1 A 133 133 ARG C C 133 176.664 178.774 -2.110 1
1 1498 . 28 1 1 A 133 133 ARG CA C 133 59.355 57.288 2.067 1
1 1499 . 28 1 1 A 133 133 ARG CB C 133 30.451 31.976 -1.525 1
1 1502 . 28 1 1 A 133 133 ARG N N 133 113.062 121.061 -7.999 1
1 1504 . 28 1 1 A 134 134 LYS H H 134 7.322 7.680 -0.358 1
1 1505 . 28 1 1 A 134 134 LYS HA H 134 4.313 4.368 -0.055 1
1 1514 . 28 1 1 A 134 134 LYS C C 134 176.282 176.596 -0.314 1
1 1515 . 28 1 1 A 134 134 LYS CA C 134 54.922 57.655 -2.733 1
1 1516 . 28 1 1 A 134 134 LYS CB C 134 32.633 32.291 0.342 1
1 1520 . 28 1 1 A 134 134 LYS N N 134 118.170 118.106 0.064 1
1 1521 . 28 1 1 A 135 135 LEU H H 135 7.440 7.511 -0.071 1
1 1522 . 28 1 1 A 135 135 LEU HA H 135 4.174 4.612 -0.438 1
1 1532 . 28 1 1 A 135 135 LEU CA C 135 54.408 52.850 1.558 1
1 1533 . 28 1 1 A 135 135 LEU CB C 135 40.407 42.223 -1.816 1
1 1537 . 28 1 1 A 135 135 LEU N N 135 123.358 117.390 5.968 1
1 1538 . 28 1 1 A 136 136 PRO HA H 136 4.437 4.488 -0.051 1
1 1545 . 28 1 1 A 136 136 PRO C C 136 177.106 176.367 0.739 1
1 1546 . 28 1 1 A 136 136 PRO CA C 136 62.889 63.041 -0.152 1
1 1547 . 28 1 1 A 136 136 PRO CB C 136 32.192 32.253 -0.061 1
1 1550 . 28 1 1 A 137 137 VAL H H 137 8.219 8.373 -0.154 1
1 1551 . 28 1 1 A 137 137 VAL HA H 137 4.077 4.731 -0.654 1
1 1559 . 28 1 1 A 137 137 VAL C C 137 176.305 174.978 1.327 1
1 1560 . 28 1 1 A 137 137 VAL CA C 137 61.958 62.228 -0.270 1
1 1561 . 28 1 1 A 137 137 VAL CB C 137 32.755 32.963 -0.208 1
1 1564 . 28 1 1 A 137 137 VAL N N 137 120.079 121.742 -1.663 1
1 1565 . 28 1 1 A 138 138 LYS H H 138 8.444 8.506 -0.062 1
1 1566 . 28 1 1 A 138 138 LYS HA H 138 4.316 4.801 -0.485 1
1 1575 . 28 1 1 A 138 138 LYS C C 138 176.790 176.048 0.742 1
1 1576 . 28 1 1 A 138 138 LYS CA C 138 56.792 54.963 1.829 1
1 1577 . 28 1 1 A 138 138 LYS CB C 138 33.205 33.738 -0.533 1
1 1581 . 28 1 1 A 138 138 LYS N N 138 126.449 126.330 0.119 1
1 1582 . 28 1 1 A 139 139 GLY H H 139 8.518 8.661 -0.143 1
1 1583 . 28 1 1 A 139 139 GLY HA2 H 139 4.070 3.733 0.337 1
1 1584 . 28 1 1 A 139 139 GLY HA3 H 139 3.897 3.755 0.142 1
1 1585 . 28 1 1 A 139 139 GLY C C 139 172.874 174.233 -1.359 1
1 1586 . 28 1 1 A 139 139 GLY CA C 139 45.157 46.950 -1.793 1
1 1587 . 28 1 1 A 139 139 GLY N N 139 112.617 113.167 -0.550 1
1 6 . 29 1 1 A 2 2 VAL H H 2 8.992 8.758 0.234 1
1 7 . 29 1 1 A 2 2 VAL HA H 2 5.370 4.748 0.622 1
1 15 . 29 1 1 A 2 2 VAL C C 2 174.325 174.310 0.015 1
1 16 . 29 1 1 A 2 2 VAL CA C 2 61.267 60.392 0.875 1
1 17 . 29 1 1 A 2 2 VAL CB C 2 33.890 35.397 -1.507 1
1 20 . 29 1 1 A 2 2 VAL N N 2 126.939 119.289 7.650 1
1 21 . 29 1 1 A 3 3 THR H H 3 8.912 8.797 0.115 1
1 22 . 29 1 1 A 3 3 THR HA H 3 4.505 5.197 -0.692 1
1 27 . 29 1 1 A 3 3 THR C C 3 172.710 172.684 0.026 1
1 28 . 29 1 1 A 3 3 THR CA C 3 59.689 59.738 -0.049 1
1 29 . 29 1 1 A 3 3 THR CB C 3 72.398 72.105 0.293 1
1 31 . 29 1 1 A 3 3 THR N N 3 118.091 122.428 -4.337 1
1 32 . 29 1 1 A 4 4 GLU H H 4 8.631 8.907 -0.276 1
1 33 . 29 1 1 A 4 4 GLU HA H 4 5.788 4.969 0.819 1
1 38 . 29 1 1 A 4 4 GLU C C 4 175.758 174.267 1.491 1
1 39 . 29 1 1 A 4 4 GLU CA C 4 54.902 54.160 0.742 1
1 40 . 29 1 1 A 4 4 GLU CB C 4 35.097 33.032 2.065 1
1 42 . 29 1 1 A 4 4 GLU N N 4 120.966 123.963 -2.997 1
1 43 . 29 1 1 A 5 5 THR H H 5 9.188 8.467 0.721 1
1 44 . 29 1 1 A 5 5 THR HA H 5 4.739 4.724 0.015 1
1 49 . 29 1 1 A 5 5 THR C C 5 172.757 171.719 1.038 1
1 50 . 29 1 1 A 5 5 THR CA C 5 60.382 60.436 -0.054 1
1 51 . 29 1 1 A 5 5 THR CB C 5 71.558 70.422 1.136 1
1 53 . 29 1 1 A 5 5 THR N N 5 119.366 114.439 4.927 1
1 54 . 29 1 1 A 6 6 VAL H H 6 8.476 8.451 0.025 1
1 55 . 29 1 1 A 6 6 VAL HA H 6 5.026 5.509 -0.483 1
1 63 . 29 1 1 A 6 6 VAL C C 6 176.674 174.907 1.767 1
1 64 . 29 1 1 A 6 6 VAL CA C 6 61.008 61.061 -0.053 1
1 65 . 29 1 1 A 6 6 VAL CB C 6 33.861 34.692 -0.831 1
1 68 . 29 1 1 A 6 6 VAL N N 6 121.384 123.504 -2.120 1
1 69 . 29 1 1 A 7 7 ASP H H 7 8.848 8.599 0.249 1
1 70 . 29 1 1 A 7 7 ASP HA H 7 4.797 4.861 -0.064 1
1 73 . 29 1 1 A 7 7 ASP CA C 7 52.834 54.858 -2.024 1
1 74 . 29 1 1 A 7 7 ASP CB C 7 42.219 42.465 -0.246 1
1 75 . 29 1 1 A 7 7 ASP N N 7 127.061 127.279 -0.218 1
1 76 . 29 1 1 A 8 8 GLY C C 8 175.143 175.220 -0.077 1
1 77 . 29 1 1 A 8 8 GLY CA C 8 46.553 47.496 -0.943 1
1 78 . 29 1 1 A 9 9 GLN H H 9 8.408 7.449 0.959 1
1 79 . 29 1 1 A 9 9 GLN HA H 9 4.541 4.226 0.315 1
1 86 . 29 1 1 A 9 9 GLN C C 9 176.463 176.883 -0.420 1
1 87 . 29 1 1 A 9 9 GLN CA C 9 55.167 55.342 -0.175 1
1 88 . 29 1 1 A 9 9 GLN CB C 9 29.376 27.750 1.626 1
1 90 . 29 1 1 A 9 9 GLN N N 9 118.300 116.822 1.478 1
1 92 . 29 1 1 A 10 10 GLY H H 10 8.162 8.742 -0.580 1
1 93 . 29 1 1 A 10 10 GLY HA2 H 10 4.174 3.927 0.247 1
1 94 . 29 1 1 A 10 10 GLY HA3 H 10 3.521 3.940 -0.419 1
1 95 . 29 1 1 A 10 10 GLY C C 10 174.092 173.618 0.474 1
1 96 . 29 1 1 A 10 10 GLY CA C 10 45.558 46.501 -0.943 1
1 97 . 29 1 1 A 10 10 GLY N N 10 108.747 110.960 -2.213 1
1 98 . 29 1 1 A 11 11 GLN H H 11 8.507 7.542 0.965 1
1 99 . 29 1 1 A 11 11 GLN HA H 11 4.202 4.891 -0.689 1
1 106 . 29 1 1 A 11 11 GLN C C 11 173.992 173.928 0.064 1
1 107 . 29 1 1 A 11 11 GLN CA C 11 55.098 53.628 1.470 1
1 108 . 29 1 1 A 11 11 GLN CB C 11 29.097 31.823 -2.726 1
1 110 . 29 1 1 A 11 11 GLN N N 11 122.979 115.116 7.863 1
1 112 . 29 1 1 A 12 12 ALA H H 12 8.259 8.555 -0.296 1
1 113 . 29 1 1 A 12 12 ALA HA H 12 5.156 5.693 -0.537 1
1 117 . 29 1 1 A 12 12 ALA C C 12 177.284 176.319 0.965 1
1 118 . 29 1 1 A 12 12 ALA CA C 12 51.087 50.588 0.499 1
1 119 . 29 1 1 A 12 12 ALA CB C 12 20.500 20.686 -0.186 1
1 120 . 29 1 1 A 12 12 ALA N N 12 127.100 122.218 4.882 1
1 121 . 29 1 1 A 13 13 TRP H H 13 9.245 8.894 0.351 1
1 122 . 29 1 1 A 13 13 TRP HA H 13 4.717 5.278 -0.561 1
1 131 . 29 1 1 A 13 13 TRP C C 13 175.108 174.254 0.854 1
1 132 . 29 1 1 A 13 13 TRP CA C 13 55.966 55.517 0.449 1
1 133 . 29 1 1 A 13 13 TRP CB C 13 31.912 31.988 -0.076 1
1 139 . 29 1 1 A 13 13 TRP N N 13 123.088 119.939 3.149 1
1 141 . 29 1 1 A 14 14 ARG H H 14 8.575 8.638 -0.063 1
1 142 . 29 1 1 A 14 14 ARG HA H 14 5.335 4.284 1.051 1
1 150 . 29 1 1 A 14 14 ARG C C 14 175.191 174.279 0.912 1
1 151 . 29 1 1 A 14 14 ARG CA C 14 53.106 55.035 -1.929 1
1 152 . 29 1 1 A 14 14 ARG CB C 14 32.749 31.450 1.299 1
1 154 . 29 1 1 A 14 14 ARG N N 14 121.163 119.698 1.465 1
1 156 . 29 1 1 A 15 15 HIS H H 15 8.595 8.066 0.529 1
1 157 . 29 1 1 A 15 15 HIS HA H 15 4.790 5.114 -0.324 1
1 161 . 29 1 1 A 15 15 HIS C C 15 173.770 174.674 -0.904 1
1 162 . 29 1 1 A 15 15 HIS CA C 15 55.289 54.298 0.991 1
1 163 . 29 1 1 A 15 15 HIS CB C 15 33.208 32.697 0.511 1
1 165 . 29 1 1 A 15 15 HIS N N 15 117.643 119.308 -1.665 1
1 166 . 29 1 1 A 16 16 HIS H H 16 8.993 9.303 -0.310 1
1 167 . 29 1 1 A 16 16 HIS HA H 16 5.158 4.939 0.219 1
1 171 . 29 1 1 A 16 16 HIS C C 16 173.608 174.487 -0.879 1
1 172 . 29 1 1 A 16 16 HIS CA C 16 56.450 55.502 0.948 1
1 173 . 29 1 1 A 16 16 HIS CB C 16 34.171 30.957 3.214 1
1 175 . 29 1 1 A 16 16 HIS N N 16 123.520 119.717 3.803 1
1 176 . 29 1 1 A 17 17 ASN H H 17 7.829 8.594 -0.765 1
1 177 . 29 1 1 A 17 17 ASN HA H 17 4.713 5.343 -0.630 1
1 182 . 29 1 1 A 17 17 ASN C C 17 173.682 175.658 -1.976 1
1 183 . 29 1 1 A 17 17 ASN CA C 17 51.822 51.259 0.563 1
1 184 . 29 1 1 A 17 17 ASN CB C 17 43.176 41.801 1.375 1
1 185 . 29 1 1 A 17 17 ASN N N 17 122.213 122.696 -0.483 1
1 187 . 29 1 1 A 18 18 GLY H H 18 8.423 8.429 -0.006 1
1 188 . 29 1 1 A 18 18 GLY HA2 H 18 3.931 3.863 0.068 1
1 189 . 29 1 1 A 18 18 GLY HA3 H 18 3.707 4.088 -0.381 1
1 190 . 29 1 1 A 18 18 GLY C C 18 173.985 172.866 1.119 1
1 191 . 29 1 1 A 18 18 GLY CA C 18 43.949 44.042 -0.093 1
1 192 . 29 1 1 A 18 18 GLY N N 18 106.991 110.983 -3.992 1
1 193 . 29 1 1 A 19 19 PHE H H 19 8.338 8.726 -0.388 1
1 194 . 29 1 1 A 19 19 PHE HA H 19 4.068 5.182 -1.114 1
1 197 . 29 1 1 A 19 19 PHE C C 19 176.568 174.933 1.635 1
1 198 . 29 1 1 A 19 19 PHE CA C 19 59.338 57.592 1.746 1
1 199 . 29 1 1 A 19 19 PHE CB C 19 40.201 40.783 -0.582 1
1 200 . 29 1 1 A 19 19 PHE N N 19 116.857 119.052 -2.195 1
1 201 . 29 1 1 A 20 20 ASP H H 20 8.794 8.619 0.175 1
1 202 . 29 1 1 A 20 20 ASP HA H 20 4.485 4.863 -0.378 1
1 205 . 29 1 1 A 20 20 ASP C C 20 177.379 177.052 0.327 1
1 206 . 29 1 1 A 20 20 ASP CA C 20 54.140 54.365 -0.225 1
1 207 . 29 1 1 A 20 20 ASP CB C 20 41.915 42.763 -0.848 1
1 208 . 29 1 1 A 20 20 ASP N N 20 123.025 124.618 -1.593 1
1 209 . 29 1 1 A 21 21 PHE H H 21 8.862 9.105 -0.243 1
1 210 . 29 1 1 A 21 21 PHE HA H 21 4.087 4.155 -0.068 1
1 218 . 29 1 1 A 21 21 PHE C C 21 176.952 177.246 -0.294 1
1 219 . 29 1 1 A 21 21 PHE CA C 21 61.095 62.027 -0.932 1
1 220 . 29 1 1 A 21 21 PHE CB C 21 38.678 39.300 -0.622 1
1 226 . 29 1 1 A 21 21 PHE N N 21 127.163 127.479 -0.316 1
1 227 . 29 1 1 A 22 22 ALA H H 22 8.561 8.353 0.208 1
1 228 . 29 1 1 A 22 22 ALA HA H 22 3.878 3.933 -0.055 1
1 232 . 29 1 1 A 22 22 ALA C C 22 180.710 180.120 0.590 1
1 233 . 29 1 1 A 22 22 ALA CA C 22 55.211 55.108 0.103 1
1 234 . 29 1 1 A 22 22 ALA CB C 22 18.321 18.146 0.175 1
1 235 . 29 1 1 A 22 22 ALA N N 22 120.293 121.502 -1.209 1
1 236 . 29 1 1 A 23 23 VAL H H 23 7.241 8.128 -0.887 1
1 237 . 29 1 1 A 23 23 VAL HA H 23 3.684 3.489 0.195 1
1 245 . 29 1 1 A 23 23 VAL C C 23 177.101 177.950 -0.849 1
1 246 . 29 1 1 A 23 23 VAL CA C 23 65.237 66.821 -1.584 1
1 247 . 29 1 1 A 23 23 VAL CB C 23 31.780 31.535 0.245 1
1 250 . 29 1 1 A 23 23 VAL N N 23 118.775 118.227 0.548 1
1 251 . 29 1 1 A 24 24 ILE H H 24 6.761 7.635 -0.874 1
1 252 . 29 1 1 A 24 24 ILE HA H 24 3.196 3.545 -0.349 1
1 262 . 29 1 1 A 24 24 ILE C C 24 177.287 178.289 -1.002 1
1 263 . 29 1 1 A 24 24 ILE CA C 24 63.404 65.700 -2.296 1
1 264 . 29 1 1 A 24 24 ILE CB C 24 36.294 37.933 -1.639 1
1 268 . 29 1 1 A 24 24 ILE N N 24 119.036 119.267 -0.231 1
1 269 . 29 1 1 A 25 25 LYS H H 25 8.032 8.217 -0.185 1
1 270 . 29 1 1 A 25 25 LYS HA H 25 3.809 3.737 0.072 1
1 279 . 29 1 1 A 25 25 LYS C C 25 179.450 178.819 0.631 1
1 280 . 29 1 1 A 25 25 LYS CA C 25 59.621 59.493 0.128 1
1 281 . 29 1 1 A 25 25 LYS CB C 25 32.259 31.952 0.307 1
1 285 . 29 1 1 A 25 25 LYS N N 25 118.368 119.968 -1.600 1
1 286 . 29 1 1 A 26 26 GLU H H 26 7.845 8.265 -0.420 1
1 287 . 29 1 1 A 26 26 GLU HA H 26 4.021 4.049 -0.028 1
1 292 . 29 1 1 A 26 26 GLU C C 26 179.191 178.598 0.593 1
1 293 . 29 1 1 A 26 26 GLU CA C 26 59.530 59.092 0.438 1
1 294 . 29 1 1 A 26 26 GLU CB C 26 29.449 29.709 -0.260 1
1 296 . 29 1 1 A 26 26 GLU N N 26 120.522 119.198 1.324 1
1 297 . 29 1 1 A 27 27 LEU H H 27 8.165 8.127 0.038 1
1 298 . 29 1 1 A 27 27 LEU HA H 27 4.163 4.127 0.036 1
1 308 . 29 1 1 A 27 27 LEU C C 27 177.256 178.466 -1.210 1
1 309 . 29 1 1 A 27 27 LEU CA C 27 58.049 57.802 0.247 1
1 310 . 29 1 1 A 27 27 LEU CB C 27 41.365 41.949 -0.584 1
1 314 . 29 1 1 A 27 27 LEU N N 27 120.879 121.209 -0.330 1
1 315 . 29 1 1 A 28 28 LYS H H 28 8.902 8.423 0.479 1
1 316 . 29 1 1 A 28 28 LYS HA H 28 4.199 4.689 -0.490 1
1 317 . 29 1 1 A 28 28 LYS C C 28 179.707 179.364 0.343 1
1 318 . 29 1 1 A 28 28 LYS CA C 28 60.097 59.299 0.798 1
1 319 . 29 1 1 A 28 28 LYS CB C 28 33.420 32.053 1.367 1
1 320 . 29 1 1 A 28 28 LYS N N 28 120.050 119.397 0.653 1
1 321 . 29 1 1 A 29 29 THR H H 29 8.294 7.874 0.420 1
1 322 . 29 1 1 A 29 29 THR HA H 29 3.892 3.919 -0.027 1
1 327 . 29 1 1 A 29 29 THR C C 29 175.711 177.019 -1.308 1
1 328 . 29 1 1 A 29 29 THR CA C 29 66.846 66.640 0.206 1
1 329 . 29 1 1 A 29 29 THR CB C 29 68.794 68.685 0.109 1
1 331 . 29 1 1 A 29 29 THR N N 29 115.933 116.683 -0.750 1
1 332 . 29 1 1 A 30 30 ALA H H 30 8.244 7.996 0.248 1
1 333 . 29 1 1 A 30 30 ALA HA H 30 4.241 4.493 -0.252 1
1 337 . 29 1 1 A 30 30 ALA C C 30 179.128 179.867 -0.739 1
1 338 . 29 1 1 A 30 30 ALA CA C 30 55.714 54.731 0.983 1
1 339 . 29 1 1 A 30 30 ALA CB C 30 18.955 18.673 0.282 1
1 340 . 29 1 1 A 30 30 ALA N N 30 124.617 124.449 0.168 1
1 341 . 29 1 1 A 31 31 ALA H H 31 8.968 8.487 0.481 1
1 342 . 29 1 1 A 31 31 ALA HA H 31 3.890 4.207 -0.317 1
1 346 . 29 1 1 A 31 31 ALA C C 31 180.352 179.924 0.428 1
1 347 . 29 1 1 A 31 31 ALA CA C 31 55.454 55.055 0.399 1
1 348 . 29 1 1 A 31 31 ALA CB C 31 17.124 18.216 -1.092 1
1 349 . 29 1 1 A 31 31 ALA N N 31 119.327 120.863 -1.536 1
1 350 . 29 1 1 A 32 32 SER H H 32 7.995 7.649 0.346 1
1 351 . 29 1 1 A 32 32 SER HA H 32 4.238 4.273 -0.035 1
1 354 . 29 1 1 A 32 32 SER C C 32 175.612 176.216 -0.604 1
1 355 . 29 1 1 A 32 32 SER CA C 32 61.203 61.378 -0.175 1
1 356 . 29 1 1 A 32 32 SER CB C 32 63.406 63.144 0.262 1
1 357 . 29 1 1 A 32 32 SER N N 32 111.962 113.082 -1.120 1
1 358 . 29 1 1 A 33 33 GLN H H 33 8.333 7.568 0.765 1
1 359 . 29 1 1 A 33 33 GLN HA H 33 3.992 4.306 -0.314 1
1 366 . 29 1 1 A 33 33 GLN C C 33 177.486 177.737 -0.251 1
1 367 . 29 1 1 A 33 33 GLN CA C 33 58.277 57.909 0.368 1
1 368 . 29 1 1 A 33 33 GLN CB C 33 29.140 29.888 -0.748 1
1 370 . 29 1 1 A 33 33 GLN N N 33 119.527 119.793 -0.266 1
1 372 . 29 1 1 A 34 34 TYR H H 34 8.587 8.317 0.270 1
1 373 . 29 1 1 A 34 34 TYR HA H 34 4.792 4.398 0.394 1
1 380 . 29 1 1 A 34 34 TYR C C 34 176.499 176.680 -0.181 1
1 381 . 29 1 1 A 34 34 TYR CA C 34 57.711 60.408 -2.697 1
1 382 . 29 1 1 A 34 34 TYR CB C 34 39.561 38.973 0.588 1
1 387 . 29 1 1 A 34 34 TYR N N 34 114.610 115.625 -1.015 1
1 388 . 29 1 1 A 35 35 GLY H H 35 7.346 7.806 -0.460 1
1 389 . 29 1 1 A 35 35 GLY HA2 H 35 4.785 4.094 0.691 1
1 390 . 29 1 1 A 35 35 GLY HA3 H 35 4.007 4.095 -0.088 1
1 391 . 29 1 1 A 35 35 GLY C C 35 175.796 173.387 2.409 1
1 392 . 29 1 1 A 35 35 GLY CA C 35 44.355 44.752 -0.397 1
1 393 . 29 1 1 A 35 35 GLY N N 35 108.501 106.247 2.254 1
1 394 . 29 1 1 A 36 36 ALA H H 36 9.363 8.102 1.261 1
1 395 . 29 1 1 A 36 36 ALA HA H 36 4.217 4.624 -0.407 1
1 399 . 29 1 1 A 36 36 ALA C C 36 178.039 177.547 0.492 1
1 400 . 29 1 1 A 36 36 ALA CA C 36 56.114 51.811 4.303 1
1 401 . 29 1 1 A 36 36 ALA CB C 36 19.179 18.761 0.418 1
1 402 . 29 1 1 A 36 36 ALA N N 36 125.811 123.294 2.517 1
1 403 . 29 1 1 A 37 37 THR H H 37 8.070 8.430 -0.360 1
1 404 . 29 1 1 A 37 37 THR HA H 37 4.570 4.511 0.059 1
1 409 . 29 1 1 A 37 37 THR C C 37 173.685 174.059 -0.374 1
1 410 . 29 1 1 A 37 37 THR CA C 37 59.822 62.828 -3.006 1
1 411 . 29 1 1 A 37 37 THR CB C 37 68.267 71.723 -3.456 1
1 413 . 29 1 1 A 37 37 THR N N 37 129.410 118.277 11.133 1
1 414 . 29 1 1 A 38 38 ALA H H 38 6.853 7.523 -0.670 1
1 415 . 29 1 1 A 38 38 ALA HA H 38 4.601 4.588 0.013 1
1 419 . 29 1 1 A 38 38 ALA CA C 38 50.758 50.661 0.097 1
1 420 . 29 1 1 A 38 38 ALA CB C 38 18.325 19.522 -1.197 1
1 421 . 29 1 1 A 38 38 ALA N N 38 124.674 124.834 -0.160 1
1 422 . 29 1 1 A 40 40 TYR HA H 40 4.032 3.982 0.050 1
1 429 . 29 1 1 A 40 40 TYR C C 40 176.456 177.159 -0.703 1
1 430 . 29 1 1 A 40 40 TYR CA C 40 61.010 61.827 -0.817 1
1 431 . 29 1 1 A 40 40 TYR CB C 40 39.286 38.505 0.781 1
1 436 . 29 1 1 A 41 41 THR H H 41 6.874 8.206 -1.332 1
1 437 . 29 1 1 A 41 41 THR HA H 41 3.616 3.861 -0.245 1
1 442 . 29 1 1 A 41 41 THR C C 41 176.930 176.613 0.317 1
1 443 . 29 1 1 A 41 41 THR CA C 41 65.557 65.618 -0.061 1
1 444 . 29 1 1 A 41 41 THR CB C 41 68.228 69.310 -1.082 1
1 446 . 29 1 1 A 41 41 THR N N 41 115.143 113.831 1.312 1
1 447 . 29 1 1 A 42 42 LEU H H 42 8.623 7.322 1.301 1
1 448 . 29 1 1 A 42 42 LEU HA H 42 3.708 4.124 -0.416 1
1 458 . 29 1 1 A 42 42 LEU C C 42 178.206 179.095 -0.889 1
1 459 . 29 1 1 A 42 42 LEU CA C 42 57.417 57.476 -0.059 1
1 460 . 29 1 1 A 42 42 LEU CB C 42 41.342 41.324 0.018 1
1 464 . 29 1 1 A 42 42 LEU N N 42 120.418 118.718 1.700 1
1 465 . 29 1 1 A 43 43 ALA H H 43 7.735 8.059 -0.324 1
1 466 . 29 1 1 A 43 43 ALA HA H 43 4.020 3.977 0.043 1
1 470 . 29 1 1 A 43 43 ALA C C 43 180.826 180.372 0.454 1
1 471 . 29 1 1 A 43 43 ALA CA C 43 54.925 54.957 -0.032 1
1 472 . 29 1 1 A 43 43 ALA CB C 43 17.506 18.231 -0.725 1
1 473 . 29 1 1 A 43 43 ALA N N 43 120.203 121.829 -1.626 1
1 474 . 29 1 1 A 44 44 ILE H H 44 7.149 7.365 -0.216 1
1 475 . 29 1 1 A 44 44 ILE HA H 44 3.603 3.605 -0.002 1
1 485 . 29 1 1 A 44 44 ILE C C 44 178.594 178.336 0.258 1
1 486 . 29 1 1 A 44 44 ILE CA C 44 64.782 64.357 0.425 1
1 487 . 29 1 1 A 44 44 ILE CB C 44 37.472 37.333 0.139 1
1 491 . 29 1 1 A 44 44 ILE N N 44 118.881 119.520 -0.639 1
1 492 . 29 1 1 A 45 45 VAL H H 45 7.968 7.690 0.278 1
1 493 . 29 1 1 A 45 45 VAL HA H 45 2.925 3.352 -0.427 1
1 501 . 29 1 1 A 45 45 VAL C C 45 177.023 176.884 0.139 1
1 502 . 29 1 1 A 45 45 VAL CA C 45 67.081 67.034 0.047 1
1 503 . 29 1 1 A 45 45 VAL CB C 45 30.854 30.972 -0.118 1
1 506 . 29 1 1 A 45 45 VAL N N 45 120.764 119.879 0.885 1
1 507 . 29 1 1 A 46 46 GLU H H 46 8.399 8.551 -0.152 1
1 508 . 29 1 1 A 46 46 GLU HA H 46 3.848 3.844 0.004 1
1 513 . 29 1 1 A 46 46 GLU C C 46 178.656 178.984 -0.328 1
1 514 . 29 1 1 A 46 46 GLU CA C 46 59.491 59.408 0.083 1
1 515 . 29 1 1 A 46 46 GLU CB C 46 28.991 29.214 -0.223 1
1 517 . 29 1 1 A 46 46 GLU N N 46 116.599 119.830 -3.231 1
1 518 . 29 1 1 A 47 47 SER H H 47 7.273 7.823 -0.550 1
1 519 . 29 1 1 A 47 47 SER HA H 47 4.287 4.143 0.144 1
1 521 . 29 1 1 A 47 47 SER CA C 47 61.047 62.579 -1.532 1
1 522 . 29 1 1 A 47 47 SER CB C 47 63.016 63.047 -0.031 1
1 523 . 29 1 1 A 47 47 SER N N 47 113.609 117.123 -3.514 1
1 524 . 29 1 1 A 48 48 VAL H H 48 8.006 8.139 -0.133 1
1 525 . 29 1 1 A 48 48 VAL HA H 48 3.556 3.519 0.037 1
1 533 . 29 1 1 A 48 48 VAL C C 48 177.257 177.898 -0.641 1
1 534 . 29 1 1 A 48 48 VAL CA C 48 65.025 66.445 -1.420 1
1 535 . 29 1 1 A 48 48 VAL CB C 48 31.841 31.375 0.466 1
1 538 . 29 1 1 A 48 48 VAL N N 48 122.327 121.618 0.709 1
1 539 . 29 1 1 A 49 49 ALA H H 49 8.369 7.889 0.480 1
1 540 . 29 1 1 A 49 49 ALA HA H 49 4.115 4.203 -0.088 1
1 544 . 29 1 1 A 49 49 ALA C C 49 177.307 178.187 -0.880 1
1 545 . 29 1 1 A 49 49 ALA CA C 49 53.253 53.539 -0.286 1
1 546 . 29 1 1 A 49 49 ALA CB C 49 20.131 18.187 1.944 1
1 547 . 29 1 1 A 49 49 ALA N N 49 118.050 121.032 -2.982 1
1 548 . 29 1 1 A 50 50 ASP H H 50 7.052 7.832 -0.780 1
1 549 . 29 1 1 A 50 50 ASP HA H 50 4.788 4.465 0.323 1
1 552 . 29 1 1 A 50 50 ASP C C 50 175.481 175.905 -0.424 1
1 553 . 29 1 1 A 50 50 ASP CA C 50 53.681 54.794 -1.113 1
1 554 . 29 1 1 A 50 50 ASP CB C 50 39.333 40.993 -1.660 1
1 555 . 29 1 1 A 50 50 ASP N N 50 116.997 117.418 -0.421 1
1 556 . 29 1 1 A 51 51 ASN H H 51 8.535 7.587 0.948 1
1 557 . 29 1 1 A 51 51 ASN HA H 51 4.628 4.603 0.025 1
1 562 . 29 1 1 A 51 51 ASN C C 51 174.077 175.130 -1.053 1
1 563 . 29 1 1 A 51 51 ASN CA C 51 52.315 51.587 0.728 1
1 564 . 29 1 1 A 51 51 ASN CB C 51 41.928 39.933 1.995 1
1 565 . 29 1 1 A 51 51 ASN N N 51 118.626 117.330 1.296 1
1 567 . 29 1 1 A 52 52 TRP H H 52 8.555 8.141 0.414 1
1 574 . 29 1 1 A 52 52 TRP C C 52 173.269 175.870 -2.601 1
1 575 . 29 1 1 A 52 52 TRP CA C 52 55.031 58.031 -3.000 1
1 576 . 29 1 1 A 52 52 TRP CB C 52 26.801 29.858 -3.057 1
1 582 . 29 1 1 A 52 52 TRP N N 52 120.693 121.276 -0.583 1
1 584 . 29 1 1 A 53 53 LEU H H 53 7.847 8.570 -0.723 1
1 585 . 29 1 1 A 53 53 LEU HA H 53 4.859 4.772 0.087 1
1 595 . 29 1 1 A 53 53 LEU C C 53 177.397 175.118 2.279 1
1 596 . 29 1 1 A 53 53 LEU CA C 53 53.619 54.408 -0.789 1
1 597 . 29 1 1 A 53 53 LEU CB C 53 41.812 45.637 -3.825 1
1 601 . 29 1 1 A 53 53 LEU N N 53 124.741 124.877 -0.136 1
1 602 . 29 1 1 A 54 54 THR H H 54 8.850 8.480 0.370 1
1 603 . 29 1 1 A 54 54 THR HA H 54 4.598 4.715 -0.117 1
1 608 . 29 1 1 A 54 54 THR CA C 54 60.531 59.771 0.760 1
1 609 . 29 1 1 A 54 54 THR CB C 54 67.183 68.932 -1.749 1
1 611 . 29 1 1 A 54 54 THR N N 54 113.407 115.626 -2.219 1
1 612 . 29 1 1 A 55 55 PRO HA H 55 4.511 4.414 0.097 1
1 619 . 29 1 1 A 55 55 PRO C C 55 179.383 178.822 0.561 1
1 620 . 29 1 1 A 55 55 PRO CA C 55 67.159 64.945 2.214 1
1 621 . 29 1 1 A 55 55 PRO CB C 55 32.095 31.728 0.367 1
1 622 . 29 1 1 A 56 56 THR H H 56 8.575 7.790 0.785 1
1 623 . 29 1 1 A 56 56 THR HA H 56 4.229 4.100 0.129 1
1 628 . 29 1 1 A 56 56 THR C C 56 176.668 176.194 0.474 1
1 629 . 29 1 1 A 56 56 THR CA C 56 66.943 65.786 1.157 1
1 630 . 29 1 1 A 56 56 THR CB C 56 68.129 68.367 -0.238 1
1 632 . 29 1 1 A 56 56 THR N N 56 114.855 112.273 2.582 1
1 633 . 29 1 1 A 57 57 ASP H H 57 8.730 8.462 0.268 1
1 634 . 29 1 1 A 57 57 ASP HA H 57 4.425 4.652 -0.227 1
1 637 . 29 1 1 A 57 57 ASP C C 57 178.351 179.392 -1.041 1
1 638 . 29 1 1 A 57 57 ASP CA C 57 57.963 57.659 0.304 1
1 639 . 29 1 1 A 57 57 ASP CB C 57 40.134 40.625 -0.491 1
1 640 . 29 1 1 A 57 57 ASP N N 57 126.239 119.917 6.322 1
1 641 . 29 1 1 A 58 58 TRP H H 58 8.244 8.539 -0.295 1
1 642 . 29 1 1 A 58 58 TRP HA H 58 4.030 4.565 -0.535 1
1 650 . 29 1 1 A 58 58 TRP C C 58 177.432 178.866 -1.434 1
1 651 . 29 1 1 A 58 58 TRP CA C 58 62.731 60.404 2.327 1
1 652 . 29 1 1 A 58 58 TRP CB C 58 29.122 29.406 -0.284 1
1 657 . 29 1 1 A 58 58 TRP N N 58 119.241 120.805 -1.564 1
1 659 . 29 1 1 A 59 59 ASN H H 59 8.098 8.724 -0.626 1
1 660 . 29 1 1 A 59 59 ASN HA H 59 4.424 4.524 -0.100 1
1 663 . 29 1 1 A 59 59 ASN C C 59 176.952 178.304 -1.352 1
1 664 . 29 1 1 A 59 59 ASN CA C 59 58.135 56.486 1.649 1
1 665 . 29 1 1 A 59 59 ASN CB C 59 40.168 39.238 0.930 1
1 666 . 29 1 1 A 59 59 ASN N N 59 115.747 117.700 -1.953 1
1 667 . 29 1 1 A 60 60 THR H H 60 8.712 8.026 0.686 1
1 668 . 29 1 1 A 60 60 THR HA H 60 3.717 4.004 -0.287 1
1 673 . 29 1 1 A 60 60 THR C C 60 176.044 176.847 -0.803 1
1 674 . 29 1 1 A 60 60 THR CA C 60 66.576 67.393 -0.817 1
1 675 . 29 1 1 A 60 60 THR CB C 60 69.251 67.778 1.473 1
1 677 . 29 1 1 A 60 60 THR N N 60 114.896 116.458 -1.562 1
1 678 . 29 1 1 A 61 61 LEU H H 61 8.485 8.388 0.097 1
1 679 . 29 1 1 A 61 61 LEU HA H 61 3.391 4.127 -0.736 1
1 689 . 29 1 1 A 61 61 LEU C C 61 177.433 178.727 -1.294 1
1 690 . 29 1 1 A 61 61 LEU CA C 61 58.354 58.804 -0.450 1
1 691 . 29 1 1 A 61 61 LEU CB C 61 41.761 42.405 -0.644 1
1 695 . 29 1 1 A 61 61 LEU N N 61 123.433 121.939 1.494 1
1 696 . 29 1 1 A 62 62 VAL H H 62 8.073 8.509 -0.436 1
1 697 . 29 1 1 A 62 62 VAL HA H 62 3.207 3.822 -0.615 1
1 705 . 29 1 1 A 62 62 VAL C C 62 177.585 177.508 0.077 1
1 706 . 29 1 1 A 62 62 VAL CA C 62 67.345 65.398 1.947 1
1 707 . 29 1 1 A 62 62 VAL CB C 62 30.905 30.733 0.172 1
1 710 . 29 1 1 A 62 62 VAL N N 62 116.018 118.532 -2.514 1
1 711 . 29 1 1 A 63 63 ARG H H 63 7.765 8.104 -0.339 1
1 712 . 29 1 1 A 63 63 ARG HA H 63 3.602 4.045 -0.443 1
1 719 . 29 1 1 A 63 63 ARG C C 63 177.818 178.081 -0.263 1
1 720 . 29 1 1 A 63 63 ARG CA C 63 58.049 57.973 0.076 1
1 721 . 29 1 1 A 63 63 ARG CB C 63 29.955 29.169 0.786 1
1 724 . 29 1 1 A 63 63 ARG N N 63 116.700 120.636 -3.936 1
1 725 . 29 1 1 A 64 64 ALA H H 64 7.574 7.466 0.108 1
1 726 . 29 1 1 A 64 64 ALA HA H 64 4.158 4.404 -0.246 1
1 730 . 29 1 1 A 64 64 ALA C C 64 179.886 179.313 0.573 1
1 731 . 29 1 1 A 64 64 ALA CA C 64 54.007 53.750 0.257 1
1 732 . 29 1 1 A 64 64 ALA CB C 64 19.147 19.948 -0.801 1
1 733 . 29 1 1 A 64 64 ALA N N 64 117.555 121.995 -4.440 1
1 734 . 29 1 1 A 65 65 VAL H H 65 7.554 8.030 -0.476 1
1 735 . 29 1 1 A 65 65 VAL HA H 65 4.253 3.873 0.380 1
1 743 . 29 1 1 A 65 65 VAL C C 65 174.180 175.611 -1.431 1
1 744 . 29 1 1 A 65 65 VAL CA C 65 62.683 65.464 -2.781 1
1 745 . 29 1 1 A 65 65 VAL CB C 65 33.458 31.268 2.190 1
1 748 . 29 1 1 A 65 65 VAL N N 65 110.013 115.489 -5.476 1
1 749 . 29 1 1 A 66 66 LEU H H 66 7.792 7.427 0.365 1
1 750 . 29 1 1 A 66 66 LEU HA H 66 4.790 4.752 0.038 1
1 760 . 29 1 1 A 66 66 LEU C C 66 177.537 174.890 2.647 1
1 761 . 29 1 1 A 66 66 LEU CA C 66 52.823 53.570 -0.747 1
1 762 . 29 1 1 A 66 66 LEU CB C 66 44.071 45.733 -1.662 1
1 766 . 29 1 1 A 66 66 LEU N N 66 118.967 122.057 -3.090 1
1 767 . 29 1 1 A 67 67 SER H H 67 9.208 8.585 0.623 1
1 768 . 29 1 1 A 67 67 SER HA H 67 4.414 4.941 -0.527 1
1 771 . 29 1 1 A 67 67 SER CA C 67 57.943 57.272 0.671 1
1 772 . 29 1 1 A 67 67 SER CB C 67 64.743 66.591 -1.848 1
1 773 . 29 1 1 A 67 67 SER N N 67 116.378 119.804 -3.426 1
1 774 . 29 1 1 A 69 69 GLY HA2 H 69 3.916 3.781 0.135 1
1 775 . 29 1 1 A 69 69 GLY HA3 H 69 3.867 3.799 0.068 1
1 776 . 29 1 1 A 69 69 GLY C C 69 176.783 175.543 1.240 1
1 777 . 29 1 1 A 69 69 GLY CA C 69 46.977 46.586 0.391 1
1 778 . 29 1 1 A 70 70 ASP H H 70 7.674 8.150 -0.476 1
1 779 . 29 1 1 A 70 70 ASP HA H 70 4.511 3.646 0.865 1
1 782 . 29 1 1 A 70 70 ASP C C 70 178.096 178.172 -0.076 1
1 783 . 29 1 1 A 70 70 ASP CA C 70 57.262 56.588 0.674 1
1 784 . 29 1 1 A 70 70 ASP CB C 70 40.594 39.709 0.885 1
1 785 . 29 1 1 A 70 70 ASP N N 70 123.930 121.697 2.233 1
1 786 . 29 1 1 A 71 71 HIS H H 71 8.729 7.944 0.785 1
1 787 . 29 1 1 A 71 71 HIS HA H 71 4.235 4.140 0.095 1
1 790 . 29 1 1 A 71 71 HIS C C 71 176.769 176.638 0.131 1
1 791 . 29 1 1 A 71 71 HIS CA C 71 60.041 59.849 0.192 1
1 792 . 29 1 1 A 71 71 HIS CB C 71 30.682 30.108 0.574 1
1 793 . 29 1 1 A 71 71 HIS N N 71 121.003 119.379 1.624 1
1 794 . 29 1 1 A 72 72 LEU H H 72 7.620 7.924 -0.304 1
1 795 . 29 1 1 A 72 72 LEU HA H 72 3.769 3.802 -0.033 1
1 805 . 29 1 1 A 72 72 LEU C C 72 180.275 179.223 1.052 1
1 806 . 29 1 1 A 72 72 LEU CA C 72 58.192 57.967 0.225 1
1 807 . 29 1 1 A 72 72 LEU CB C 72 41.381 41.236 0.145 1
1 811 . 29 1 1 A 72 72 LEU N N 72 118.569 118.274 0.295 1
1 812 . 29 1 1 A 73 73 LEU H H 73 7.542 7.761 -0.219 1
1 813 . 29 1 1 A 73 73 LEU HA H 73 4.107 4.032 0.075 1
1 823 . 29 1 1 A 73 73 LEU C C 73 179.436 179.092 0.344 1
1 824 . 29 1 1 A 73 73 LEU CA C 73 58.026 57.609 0.417 1
1 825 . 29 1 1 A 73 73 LEU CB C 73 41.638 41.797 -0.159 1
1 829 . 29 1 1 A 73 73 LEU N N 73 121.418 121.313 0.105 1
1 830 . 29 1 1 A 74 74 TRP H H 74 8.786 8.096 0.690 1
1 831 . 29 1 1 A 74 74 TRP HA H 74 3.589 5.394 -1.805 1
1 840 . 29 1 1 A 74 74 TRP C C 74 176.816 178.792 -1.976 1
1 841 . 29 1 1 A 74 74 TRP CA C 74 63.046 59.861 3.185 1
1 842 . 29 1 1 A 74 74 TRP CB C 74 28.065 29.138 -1.073 1
1 848 . 29 1 1 A 74 74 TRP N N 74 121.111 118.118 2.993 1
1 850 . 29 1 1 A 75 75 LYS H H 75 8.939 7.574 1.365 1
1 851 . 29 1 1 A 75 75 LYS HA H 75 3.055 4.131 -1.076 1
1 860 . 29 1 1 A 75 75 LYS C C 75 177.967 179.457 -1.490 1
1 861 . 29 1 1 A 75 75 LYS CA C 75 60.029 58.801 1.228 1
1 862 . 29 1 1 A 75 75 LYS CB C 75 32.533 32.315 0.218 1
1 866 . 29 1 1 A 75 75 LYS N N 75 119.783 118.600 1.183 1
1 867 . 29 1 1 A 76 76 SER H H 76 7.832 7.921 -0.089 1
1 868 . 29 1 1 A 76 76 SER HA H 76 4.040 4.257 -0.217 1
1 871 . 29 1 1 A 76 76 SER C C 76 177.816 177.017 0.799 1
1 872 . 29 1 1 A 76 76 SER CA C 76 62.105 61.077 1.028 1
1 873 . 29 1 1 A 76 76 SER CB C 76 62.679 62.397 0.282 1
1 874 . 29 1 1 A 76 76 SER N N 76 113.395 114.793 -1.398 1
1 875 . 29 1 1 A 77 77 GLU H H 77 7.590 7.705 -0.115 1
1 876 . 29 1 1 A 77 77 GLU HA H 77 4.042 4.288 -0.246 1
1 881 . 29 1 1 A 77 77 GLU C C 77 177.809 178.389 -0.580 1
1 882 . 29 1 1 A 77 77 GLU CA C 77 58.270 58.039 0.231 1
1 883 . 29 1 1 A 77 77 GLU CB C 77 29.208 29.618 -0.410 1
1 885 . 29 1 1 A 77 77 GLU N N 77 121.574 121.620 -0.046 1
1 886 . 29 1 1 A 78 78 PHE H H 78 9.081 7.803 1.278 1
1 887 . 29 1 1 A 78 78 PHE HA H 78 3.778 4.158 -0.380 1
1 895 . 29 1 1 A 78 78 PHE C C 78 178.114 177.223 0.891 1
1 896 . 29 1 1 A 78 78 PHE CA C 78 60.629 61.230 -0.601 1
1 897 . 29 1 1 A 78 78 PHE CB C 78 38.295 38.727 -0.432 1
1 902 . 29 1 1 A 78 78 PHE N N 78 122.682 122.482 0.200 1
1 903 . 29 1 1 A 79 79 PHE H H 79 8.890 7.977 0.913 1
1 904 . 29 1 1 A 79 79 PHE HA H 79 3.800 4.074 -0.274 1
1 912 . 29 1 1 A 79 79 PHE C C 79 178.354 178.210 0.144 1
1 913 . 29 1 1 A 79 79 PHE CA C 79 60.704 61.984 -1.280 1
1 914 . 29 1 1 A 79 79 PHE CB C 79 37.184 38.657 -1.473 1
1 920 . 29 1 1 A 79 79 PHE N N 79 121.056 117.794 3.262 1
1 921 . 29 1 1 A 80 80 GLU H H 80 7.793 8.092 -0.299 1
1 922 . 29 1 1 A 80 80 GLU HA H 80 4.082 3.972 0.110 1
1 927 . 29 1 1 A 80 80 GLU C C 80 179.068 179.456 -0.388 1
1 928 . 29 1 1 A 80 80 GLU CA C 80 59.735 59.630 0.105 1
1 929 . 29 1 1 A 80 80 GLU CB C 80 28.722 29.245 -0.523 1
1 931 . 29 1 1 A 80 80 GLU N N 80 120.312 119.509 0.803 1
1 932 . 29 1 1 A 81 81 ASN H H 81 8.624 8.528 0.096 1
1 933 . 29 1 1 A 81 81 ASN HA H 81 4.521 4.477 0.044 1
1 938 . 29 1 1 A 81 81 ASN C C 81 179.262 178.142 1.120 1
1 939 . 29 1 1 A 81 81 ASN CA C 81 55.504 56.417 -0.913 1
1 940 . 29 1 1 A 81 81 ASN CB C 81 37.517 37.715 -0.198 1
1 941 . 29 1 1 A 81 81 ASN N N 81 119.338 118.387 0.951 1
1 943 . 29 1 1 A 82 82 CYS H H 82 8.554 7.782 0.772 1
1 944 . 29 1 1 A 82 82 CYS HA H 82 3.792 3.884 -0.092 1
1 947 . 29 1 1 A 82 82 CYS C C 82 176.478 176.998 -0.520 1
1 948 . 29 1 1 A 82 82 CYS CA C 82 65.232 63.173 2.059 1
1 949 . 29 1 1 A 82 82 CYS CB C 82 26.762 26.604 0.158 1
1 950 . 29 1 1 A 82 82 CYS N N 82 120.576 118.067 2.509 1
1 951 . 29 1 1 A 83 83 ARG H H 83 8.522 8.045 0.477 1
1 952 . 29 1 1 A 83 83 ARG HA H 83 3.932 4.102 -0.170 1
1 960 . 29 1 1 A 83 83 ARG C C 83 179.138 178.633 0.505 1
1 961 . 29 1 1 A 83 83 ARG CA C 83 60.443 58.973 1.470 1
1 962 . 29 1 1 A 83 83 ARG CB C 83 29.550 29.872 -0.322 1
1 965 . 29 1 1 A 83 83 ARG N N 83 123.035 119.605 3.430 1
1 967 . 29 1 1 A 84 84 ASP H H 84 7.791 8.177 -0.386 1
1 968 . 29 1 1 A 84 84 ASP HA H 84 4.353 4.445 -0.092 1
1 971 . 29 1 1 A 84 84 ASP C C 84 178.649 178.471 0.178 1
1 972 . 29 1 1 A 84 84 ASP CA C 84 57.767 57.490 0.277 1
1 973 . 29 1 1 A 84 84 ASP CB C 84 41.305 41.341 -0.036 1
1 974 . 29 1 1 A 84 84 ASP N N 84 120.332 119.488 0.844 1
1 975 . 29 1 1 A 85 85 THR H H 85 8.370 8.192 0.178 1
1 976 . 29 1 1 A 85 85 THR HA H 85 3.730 3.936 -0.206 1
1 981 . 29 1 1 A 85 85 THR C C 85 175.198 176.350 -1.152 1
1 982 . 29 1 1 A 85 85 THR CA C 85 66.830 66.050 0.780 1
1 983 . 29 1 1 A 85 85 THR CB C 85 68.533 68.442 0.091 1
1 985 . 29 1 1 A 85 85 THR N N 85 117.360 115.573 1.787 1
1 986 . 29 1 1 A 86 86 ALA H H 86 8.845 8.329 0.516 1
1 987 . 29 1 1 A 86 86 ALA HA H 86 3.991 4.117 -0.126 1
1 991 . 29 1 1 A 86 86 ALA C C 86 179.980 179.558 0.422 1
1 992 . 29 1 1 A 86 86 ALA CA C 86 55.769 55.628 0.141 1
1 993 . 29 1 1 A 86 86 ALA CB C 86 17.881 18.431 -0.550 1
1 994 . 29 1 1 A 86 86 ALA N N 86 123.613 123.230 0.383 1
1 995 . 29 1 1 A 87 87 LYS H H 87 7.686 8.522 -0.836 1
1 996 . 29 1 1 A 87 87 LYS HA H 87 4.099 4.048 0.051 1
1 1005 . 29 1 1 A 87 87 LYS C C 87 179.592 178.717 0.875 1
1 1006 . 29 1 1 A 87 87 LYS CA C 87 59.708 59.379 0.329 1
1 1007 . 29 1 1 A 87 87 LYS CB C 87 32.054 32.188 -0.134 1
1 1011 . 29 1 1 A 87 87 LYS N N 87 119.623 117.174 2.449 1
1 1012 . 29 1 1 A 88 88 ARG H H 88 7.683 8.121 -0.438 1
1 1013 . 29 1 1 A 88 88 ARG HA H 88 4.051 4.122 -0.071 1
1 1020 . 29 1 1 A 88 88 ARG C C 88 180.053 178.922 1.131 1
1 1021 . 29 1 1 A 88 88 ARG CA C 88 59.558 59.346 0.212 1
1 1022 . 29 1 1 A 88 88 ARG CB C 88 29.684 29.821 -0.137 1
1 1025 . 29 1 1 A 88 88 ARG N N 88 120.788 119.223 1.565 1
1 1026 . 29 1 1 A 89 89 ASN H H 89 8.973 8.140 0.833 1
1 1027 . 29 1 1 A 89 89 ASN HA H 89 4.354 4.645 -0.291 1
1 1032 . 29 1 1 A 89 89 ASN C C 89 178.382 178.410 -0.028 1
1 1033 . 29 1 1 A 89 89 ASN CA C 89 55.334 55.754 -0.420 1
1 1034 . 29 1 1 A 89 89 ASN CB C 89 37.864 38.418 -0.554 1
1 1035 . 29 1 1 A 89 89 ASN N N 89 121.012 117.464 3.548 1
1 1037 . 29 1 1 A 90 90 GLN H H 90 8.152 8.187 -0.035 1
1 1038 . 29 1 1 A 90 90 GLN HA H 90 4.020 4.089 -0.069 1
1 1045 . 29 1 1 A 90 90 GLN C C 90 179.075 178.852 0.223 1
1 1046 . 29 1 1 A 90 90 GLN CA C 90 59.318 58.790 0.528 1
1 1047 . 29 1 1 A 90 90 GLN CB C 90 28.049 28.168 -0.119 1
1 1049 . 29 1 1 A 90 90 GLN N N 90 122.122 120.980 1.142 1
1 1051 . 29 1 1 A 91 91 GLN H H 91 7.514 8.612 -1.098 1
1 1052 . 29 1 1 A 91 91 GLN HA H 91 4.053 4.188 -0.135 1
1 1059 . 29 1 1 A 91 91 GLN C C 91 177.081 176.655 0.426 1
1 1060 . 29 1 1 A 91 91 GLN CA C 91 58.031 57.507 0.524 1
1 1061 . 29 1 1 A 91 91 GLN CB C 91 28.365 27.225 1.140 1
1 1063 . 29 1 1 A 91 91 GLN N N 91 118.124 117.969 0.155 1
1 1065 . 29 1 1 A 92 92 ALA H H 92 7.704 7.766 -0.062 1
1 1066 . 29 1 1 A 92 92 ALA HA H 92 4.246 4.445 -0.199 1
1 1070 . 29 1 1 A 92 92 ALA C C 92 178.450 177.860 0.590 1
1 1071 . 29 1 1 A 92 92 ALA CA C 92 52.671 51.817 0.854 1
1 1072 . 29 1 1 A 92 92 ALA CB C 92 19.316 19.195 0.121 1
1 1073 . 29 1 1 A 92 92 ALA N N 92 119.880 121.760 -1.880 1
1 1074 . 29 1 1 A 93 93 GLY H H 93 7.693 8.130 -0.437 1
1 1075 . 29 1 1 A 93 93 GLY HA2 H 93 3.941 3.937 0.004 1
1 1076 . 29 1 1 A 93 93 GLY HA3 H 93 3.744 3.939 -0.195 1
1 1077 . 29 1 1 A 93 93 GLY C C 93 174.344 174.900 -0.556 1
1 1078 . 29 1 1 A 93 93 GLY CA C 93 45.949 46.903 -0.954 1
1 1079 . 29 1 1 A 93 93 GLY N N 93 105.347 107.329 -1.982 1
1 1080 . 29 1 1 A 94 94 ASN H H 94 7.076 8.497 -1.421 1
1 1081 . 29 1 1 A 94 94 ASN HA H 94 4.115 4.681 -0.566 1
1 1085 . 29 1 1 A 94 94 ASN C C 94 175.410 176.413 -1.003 1
1 1086 . 29 1 1 A 94 94 ASN CA C 94 52.651 55.088 -2.437 1
1 1087 . 29 1 1 A 94 94 ASN CB C 94 38.330 39.146 -0.816 1
1 1088 . 29 1 1 A 94 94 ASN N N 94 115.747 117.723 -1.976 1
1 1090 . 29 1 1 A 95 95 GLY H H 95 8.236 8.761 -0.525 1
1 1091 . 29 1 1 A 95 95 GLY HA2 H 95 3.633 3.998 -0.365 1
1 1092 . 29 1 1 A 95 95 GLY HA3 H 95 3.633 4.007 -0.374 1
1 1093 . 29 1 1 A 95 95 GLY C C 95 174.450 173.706 0.744 1
1 1094 . 29 1 1 A 95 95 GLY CA C 95 45.522 46.761 -1.239 1
1 1095 . 29 1 1 A 95 95 GLY N N 95 109.166 106.890 2.276 1
1 1096 . 29 1 1 A 96 96 TRP H H 96 7.899 7.763 0.136 1
1 1097 . 29 1 1 A 96 96 TRP HA H 96 5.241 4.906 0.335 1
1 1106 . 29 1 1 A 96 96 TRP C C 96 175.661 175.165 0.496 1
1 1107 . 29 1 1 A 96 96 TRP CA C 96 55.090 57.334 -2.244 1
1 1108 . 29 1 1 A 96 96 TRP CB C 96 27.138 33.029 -5.891 1
1 1114 . 29 1 1 A 96 96 TRP N N 96 122.840 120.151 2.689 1
1 1116 . 29 1 1 A 97 97 ASP H H 97 7.344 8.449 -1.105 1
1 1117 . 29 1 1 A 97 97 ASP HA H 97 4.829 4.105 0.724 1
1 1120 . 29 1 1 A 97 97 ASP C C 97 175.019 176.736 -1.717 1
1 1121 . 29 1 1 A 97 97 ASP CA C 97 52.149 56.714 -4.565 1
1 1122 . 29 1 1 A 97 97 ASP CB C 97 42.697 38.812 3.885 1
1 1123 . 29 1 1 A 97 97 ASP N N 97 126.861 124.460 2.401 1
1 1124 . 29 1 1 A 98 98 PHE H H 98 8.566 8.616 -0.050 1
1 1125 . 29 1 1 A 98 98 PHE HA H 98 3.727 4.034 -0.307 1
1 1133 . 29 1 1 A 98 98 PHE C C 98 177.443 177.461 -0.018 1
1 1134 . 29 1 1 A 98 98 PHE CA C 98 62.471 61.952 0.519 1
1 1135 . 29 1 1 A 98 98 PHE CB C 98 39.919 39.171 0.748 1
1 1141 . 29 1 1 A 98 98 PHE N N 98 117.781 120.792 -3.011 1
1 1142 . 29 1 1 A 99 99 ASP H H 99 8.259 8.393 -0.134 1
1 1143 . 29 1 1 A 99 99 ASP HA H 99 3.960 4.205 -0.245 1
1 1146 . 29 1 1 A 99 99 ASP C C 99 178.132 178.465 -0.333 1
1 1147 . 29 1 1 A 99 99 ASP CA C 99 57.658 56.749 0.909 1
1 1148 . 29 1 1 A 99 99 ASP CB C 99 38.572 40.568 -1.996 1
1 1149 . 29 1 1 A 99 99 ASP N N 99 121.709 119.352 2.357 1
1 1150 . 29 1 1 A 100 100 MET H H 100 8.008 8.131 -0.123 1
1 1151 . 29 1 1 A 100 100 MET HA H 100 3.644 4.036 -0.392 1
1 1156 . 29 1 1 A 100 100 MET C C 100 180.008 176.679 3.329 1
1 1157 . 29 1 1 A 100 100 MET CA C 100 58.598 58.452 0.146 1
1 1158 . 29 1 1 A 100 100 MET CB C 100 33.423 32.811 0.612 1
1 1160 . 29 1 1 A 100 100 MET N N 100 119.668 117.975 1.693 1
1 1161 . 29 1 1 A 101 101 LEU H H 101 7.961 8.020 -0.059 1
1 1162 . 29 1 1 A 101 101 LEU HA H 101 3.523 4.594 -1.071 1
1 1172 . 29 1 1 A 101 101 LEU C C 101 173.873 176.693 -2.820 1
1 1173 . 29 1 1 A 101 101 LEU CA C 101 58.743 53.792 4.951 1
1 1174 . 29 1 1 A 101 101 LEU CB C 101 42.632 43.641 -1.009 1
1 1178 . 29 1 1 A 101 101 LEU N N 101 119.752 116.625 3.127 1
1 1179 . 29 1 1 A 102 102 THR H H 102 6.955 9.379 -2.424 1
1 1180 . 29 1 1 A 102 102 THR HA H 102 4.134 3.965 0.169 1
1 1185 . 29 1 1 A 102 102 THR C C 102 176.513 175.171 1.342 1
1 1186 . 29 1 1 A 102 102 THR CA C 102 61.125 65.586 -4.461 1
1 1187 . 29 1 1 A 102 102 THR CB C 102 71.415 66.845 4.570 1
1 1189 . 29 1 1 A 102 102 THR N N 102 124.665 112.451 12.214 1
1 1190 . 29 1 1 A 103 103 GLY H H 103 7.816 8.429 -0.613 1
1 1191 . 29 1 1 A 103 103 GLY HA2 H 103 3.824 4.032 -0.208 1
1 1192 . 29 1 1 A 103 103 GLY HA3 H 103 3.824 4.118 -0.294 1
1 1193 . 29 1 1 A 103 103 GLY C C 103 174.126 175.056 -0.930 1
1 1194 . 29 1 1 A 103 103 GLY CA C 103 47.805 46.238 1.567 1
1 1195 . 29 1 1 A 103 103 GLY N N 103 114.191 108.634 5.557 1
1 1196 . 29 1 1 A 104 104 SER H H 104 8.860 7.757 1.103 1
1 1197 . 29 1 1 A 104 104 SER HA H 104 4.758 4.515 0.243 1
1 1200 . 29 1 1 A 104 104 SER C C 104 174.591 174.406 0.185 1
1 1201 . 29 1 1 A 104 104 SER CA C 104 56.755 57.990 -1.235 1
1 1202 . 29 1 1 A 104 104 SER CB C 104 65.050 63.070 1.980 1
1 1203 . 29 1 1 A 104 104 SER N N 104 114.771 114.265 0.506 1
1 1204 . 29 1 1 A 105 105 GLY H H 105 8.788 7.940 0.848 1
1 1205 . 29 1 1 A 105 105 GLY HA2 H 105 3.733 3.999 -0.266 1
1 1206 . 29 1 1 A 105 105 GLY HA3 H 105 3.733 4.002 -0.269 1
1 1207 . 29 1 1 A 105 105 GLY CA C 105 47.247 45.433 1.814 1
1 1208 . 29 1 1 A 105 105 GLY N N 105 110.394 109.033 1.361 1
1 1209 . 29 1 1 A 106 106 ASN HA H 106 4.454 4.719 -0.265 1
1 1212 . 29 1 1 A 106 106 ASN C C 106 175.180 176.586 -1.406 1
1 1213 . 29 1 1 A 106 106 ASN CA C 106 54.492 55.307 -0.815 1
1 1214 . 29 1 1 A 106 106 ASN CB C 106 37.282 39.307 -2.025 1
1 1215 . 29 1 1 A 107 107 TYR H H 107 8.241 7.814 0.427 1
1 1216 . 29 1 1 A 107 107 TYR HA H 107 4.335 4.738 -0.403 1
1 1223 . 29 1 1 A 107 107 TYR C C 107 173.954 176.658 -2.704 1
1 1224 . 29 1 1 A 107 107 TYR CA C 107 57.727 58.064 -0.337 1
1 1225 . 29 1 1 A 107 107 TYR CB C 107 37.063 39.790 -2.727 1
1 1230 . 29 1 1 A 107 107 TYR N N 107 120.708 115.949 4.759 1
1 1231 . 29 1 1 A 108 108 SER H H 108 7.117 7.717 -0.600 1
1 1232 . 29 1 1 A 108 108 SER HA H 108 4.221 3.914 0.307 1
1 1235 . 29 1 1 A 108 108 SER C C 108 174.834 173.350 1.484 1
1 1236 . 29 1 1 A 108 108 SER CA C 108 59.859 59.243 0.616 1
1 1237 . 29 1 1 A 108 108 SER CB C 108 63.846 62.330 1.516 1
1 1238 . 29 1 1 A 108 108 SER N N 108 113.362 116.000 -2.638 1
1 1239 . 29 1 1 A 109 109 SER H H 109 8.053 8.172 -0.119 1
1 1240 . 29 1 1 A 109 109 SER HA H 109 4.560 4.552 0.008 1
1 1243 . 29 1 1 A 109 109 SER CA C 109 57.141 58.948 -1.807 1
1 1244 . 29 1 1 A 109 109 SER CB C 109 64.874 64.292 0.582 1
1 1245 . 29 1 1 A 109 109 SER N N 109 116.657 116.965 -0.308 1
1 1246 . 29 1 1 A 110 110 THR HA H 110 3.541 4.178 -0.637 1
1 1251 . 29 1 1 A 110 110 THR C C 110 175.477 175.711 -0.234 1
1 1252 . 29 1 1 A 110 110 THR CA C 110 66.443 64.811 1.632 1
1 1253 . 29 1 1 A 110 110 THR CB C 110 68.091 69.011 -0.920 1
1 1255 . 29 1 1 A 111 111 ASP H H 111 8.224 8.917 -0.693 1
1 1256 . 29 1 1 A 111 111 ASP HA H 111 4.237 4.404 -0.167 1
1 1259 . 29 1 1 A 111 111 ASP C C 111 177.520 178.726 -1.206 1
1 1260 . 29 1 1 A 111 111 ASP CA C 111 57.559 57.176 0.383 1
1 1261 . 29 1 1 A 111 111 ASP CB C 111 40.292 40.134 0.158 1
1 1262 . 29 1 1 A 111 111 ASP N N 111 119.490 119.829 -0.339 1
1 1263 . 29 1 1 A 112 112 ALA H H 112 7.431 8.212 -0.781 1
1 1264 . 29 1 1 A 112 112 ALA HA H 112 4.191 4.163 0.028 1
1 1268 . 29 1 1 A 112 112 ALA C C 112 180.646 180.018 0.628 1
1 1269 . 29 1 1 A 112 112 ALA CA C 112 54.534 54.630 -0.096 1
1 1270 . 29 1 1 A 112 112 ALA CB C 112 18.992 18.532 0.460 1
1 1271 . 29 1 1 A 112 112 ALA N N 112 119.710 121.712 -2.002 1
1 1272 . 29 1 1 A 113 113 GLN H H 113 7.576 7.965 -0.389 1
1 1273 . 29 1 1 A 113 113 GLN HA H 113 3.562 4.266 -0.704 1
1 1278 . 29 1 1 A 113 113 GLN C C 113 176.756 178.087 -1.331 1
1 1279 . 29 1 1 A 113 113 GLN CA C 113 57.736 58.996 -1.260 1
1 1280 . 29 1 1 A 113 113 GLN CB C 113 29.110 28.372 0.738 1
1 1281 . 29 1 1 A 113 113 GLN N N 113 117.518 118.747 -1.229 1
1 1283 . 29 1 1 A 114 114 MET H H 114 8.192 8.292 -0.100 1
1 1284 . 29 1 1 A 114 114 MET HA H 114 4.231 4.416 -0.185 1
1 1289 . 29 1 1 A 114 114 MET C C 114 175.648 177.157 -1.509 1
1 1290 . 29 1 1 A 114 114 MET CA C 114 57.446 57.754 -0.308 1
1 1291 . 29 1 1 A 114 114 MET CB C 114 33.570 32.902 0.668 1
1 1293 . 29 1 1 A 114 114 MET N N 114 111.509 119.600 -8.091 1
1 1294 . 29 1 1 A 115 115 GLN H H 115 6.940 7.435 -0.495 1
1 1295 . 29 1 1 A 115 115 GLN HA H 115 4.307 4.621 -0.314 1
1 1302 . 29 1 1 A 115 115 GLN C C 115 176.270 176.091 0.179 1
1 1303 . 29 1 1 A 115 115 GLN CA C 115 54.680 54.943 -0.263 1
1 1304 . 29 1 1 A 115 115 GLN CB C 115 28.233 29.269 -1.036 1
1 1306 . 29 1 1 A 115 115 GLN N N 115 114.300 116.910 -2.610 1
1 1308 . 29 1 1 A 116 116 TYR H H 116 6.677 7.568 -0.891 1
1 1309 . 29 1 1 A 116 116 TYR HA H 116 4.193 4.410 -0.217 1
1 1312 . 29 1 1 A 116 116 TYR C C 116 175.268 175.224 0.044 1
1 1313 . 29 1 1 A 116 116 TYR CA C 116 54.357 60.810 -6.453 1
1 1314 . 29 1 1 A 116 116 TYR CB C 116 35.498 39.056 -3.558 1
1 1315 . 29 1 1 A 116 116 TYR N N 116 117.919 120.324 -2.405 1
1 1316 . 29 1 1 A 117 117 ASP H H 117 8.081 7.701 0.380 1
1 1317 . 29 1 1 A 117 117 ASP HA H 117 4.665 4.691 -0.026 1
1 1320 . 29 1 1 A 117 117 ASP CA C 117 52.422 56.277 -3.855 1
1 1321 . 29 1 1 A 117 117 ASP CB C 117 42.416 39.900 2.516 1
1 1322 . 29 1 1 A 117 117 ASP N N 117 120.887 116.565 4.322 1
1 1323 . 29 1 1 A 118 118 PRO C C 118 179.180 178.629 0.551 1
1 1324 . 29 1 1 A 118 118 PRO CA C 118 65.942 64.666 1.276 1
1 1325 . 29 1 1 A 118 118 PRO CB C 118 32.197 32.083 0.114 1
1 1326 . 29 1 1 A 119 119 GLY H H 119 9.742 8.624 1.118 1
1 1327 . 29 1 1 A 119 119 GLY C C 119 175.622 175.520 0.102 1
1 1328 . 29 1 1 A 119 119 GLY CA C 119 46.785 46.945 -0.160 1
1 1329 . 29 1 1 A 119 119 GLY N N 119 106.412 106.873 -0.461 1
1 1330 . 29 1 1 A 120 120 LEU H H 120 6.666 8.240 -1.574 1
1 1331 . 29 1 1 A 120 120 LEU HA H 120 3.365 3.545 -0.180 1
1 1341 . 29 1 1 A 120 120 LEU C C 120 179.262 178.674 0.588 1
1 1342 . 29 1 1 A 120 120 LEU CA C 120 56.605 57.904 -1.299 1
1 1343 . 29 1 1 A 120 120 LEU CB C 120 39.262 41.496 -2.234 1
1 1347 . 29 1 1 A 120 120 LEU N N 120 126.226 122.761 3.465 1
1 1348 . 29 1 1 A 121 121 PHE H H 121 7.356 8.535 -1.179 1
1 1349 . 29 1 1 A 121 121 PHE HA H 121 4.459 4.051 0.408 1
1 1352 . 29 1 1 A 121 121 PHE C C 121 179.716 176.862 2.854 1
1 1353 . 29 1 1 A 121 121 PHE CA C 121 62.838 61.692 1.146 1
1 1354 . 29 1 1 A 121 121 PHE CB C 121 37.603 39.253 -1.650 1
1 1355 . 29 1 1 A 121 121 PHE N N 121 117.437 119.739 -2.302 1
1 1356 . 29 1 1 A 122 122 ALA H H 122 7.926 7.977 -0.051 1
1 1357 . 29 1 1 A 122 122 ALA HA H 122 4.523 3.713 0.810 1
1 1361 . 29 1 1 A 122 122 ALA C C 122 180.435 179.440 0.995 1
1 1362 . 29 1 1 A 122 122 ALA CA C 122 55.527 55.180 0.347 1
1 1363 . 29 1 1 A 122 122 ALA CB C 122 17.814 18.277 -0.463 1
1 1364 . 29 1 1 A 122 122 ALA N N 122 121.068 121.075 -0.007 1
1 1365 . 29 1 1 A 123 123 GLN H H 123 7.507 8.107 -0.600 1
1 1366 . 29 1 1 A 123 123 GLN HA H 123 4.153 3.989 0.164 1
1 1371 . 29 1 1 A 123 123 GLN C C 123 180.561 178.686 1.875 1
1 1372 . 29 1 1 A 123 123 GLN CA C 123 59.948 58.532 1.416 1
1 1373 . 29 1 1 A 123 123 GLN CB C 123 29.135 28.479 0.656 1
1 1375 . 29 1 1 A 123 123 GLN N N 123 120.324 117.210 3.114 1
1 1376 . 29 1 1 A 124 124 ILE H H 124 8.318 8.078 0.240 1
1 1377 . 29 1 1 A 124 124 ILE HA H 124 3.635 3.791 -0.156 1
1 1387 . 29 1 1 A 124 124 ILE C C 124 176.481 177.723 -1.242 1
1 1388 . 29 1 1 A 124 124 ILE CA C 124 66.432 63.986 2.446 1
1 1389 . 29 1 1 A 124 124 ILE CB C 124 39.168 37.647 1.521 1
1 1393 . 29 1 1 A 124 124 ILE N N 124 123.747 117.643 6.104 1
1 1394 . 29 1 1 A 125 125 GLN H H 125 8.474 7.941 0.533 1
1 1395 . 29 1 1 A 125 125 GLN HA H 125 4.264 4.086 0.178 1
1 1402 . 29 1 1 A 125 125 GLN C C 125 178.947 177.941 1.006 1
1 1403 . 29 1 1 A 125 125 GLN CA C 125 59.651 58.013 1.638 1
1 1404 . 29 1 1 A 125 125 GLN CB C 125 28.880 27.934 0.946 1
1 1406 . 29 1 1 A 125 125 GLN N N 125 120.368 121.820 -1.452 1
1 1408 . 29 1 1 A 126 126 ALA H H 126 8.002 7.446 0.556 1
1 1409 . 29 1 1 A 126 126 ALA HA H 126 4.144 4.014 0.130 1
1 1413 . 29 1 1 A 126 126 ALA C C 126 179.316 179.604 -0.288 1
1 1414 . 29 1 1 A 126 126 ALA CA C 126 55.036 54.659 0.377 1
1 1415 . 29 1 1 A 126 126 ALA CB C 126 18.087 18.083 0.004 1
1 1416 . 29 1 1 A 126 126 ALA N N 126 121.661 122.516 -0.855 1
1 1417 . 29 1 1 A 127 127 ALA H H 127 7.823 7.896 -0.073 1
1 1418 . 29 1 1 A 127 127 ALA HA H 127 4.162 3.986 0.176 1
1 1422 . 29 1 1 A 127 127 ALA C C 127 180.707 179.276 1.431 1
1 1423 . 29 1 1 A 127 127 ALA CA C 127 55.080 54.764 0.316 1
1 1424 . 29 1 1 A 127 127 ALA CB C 127 19.354 18.189 1.165 1
1 1425 . 29 1 1 A 127 127 ALA N N 127 119.853 120.212 -0.359 1
1 1426 . 29 1 1 A 128 128 ALA H H 128 8.936 7.570 1.366 1
1 1427 . 29 1 1 A 128 128 ALA HA H 128 3.928 3.616 0.312 1
1 1431 . 29 1 1 A 128 128 ALA C C 128 181.031 178.890 2.141 1
1 1432 . 29 1 1 A 128 128 ALA CA C 128 55.502 54.562 0.940 1
1 1433 . 29 1 1 A 128 128 ALA CB C 128 16.609 17.768 -1.159 1
1 1434 . 29 1 1 A 128 128 ALA N N 128 121.355 120.170 1.185 1
1 1435 . 29 1 1 A 129 129 THR H H 129 8.543 7.369 1.174 1
1 1436 . 29 1 1 A 129 129 THR HA H 129 4.015 3.653 0.362 1
1 1441 . 29 1 1 A 129 129 THR C C 129 177.332 175.949 1.383 1
1 1442 . 29 1 1 A 129 129 THR CA C 129 65.893 65.071 0.822 1
1 1443 . 29 1 1 A 129 129 THR CB C 129 68.566 68.543 0.023 1
1 1445 . 29 1 1 A 129 129 THR N N 129 112.709 111.840 0.869 1
1 1446 . 29 1 1 A 130 130 LYS H H 130 8.126 7.506 0.620 1
1 1447 . 29 1 1 A 130 130 LYS HA H 130 4.000 4.012 -0.012 1
1 1456 . 29 1 1 A 130 130 LYS C C 130 179.082 178.589 0.493 1
1 1457 . 29 1 1 A 130 130 LYS CA C 130 60.299 58.445 1.854 1
1 1458 . 29 1 1 A 130 130 LYS CB C 130 32.767 31.711 1.056 1
1 1462 . 29 1 1 A 130 130 LYS N N 130 123.879 120.710 3.169 1
1 1463 . 29 1 1 A 131 131 ALA H H 131 7.184 7.594 -0.410 1
1 1464 . 29 1 1 A 131 131 ALA HA H 131 4.005 4.211 -0.206 1
1 1468 . 29 1 1 A 131 131 ALA C C 131 178.482 179.541 -1.059 1
1 1469 . 29 1 1 A 131 131 ALA CA C 131 55.027 55.171 -0.144 1
1 1470 . 29 1 1 A 131 131 ALA CB C 131 18.669 19.465 -0.796 1
1 1471 . 29 1 1 A 131 131 ALA N N 131 118.590 121.230 -2.640 1
1 1472 . 29 1 1 A 132 132 TRP H H 132 7.977 8.513 -0.536 1
1 1473 . 29 1 1 A 132 132 TRP HA H 132 4.001 4.231 -0.230 1
1 1480 . 29 1 1 A 132 132 TRP C C 132 177.332 175.898 1.434 1
1 1481 . 29 1 1 A 132 132 TRP CA C 132 60.431 57.385 3.046 1
1 1482 . 29 1 1 A 132 132 TRP CB C 132 27.786 27.681 0.105 1
1 1486 . 29 1 1 A 132 132 TRP N N 132 119.168 117.019 2.149 1
1 1488 . 29 1 1 A 133 133 ARG H H 133 8.006 8.098 -0.092 1
1 1489 . 29 1 1 A 133 133 ARG HA H 133 4.027 4.367 -0.340 1
1 1497 . 29 1 1 A 133 133 ARG C C 133 176.664 179.056 -2.392 1
1 1498 . 29 1 1 A 133 133 ARG CA C 133 59.355 57.448 1.907 1
1 1499 . 29 1 1 A 133 133 ARG CB C 133 30.451 32.149 -1.698 1
1 1502 . 29 1 1 A 133 133 ARG N N 133 113.062 121.028 -7.966 1
1 1504 . 29 1 1 A 134 134 LYS H H 134 7.322 8.130 -0.808 1
1 1505 . 29 1 1 A 134 134 LYS HA H 134 4.313 4.339 -0.026 1
1 1514 . 29 1 1 A 134 134 LYS C C 134 176.282 176.608 -0.326 1
1 1515 . 29 1 1 A 134 134 LYS CA C 134 54.922 57.832 -2.910 1
1 1516 . 29 1 1 A 134 134 LYS CB C 134 32.633 32.003 0.630 1
1 1520 . 29 1 1 A 134 134 LYS N N 134 118.170 119.599 -1.429 1
1 1521 . 29 1 1 A 135 135 LEU H H 135 7.440 7.321 0.119 1
1 1522 . 29 1 1 A 135 135 LEU HA H 135 4.174 4.668 -0.494 1
1 1532 . 29 1 1 A 135 135 LEU CA C 135 54.408 52.219 2.189 1
1 1533 . 29 1 1 A 135 135 LEU CB C 135 40.407 42.285 -1.878 1
1 1537 . 29 1 1 A 135 135 LEU N N 135 123.358 116.143 7.215 1
1 1538 . 29 1 1 A 136 136 PRO HA H 136 4.437 4.540 -0.103 1
1 1545 . 29 1 1 A 136 136 PRO C C 136 177.106 176.842 0.264 1
1 1546 . 29 1 1 A 136 136 PRO CA C 136 62.889 62.619 0.270 1
1 1547 . 29 1 1 A 136 136 PRO CB C 136 32.192 32.810 -0.618 1
1 1550 . 29 1 1 A 137 137 VAL H H 137 8.219 8.383 -0.164 1
1 1551 . 29 1 1 A 137 137 VAL HA H 137 4.077 4.223 -0.146 1
1 1559 . 29 1 1 A 137 137 VAL C C 137 176.305 176.314 -0.009 1
1 1560 . 29 1 1 A 137 137 VAL CA C 137 61.958 62.932 -0.974 1
1 1561 . 29 1 1 A 137 137 VAL CB C 137 32.755 32.636 0.119 1
1 1564 . 29 1 1 A 137 137 VAL N N 137 120.079 122.921 -2.842 1
1 1565 . 29 1 1 A 138 138 LYS H H 138 8.444 8.557 -0.113 1
1 1566 . 29 1 1 A 138 138 LYS HA H 138 4.316 4.351 -0.035 1
1 1575 . 29 1 1 A 138 138 LYS C C 138 176.790 177.238 -0.448 1
1 1576 . 29 1 1 A 138 138 LYS CA C 138 56.792 56.243 0.549 1
1 1577 . 29 1 1 A 138 138 LYS CB C 138 33.205 33.712 -0.507 1
1 1581 . 29 1 1 A 138 138 LYS N N 138 126.449 125.670 0.779 1
1 1582 . 29 1 1 A 139 139 GLY H H 139 8.518 8.590 -0.072 1
1 1583 . 29 1 1 A 139 139 GLY HA2 H 139 4.070 3.946 0.124 1
1 1584 . 29 1 1 A 139 139 GLY HA3 H 139 3.897 3.948 -0.051 1
1 1585 . 29 1 1 A 139 139 GLY C C 139 172.874 172.899 -0.025 1
1 1586 . 29 1 1 A 139 139 GLY CA C 139 45.157 45.355 -0.198 1
1 1587 . 29 1 1 A 139 139 GLY N N 139 112.617 111.351 1.266 1
1 6 . 30 1 1 A 2 2 VAL H H 2 8.992 8.852 0.140 1
1 7 . 30 1 1 A 2 2 VAL HA H 2 5.370 4.744 0.626 1
1 15 . 30 1 1 A 2 2 VAL C C 2 174.325 174.582 -0.257 1
1 16 . 30 1 1 A 2 2 VAL CA C 2 61.267 60.480 0.787 1
1 17 . 30 1 1 A 2 2 VAL CB C 2 33.890 34.249 -0.359 1
1 20 . 30 1 1 A 2 2 VAL N N 2 126.939 119.577 7.362 1
1 21 . 30 1 1 A 3 3 THR H H 3 8.912 9.299 -0.387 1
1 22 . 30 1 1 A 3 3 THR HA H 3 4.505 5.063 -0.558 1
1 27 . 30 1 1 A 3 3 THR C C 3 172.710 173.348 -0.638 1
1 28 . 30 1 1 A 3 3 THR CA C 3 59.689 59.633 0.056 1
1 29 . 30 1 1 A 3 3 THR CB C 3 72.398 71.844 0.554 1
1 31 . 30 1 1 A 3 3 THR N N 3 118.091 122.665 -4.574 1
1 32 . 30 1 1 A 4 4 GLU H H 4 8.631 8.774 -0.143 1
1 33 . 30 1 1 A 4 4 GLU HA H 4 5.788 4.929 0.859 1
1 38 . 30 1 1 A 4 4 GLU C C 4 175.758 174.442 1.316 1
1 39 . 30 1 1 A 4 4 GLU CA C 4 54.902 53.852 1.050 1
1 40 . 30 1 1 A 4 4 GLU CB C 4 35.097 31.996 3.101 1
1 42 . 30 1 1 A 4 4 GLU N N 4 120.966 120.720 0.246 1
1 43 . 30 1 1 A 5 5 THR H H 5 9.188 8.604 0.584 1
1 44 . 30 1 1 A 5 5 THR HA H 5 4.739 4.706 0.033 1
1 49 . 30 1 1 A 5 5 THR C C 5 172.757 172.350 0.407 1
1 50 . 30 1 1 A 5 5 THR CA C 5 60.382 60.679 -0.297 1
1 51 . 30 1 1 A 5 5 THR CB C 5 71.558 70.395 1.163 1
1 53 . 30 1 1 A 5 5 THR N N 5 119.366 114.212 5.154 1
1 54 . 30 1 1 A 6 6 VAL H H 6 8.476 8.790 -0.314 1
1 55 . 30 1 1 A 6 6 VAL HA H 6 5.026 5.782 -0.756 1
1 63 . 30 1 1 A 6 6 VAL C C 6 176.674 173.707 2.967 1
1 64 . 30 1 1 A 6 6 VAL CA C 6 61.008 59.703 1.305 1
1 65 . 30 1 1 A 6 6 VAL CB C 6 33.861 36.097 -2.236 1
1 68 . 30 1 1 A 6 6 VAL N N 6 121.384 120.021 1.363 1
1 69 . 30 1 1 A 7 7 ASP H H 7 8.848 8.968 -0.120 1
1 70 . 30 1 1 A 7 7 ASP HA H 7 4.797 5.026 -0.229 1
1 73 . 30 1 1 A 7 7 ASP CA C 7 52.834 53.654 -0.820 1
1 74 . 30 1 1 A 7 7 ASP CB C 7 42.219 42.538 -0.319 1
1 75 . 30 1 1 A 7 7 ASP N N 7 127.061 125.629 1.432 1
1 76 . 30 1 1 A 8 8 GLY C C 8 175.143 174.657 0.486 1
1 77 . 30 1 1 A 8 8 GLY CA C 8 46.553 47.535 -0.982 1
1 78 . 30 1 1 A 9 9 GLN H H 9 8.408 7.891 0.517 1
1 79 . 30 1 1 A 9 9 GLN HA H 9 4.541 4.274 0.267 1
1 86 . 30 1 1 A 9 9 GLN C C 9 176.463 176.930 -0.467 1
1 87 . 30 1 1 A 9 9 GLN CA C 9 55.167 55.206 -0.039 1
1 88 . 30 1 1 A 9 9 GLN CB C 9 29.376 27.664 1.712 1
1 90 . 30 1 1 A 9 9 GLN N N 9 118.300 116.506 1.794 1
1 92 . 30 1 1 A 10 10 GLY H H 10 8.162 7.834 0.328 1
1 93 . 30 1 1 A 10 10 GLY HA2 H 10 4.174 3.940 0.234 1
1 94 . 30 1 1 A 10 10 GLY HA3 H 10 3.521 3.944 -0.423 1
1 95 . 30 1 1 A 10 10 GLY C C 10 174.092 174.401 -0.309 1
1 96 . 30 1 1 A 10 10 GLY CA C 10 45.558 46.322 -0.764 1
1 97 . 30 1 1 A 10 10 GLY N N 10 108.747 109.750 -1.003 1
1 98 . 30 1 1 A 11 11 GLN H H 11 8.507 7.818 0.689 1
1 99 . 30 1 1 A 11 11 GLN HA H 11 4.202 4.514 -0.312 1
1 106 . 30 1 1 A 11 11 GLN C C 11 173.992 173.985 0.007 1
1 107 . 30 1 1 A 11 11 GLN CA C 11 55.098 54.467 0.631 1
1 108 . 30 1 1 A 11 11 GLN CB C 11 29.097 31.204 -2.107 1
1 110 . 30 1 1 A 11 11 GLN N N 11 122.979 119.000 3.979 1
1 112 . 30 1 1 A 12 12 ALA H H 12 8.259 8.787 -0.528 1
1 113 . 30 1 1 A 12 12 ALA HA H 12 5.156 5.609 -0.453 1
1 117 . 30 1 1 A 12 12 ALA C C 12 177.284 175.707 1.577 1
1 118 . 30 1 1 A 12 12 ALA CA C 12 51.087 50.109 0.978 1
1 119 . 30 1 1 A 12 12 ALA CB C 12 20.500 21.594 -1.094 1
1 120 . 30 1 1 A 12 12 ALA N N 12 127.100 125.637 1.463 1
1 121 . 30 1 1 A 13 13 TRP H H 13 9.245 9.500 -0.255 1
1 122 . 30 1 1 A 13 13 TRP HA H 13 4.717 5.248 -0.531 1
1 131 . 30 1 1 A 13 13 TRP C C 13 175.108 175.480 -0.372 1
1 132 . 30 1 1 A 13 13 TRP CA C 13 55.966 56.012 -0.046 1
1 133 . 30 1 1 A 13 13 TRP CB C 13 31.912 33.947 -2.035 1
1 139 . 30 1 1 A 13 13 TRP N N 13 123.088 121.821 1.267 1
1 141 . 30 1 1 A 14 14 ARG H H 14 8.575 8.835 -0.260 1
1 142 . 30 1 1 A 14 14 ARG HA H 14 5.335 5.081 0.254 1
1 150 . 30 1 1 A 14 14 ARG C C 14 175.191 174.876 0.315 1
1 151 . 30 1 1 A 14 14 ARG CA C 14 53.106 54.170 -1.064 1
1 152 . 30 1 1 A 14 14 ARG CB C 14 32.749 34.249 -1.500 1
1 154 . 30 1 1 A 14 14 ARG N N 14 121.163 120.070 1.093 1
1 156 . 30 1 1 A 15 15 HIS H H 15 8.595 9.216 -0.621 1
1 157 . 30 1 1 A 15 15 HIS HA H 15 4.790 4.820 -0.030 1
1 161 . 30 1 1 A 15 15 HIS C C 15 173.770 174.194 -0.424 1
1 162 . 30 1 1 A 15 15 HIS CA C 15 55.289 54.502 0.787 1
1 163 . 30 1 1 A 15 15 HIS CB C 15 33.208 33.816 -0.608 1
1 165 . 30 1 1 A 15 15 HIS N N 15 117.643 119.983 -2.340 1
1 166 . 30 1 1 A 16 16 HIS H H 16 8.993 9.245 -0.252 1
1 167 . 30 1 1 A 16 16 HIS HA H 16 5.158 4.795 0.363 1
1 171 . 30 1 1 A 16 16 HIS C C 16 173.608 174.912 -1.304 1
1 172 . 30 1 1 A 16 16 HIS CA C 16 56.450 55.858 0.592 1
1 173 . 30 1 1 A 16 16 HIS CB C 16 34.171 30.829 3.342 1
1 175 . 30 1 1 A 16 16 HIS N N 16 123.520 119.297 4.223 1
1 176 . 30 1 1 A 17 17 ASN H H 17 7.829 8.815 -0.986 1
1 177 . 30 1 1 A 17 17 ASN HA H 17 4.713 5.203 -0.490 1
1 182 . 30 1 1 A 17 17 ASN C C 17 173.682 175.386 -1.704 1
1 183 . 30 1 1 A 17 17 ASN CA C 17 51.822 51.616 0.206 1
1 184 . 30 1 1 A 17 17 ASN CB C 17 43.176 40.298 2.878 1
1 185 . 30 1 1 A 17 17 ASN N N 17 122.213 120.257 1.956 1
1 187 . 30 1 1 A 18 18 GLY H H 18 8.423 8.205 0.218 1
1 188 . 30 1 1 A 18 18 GLY HA2 H 18 3.931 3.924 0.007 1
1 189 . 30 1 1 A 18 18 GLY HA3 H 18 3.707 4.087 -0.380 1
1 190 . 30 1 1 A 18 18 GLY C C 18 173.985 173.039 0.946 1
1 191 . 30 1 1 A 18 18 GLY CA C 18 43.949 44.181 -0.232 1
1 192 . 30 1 1 A 18 18 GLY N N 18 106.991 108.210 -1.219 1
1 193 . 30 1 1 A 19 19 PHE H H 19 8.338 8.358 -0.020 1
1 194 . 30 1 1 A 19 19 PHE HA H 19 4.068 5.238 -1.170 1
1 197 . 30 1 1 A 19 19 PHE C C 19 176.568 174.774 1.794 1
1 198 . 30 1 1 A 19 19 PHE CA C 19 59.338 56.462 2.876 1
1 199 . 30 1 1 A 19 19 PHE CB C 19 40.201 42.057 -1.856 1
1 200 . 30 1 1 A 19 19 PHE N N 19 116.857 119.444 -2.587 1
1 201 . 30 1 1 A 20 20 ASP H H 20 8.794 8.957 -0.163 1
1 202 . 30 1 1 A 20 20 ASP HA H 20 4.485 4.772 -0.287 1
1 205 . 30 1 1 A 20 20 ASP C C 20 177.379 177.436 -0.057 1
1 206 . 30 1 1 A 20 20 ASP CA C 20 54.140 54.998 -0.858 1
1 207 . 30 1 1 A 20 20 ASP CB C 20 41.915 40.982 0.933 1
1 208 . 30 1 1 A 20 20 ASP N N 20 123.025 125.694 -2.669 1
1 209 . 30 1 1 A 21 21 PHE H H 21 8.862 9.164 -0.302 1
1 210 . 30 1 1 A 21 21 PHE HA H 21 4.087 4.142 -0.055 1
1 218 . 30 1 1 A 21 21 PHE C C 21 176.952 177.197 -0.245 1
1 219 . 30 1 1 A 21 21 PHE CA C 21 61.095 62.116 -1.021 1
1 220 . 30 1 1 A 21 21 PHE CB C 21 38.678 39.394 -0.716 1
1 226 . 30 1 1 A 21 21 PHE N N 21 127.163 125.387 1.776 1
1 227 . 30 1 1 A 22 22 ALA H H 22 8.561 8.401 0.160 1
1 228 . 30 1 1 A 22 22 ALA HA H 22 3.878 4.039 -0.161 1
1 232 . 30 1 1 A 22 22 ALA C C 22 180.710 179.976 0.734 1
1 233 . 30 1 1 A 22 22 ALA CA C 22 55.211 55.283 -0.072 1
1 234 . 30 1 1 A 22 22 ALA CB C 22 18.321 18.616 -0.295 1
1 235 . 30 1 1 A 22 22 ALA N N 22 120.293 121.213 -0.920 1
1 236 . 30 1 1 A 23 23 VAL H H 23 7.241 7.802 -0.561 1
1 237 . 30 1 1 A 23 23 VAL HA H 23 3.684 3.498 0.186 1
1 245 . 30 1 1 A 23 23 VAL C C 23 177.101 178.107 -1.006 1
1 246 . 30 1 1 A 23 23 VAL CA C 23 65.237 66.978 -1.741 1
1 247 . 30 1 1 A 23 23 VAL CB C 23 31.780 31.655 0.125 1
1 250 . 30 1 1 A 23 23 VAL N N 23 118.775 117.610 1.165 1
1 251 . 30 1 1 A 24 24 ILE H H 24 6.761 7.754 -0.993 1
1 252 . 30 1 1 A 24 24 ILE HA H 24 3.196 3.446 -0.250 1
1 262 . 30 1 1 A 24 24 ILE C C 24 177.287 178.034 -0.747 1
1 263 . 30 1 1 A 24 24 ILE CA C 24 63.404 65.748 -2.344 1
1 264 . 30 1 1 A 24 24 ILE CB C 24 36.294 37.596 -1.302 1
1 268 . 30 1 1 A 24 24 ILE N N 24 119.036 119.916 -0.880 1
1 269 . 30 1 1 A 25 25 LYS H H 25 8.032 8.055 -0.023 1
1 270 . 30 1 1 A 25 25 LYS HA H 25 3.809 3.723 0.086 1
1 279 . 30 1 1 A 25 25 LYS C C 25 179.450 178.775 0.675 1
1 280 . 30 1 1 A 25 25 LYS CA C 25 59.621 59.486 0.135 1
1 281 . 30 1 1 A 25 25 LYS CB C 25 32.259 31.986 0.273 1
1 285 . 30 1 1 A 25 25 LYS N N 25 118.368 119.879 -1.511 1
1 286 . 30 1 1 A 26 26 GLU H H 26 7.845 8.377 -0.532 1
1 287 . 30 1 1 A 26 26 GLU HA H 26 4.021 4.085 -0.064 1
1 292 . 30 1 1 A 26 26 GLU C C 26 179.191 179.249 -0.058 1
1 293 . 30 1 1 A 26 26 GLU CA C 26 59.530 58.945 0.585 1
1 294 . 30 1 1 A 26 26 GLU CB C 26 29.449 29.285 0.164 1
1 296 . 30 1 1 A 26 26 GLU N N 26 120.522 118.596 1.926 1
1 297 . 30 1 1 A 27 27 LEU H H 27 8.165 8.310 -0.145 1
1 298 . 30 1 1 A 27 27 LEU HA H 27 4.163 4.172 -0.009 1
1 308 . 30 1 1 A 27 27 LEU C C 27 177.256 178.381 -1.125 1
1 309 . 30 1 1 A 27 27 LEU CA C 27 58.049 57.635 0.414 1
1 310 . 30 1 1 A 27 27 LEU CB C 27 41.365 41.246 0.119 1
1 314 . 30 1 1 A 27 27 LEU N N 27 120.879 121.662 -0.783 1
1 315 . 30 1 1 A 28 28 LYS H H 28 8.902 8.156 0.746 1
1 316 . 30 1 1 A 28 28 LYS HA H 28 4.199 4.350 -0.151 1
1 317 . 30 1 1 A 28 28 LYS C C 28 179.707 179.141 0.566 1
1 318 . 30 1 1 A 28 28 LYS CA C 28 60.097 59.243 0.854 1
1 319 . 30 1 1 A 28 28 LYS CB C 28 33.420 31.917 1.503 1
1 320 . 30 1 1 A 28 28 LYS N N 28 120.050 119.473 0.577 1
1 321 . 30 1 1 A 29 29 THR H H 29 8.294 8.109 0.185 1
1 322 . 30 1 1 A 29 29 THR HA H 29 3.892 3.886 0.006 1
1 327 . 30 1 1 A 29 29 THR C C 29 175.711 176.186 -0.475 1
1 328 . 30 1 1 A 29 29 THR CA C 29 66.846 66.554 0.292 1
1 329 . 30 1 1 A 29 29 THR CB C 29 68.794 68.688 0.106 1
1 331 . 30 1 1 A 29 29 THR N N 29 115.933 116.826 -0.893 1
1 332 . 30 1 1 A 30 30 ALA H H 30 8.244 8.664 -0.420 1
1 333 . 30 1 1 A 30 30 ALA HA H 30 4.241 4.247 -0.006 1
1 337 . 30 1 1 A 30 30 ALA C C 30 179.128 179.771 -0.643 1
1 338 . 30 1 1 A 30 30 ALA CA C 30 55.714 55.794 -0.080 1
1 339 . 30 1 1 A 30 30 ALA CB C 30 18.955 18.518 0.437 1
1 340 . 30 1 1 A 30 30 ALA N N 30 124.617 122.948 1.669 1
1 341 . 30 1 1 A 31 31 ALA H H 31 8.968 8.676 0.292 1
1 342 . 30 1 1 A 31 31 ALA HA H 31 3.890 4.045 -0.155 1
1 346 . 30 1 1 A 31 31 ALA C C 31 180.352 179.460 0.892 1
1 347 . 30 1 1 A 31 31 ALA CA C 31 55.454 55.471 -0.017 1
1 348 . 30 1 1 A 31 31 ALA CB C 31 17.124 18.487 -1.363 1
1 349 . 30 1 1 A 31 31 ALA N N 31 119.327 119.863 -0.536 1
1 350 . 30 1 1 A 32 32 SER H H 32 7.995 7.698 0.297 1
1 351 . 30 1 1 A 32 32 SER HA H 32 4.238 4.221 0.017 1
1 354 . 30 1 1 A 32 32 SER C C 32 175.612 175.827 -0.215 1
1 355 . 30 1 1 A 32 32 SER CA C 32 61.203 61.499 -0.296 1
1 356 . 30 1 1 A 32 32 SER CB C 32 63.406 63.518 -0.112 1
1 357 . 30 1 1 A 32 32 SER N N 32 111.962 113.723 -1.761 1
1 358 . 30 1 1 A 33 33 GLN H H 33 8.333 7.754 0.579 1
1 359 . 30 1 1 A 33 33 GLN HA H 33 3.992 4.128 -0.136 1
1 366 . 30 1 1 A 33 33 GLN C C 33 177.486 176.449 1.037 1
1 367 . 30 1 1 A 33 33 GLN CA C 33 58.277 57.420 0.857 1
1 368 . 30 1 1 A 33 33 GLN CB C 33 29.140 29.517 -0.377 1
1 370 . 30 1 1 A 33 33 GLN N N 33 119.527 118.769 0.758 1
1 372 . 30 1 1 A 34 34 TYR H H 34 8.587 8.339 0.248 1
1 373 . 30 1 1 A 34 34 TYR HA H 34 4.792 4.914 -0.122 1
1 380 . 30 1 1 A 34 34 TYR C C 34 176.499 176.997 -0.498 1
1 381 . 30 1 1 A 34 34 TYR CA C 34 57.711 57.755 -0.044 1
1 382 . 30 1 1 A 34 34 TYR CB C 34 39.561 38.975 0.586 1
1 387 . 30 1 1 A 34 34 TYR N N 34 114.610 114.516 0.094 1
1 388 . 30 1 1 A 35 35 GLY H H 35 7.346 8.520 -1.174 1
1 389 . 30 1 1 A 35 35 GLY HA2 H 35 4.785 3.792 0.993 1
1 390 . 30 1 1 A 35 35 GLY HA3 H 35 4.007 3.846 0.161 1
1 391 . 30 1 1 A 35 35 GLY C C 35 175.796 175.212 0.584 1
1 392 . 30 1 1 A 35 35 GLY CA C 35 44.355 47.425 -3.070 1
1 393 . 30 1 1 A 35 35 GLY N N 35 108.501 109.230 -0.729 1
1 394 . 30 1 1 A 36 36 ALA H H 36 9.363 7.968 1.395 1
1 395 . 30 1 1 A 36 36 ALA HA H 36 4.217 4.352 -0.135 1
1 399 . 30 1 1 A 36 36 ALA C C 36 178.039 178.286 -0.247 1
1 400 . 30 1 1 A 36 36 ALA CA C 36 56.114 53.219 2.895 1
1 401 . 30 1 1 A 36 36 ALA CB C 36 19.179 18.408 0.771 1
1 402 . 30 1 1 A 36 36 ALA N N 36 125.811 122.976 2.835 1
1 403 . 30 1 1 A 37 37 THR H H 37 8.070 8.806 -0.736 1
1 404 . 30 1 1 A 37 37 THR HA H 37 4.570 4.092 0.478 1
1 409 . 30 1 1 A 37 37 THR C C 37 173.685 173.126 0.559 1
1 410 . 30 1 1 A 37 37 THR CA C 37 59.822 63.591 -3.769 1
1 411 . 30 1 1 A 37 37 THR CB C 37 68.267 66.656 1.611 1
1 413 . 30 1 1 A 37 37 THR N N 37 129.410 116.719 12.691 1
1 414 . 30 1 1 A 38 38 ALA H H 38 6.853 7.820 -0.967 1
1 415 . 30 1 1 A 38 38 ALA HA H 38 4.601 4.654 -0.053 1
1 419 . 30 1 1 A 38 38 ALA CA C 38 50.758 49.567 1.191 1
1 420 . 30 1 1 A 38 38 ALA CB C 38 18.325 20.364 -2.039 1
1 421 . 30 1 1 A 38 38 ALA N N 38 124.674 124.693 -0.019 1
1 422 . 30 1 1 A 40 40 TYR HA H 40 4.032 4.125 -0.093 1
1 429 . 30 1 1 A 40 40 TYR C C 40 176.456 177.382 -0.926 1
1 430 . 30 1 1 A 40 40 TYR CA C 40 61.010 61.775 -0.765 1
1 431 . 30 1 1 A 40 40 TYR CB C 40 39.286 38.889 0.397 1
1 436 . 30 1 1 A 41 41 THR H H 41 6.874 8.417 -1.543 1
1 437 . 30 1 1 A 41 41 THR HA H 41 3.616 3.927 -0.311 1
1 442 . 30 1 1 A 41 41 THR C C 41 176.930 177.484 -0.554 1
1 443 . 30 1 1 A 41 41 THR CA C 41 65.557 66.834 -1.277 1
1 444 . 30 1 1 A 41 41 THR CB C 41 68.228 68.470 -0.242 1
1 446 . 30 1 1 A 41 41 THR N N 41 115.143 114.009 1.134 1
1 447 . 30 1 1 A 42 42 LEU H H 42 8.623 7.443 1.180 1
1 448 . 30 1 1 A 42 42 LEU HA H 42 3.708 4.011 -0.303 1
1 458 . 30 1 1 A 42 42 LEU C C 42 178.206 178.800 -0.594 1
1 459 . 30 1 1 A 42 42 LEU CA C 42 57.417 57.682 -0.265 1
1 460 . 30 1 1 A 42 42 LEU CB C 42 41.342 41.197 0.145 1
1 464 . 30 1 1 A 42 42 LEU N N 42 120.418 118.147 2.271 1
1 465 . 30 1 1 A 43 43 ALA H H 43 7.735 7.562 0.173 1
1 466 . 30 1 1 A 43 43 ALA HA H 43 4.020 3.981 0.039 1
1 470 . 30 1 1 A 43 43 ALA C C 43 180.826 180.472 0.354 1
1 471 . 30 1 1 A 43 43 ALA CA C 43 54.925 54.960 -0.035 1
1 472 . 30 1 1 A 43 43 ALA CB C 43 17.506 18.483 -0.977 1
1 473 . 30 1 1 A 43 43 ALA N N 43 120.203 121.775 -1.572 1
1 474 . 30 1 1 A 44 44 ILE H H 44 7.149 7.443 -0.294 1
1 475 . 30 1 1 A 44 44 ILE HA H 44 3.603 3.540 0.063 1
1 485 . 30 1 1 A 44 44 ILE C C 44 178.594 177.921 0.673 1
1 486 . 30 1 1 A 44 44 ILE CA C 44 64.782 64.622 0.160 1
1 487 . 30 1 1 A 44 44 ILE CB C 44 37.472 37.596 -0.124 1
1 491 . 30 1 1 A 44 44 ILE N N 44 118.881 119.800 -0.919 1
1 492 . 30 1 1 A 45 45 VAL H H 45 7.968 7.610 0.358 1
1 493 . 30 1 1 A 45 45 VAL HA H 45 2.925 3.377 -0.452 1
1 501 . 30 1 1 A 45 45 VAL C C 45 177.023 177.995 -0.972 1
1 502 . 30 1 1 A 45 45 VAL CA C 45 67.081 67.081 0.000 1
1 503 . 30 1 1 A 45 45 VAL CB C 45 30.854 31.295 -0.441 1
1 506 . 30 1 1 A 45 45 VAL N N 45 120.764 119.983 0.781 1
1 507 . 30 1 1 A 46 46 GLU H H 46 8.399 8.071 0.328 1
1 508 . 30 1 1 A 46 46 GLU HA H 46 3.848 3.960 -0.112 1
1 513 . 30 1 1 A 46 46 GLU C C 46 178.656 178.280 0.376 1
1 514 . 30 1 1 A 46 46 GLU CA C 46 59.491 58.680 0.811 1
1 515 . 30 1 1 A 46 46 GLU CB C 46 28.991 28.129 0.862 1
1 517 . 30 1 1 A 46 46 GLU N N 46 116.599 119.574 -2.975 1
1 518 . 30 1 1 A 47 47 SER H H 47 7.273 7.812 -0.539 1
1 519 . 30 1 1 A 47 47 SER HA H 47 4.287 4.180 0.107 1
1 521 . 30 1 1 A 47 47 SER CA C 47 61.047 62.188 -1.141 1
1 522 . 30 1 1 A 47 47 SER CB C 47 63.016 63.011 0.005 1
1 523 . 30 1 1 A 47 47 SER N N 47 113.609 117.870 -4.261 1
1 524 . 30 1 1 A 48 48 VAL H H 48 8.006 8.210 -0.204 1
1 525 . 30 1 1 A 48 48 VAL HA H 48 3.556 3.578 -0.022 1
1 533 . 30 1 1 A 48 48 VAL C C 48 177.257 177.041 0.216 1
1 534 . 30 1 1 A 48 48 VAL CA C 48 65.025 66.574 -1.549 1
1 535 . 30 1 1 A 48 48 VAL CB C 48 31.841 31.526 0.315 1
1 538 . 30 1 1 A 48 48 VAL N N 48 122.327 121.589 0.738 1
1 539 . 30 1 1 A 49 49 ALA H H 49 8.369 7.849 0.520 1
1 540 . 30 1 1 A 49 49 ALA HA H 49 4.115 4.259 -0.144 1
1 544 . 30 1 1 A 49 49 ALA C C 49 177.307 177.444 -0.137 1
1 545 . 30 1 1 A 49 49 ALA CA C 49 53.253 52.907 0.346 1
1 546 . 30 1 1 A 49 49 ALA CB C 49 20.131 18.334 1.797 1
1 547 . 30 1 1 A 49 49 ALA N N 49 118.050 120.924 -2.874 1
1 548 . 30 1 1 A 50 50 ASP H H 50 7.052 7.899 -0.847 1
1 549 . 30 1 1 A 50 50 ASP HA H 50 4.788 4.590 0.198 1
1 552 . 30 1 1 A 50 50 ASP C C 50 175.481 175.767 -0.286 1
1 553 . 30 1 1 A 50 50 ASP CA C 50 53.681 53.975 -0.294 1
1 554 . 30 1 1 A 50 50 ASP CB C 50 39.333 41.160 -1.827 1
1 555 . 30 1 1 A 50 50 ASP N N 50 116.997 117.244 -0.247 1
1 556 . 30 1 1 A 51 51 ASN H H 51 8.535 7.799 0.736 1
1 557 . 30 1 1 A 51 51 ASN HA H 51 4.628 5.044 -0.416 1
1 562 . 30 1 1 A 51 51 ASN C C 51 174.077 175.034 -0.957 1
1 563 . 30 1 1 A 51 51 ASN CA C 51 52.315 51.947 0.368 1
1 564 . 30 1 1 A 51 51 ASN CB C 51 41.928 41.667 0.261 1
1 565 . 30 1 1 A 51 51 ASN N N 51 118.626 117.340 1.286 1
1 567 . 30 1 1 A 52 52 TRP H H 52 8.555 8.835 -0.280 1
1 574 . 30 1 1 A 52 52 TRP C C 52 173.269 175.494 -2.225 1
1 575 . 30 1 1 A 52 52 TRP CA C 52 55.031 58.111 -3.080 1
1 576 . 30 1 1 A 52 52 TRP CB C 52 26.801 29.612 -2.811 1
1 582 . 30 1 1 A 52 52 TRP N N 52 120.693 120.947 -0.254 1
1 584 . 30 1 1 A 53 53 LEU H H 53 7.847 8.868 -1.021 1
1 585 . 30 1 1 A 53 53 LEU HA H 53 4.859 4.858 0.001 1
1 595 . 30 1 1 A 53 53 LEU C C 53 177.397 175.112 2.285 1
1 596 . 30 1 1 A 53 53 LEU CA C 53 53.619 53.891 -0.272 1
1 597 . 30 1 1 A 53 53 LEU CB C 53 41.812 44.897 -3.085 1
1 601 . 30 1 1 A 53 53 LEU N N 53 124.741 125.382 -0.641 1
1 602 . 30 1 1 A 54 54 THR H H 54 8.850 8.733 0.117 1
1 603 . 30 1 1 A 54 54 THR HA H 54 4.598 4.234 0.364 1
1 608 . 30 1 1 A 54 54 THR CA C 54 60.531 61.059 -0.528 1
1 609 . 30 1 1 A 54 54 THR CB C 54 67.183 68.435 -1.252 1
1 611 . 30 1 1 A 54 54 THR N N 54 113.407 123.281 -9.874 1
1 612 . 30 1 1 A 55 55 PRO HA H 55 4.511 4.379 0.132 1
1 619 . 30 1 1 A 55 55 PRO C C 55 179.383 177.862 1.521 1
1 620 . 30 1 1 A 55 55 PRO CA C 55 67.159 65.679 1.480 1
1 621 . 30 1 1 A 55 55 PRO CB C 55 32.095 31.897 0.198 1
1 622 . 30 1 1 A 56 56 THR H H 56 8.575 7.678 0.897 1
1 623 . 30 1 1 A 56 56 THR HA H 56 4.229 4.743 -0.514 1
1 628 . 30 1 1 A 56 56 THR C C 56 176.668 176.245 0.423 1
1 629 . 30 1 1 A 56 56 THR CA C 56 66.943 64.962 1.981 1
1 630 . 30 1 1 A 56 56 THR CB C 56 68.129 68.736 -0.607 1
1 632 . 30 1 1 A 56 56 THR N N 56 114.855 111.152 3.703 1
1 633 . 30 1 1 A 57 57 ASP H H 57 8.730 8.277 0.453 1
1 634 . 30 1 1 A 57 57 ASP HA H 57 4.425 4.734 -0.309 1
1 637 . 30 1 1 A 57 57 ASP C C 57 178.351 178.822 -0.471 1
1 638 . 30 1 1 A 57 57 ASP CA C 57 57.963 57.480 0.483 1
1 639 . 30 1 1 A 57 57 ASP CB C 57 40.134 41.457 -1.323 1
1 640 . 30 1 1 A 57 57 ASP N N 57 126.239 121.063 5.176 1
1 641 . 30 1 1 A 58 58 TRP H H 58 8.244 8.795 -0.551 1
1 642 . 30 1 1 A 58 58 TRP HA H 58 4.030 4.624 -0.594 1
1 650 . 30 1 1 A 58 58 TRP C C 58 177.432 179.515 -2.083 1
1 651 . 30 1 1 A 58 58 TRP CA C 58 62.731 60.230 2.501 1
1 652 . 30 1 1 A 58 58 TRP CB C 58 29.122 29.504 -0.382 1
1 657 . 30 1 1 A 58 58 TRP N N 58 119.241 121.309 -2.068 1
1 659 . 30 1 1 A 59 59 ASN H H 59 8.098 8.741 -0.643 1
1 660 . 30 1 1 A 59 59 ASN HA H 59 4.424 4.450 -0.026 1
1 663 . 30 1 1 A 59 59 ASN C C 59 176.952 177.661 -0.709 1
1 664 . 30 1 1 A 59 59 ASN CA C 59 58.135 56.098 2.037 1
1 665 . 30 1 1 A 59 59 ASN CB C 59 40.168 37.574 2.594 1
1 666 . 30 1 1 A 59 59 ASN N N 59 115.747 117.391 -1.644 1
1 667 . 30 1 1 A 60 60 THR H H 60 8.712 7.902 0.810 1
1 668 . 30 1 1 A 60 60 THR HA H 60 3.717 4.013 -0.296 1
1 673 . 30 1 1 A 60 60 THR C C 60 176.044 176.586 -0.542 1
1 674 . 30 1 1 A 60 60 THR CA C 60 66.576 67.289 -0.713 1
1 675 . 30 1 1 A 60 60 THR CB C 60 69.251 67.869 1.382 1
1 677 . 30 1 1 A 60 60 THR N N 60 114.896 116.552 -1.656 1
1 678 . 30 1 1 A 61 61 LEU H H 61 8.485 8.669 -0.184 1
1 679 . 30 1 1 A 61 61 LEU HA H 61 3.391 4.069 -0.678 1
1 689 . 30 1 1 A 61 61 LEU C C 61 177.433 178.666 -1.233 1
1 690 . 30 1 1 A 61 61 LEU CA C 61 58.354 58.710 -0.356 1
1 691 . 30 1 1 A 61 61 LEU CB C 61 41.761 42.388 -0.627 1
1 695 . 30 1 1 A 61 61 LEU N N 61 123.433 121.900 1.533 1
1 696 . 30 1 1 A 62 62 VAL H H 62 8.073 8.712 -0.639 1
1 697 . 30 1 1 A 62 62 VAL HA H 62 3.207 3.856 -0.649 1
1 705 . 30 1 1 A 62 62 VAL C C 62 177.585 177.644 -0.059 1
1 706 . 30 1 1 A 62 62 VAL CA C 62 67.345 65.128 2.217 1
1 707 . 30 1 1 A 62 62 VAL CB C 62 30.905 30.614 0.291 1
1 710 . 30 1 1 A 62 62 VAL N N 62 116.018 118.361 -2.343 1
1 711 . 30 1 1 A 63 63 ARG H H 63 7.765 7.813 -0.048 1
1 712 . 30 1 1 A 63 63 ARG HA H 63 3.602 3.871 -0.269 1
1 719 . 30 1 1 A 63 63 ARG C C 63 177.818 178.436 -0.618 1
1 720 . 30 1 1 A 63 63 ARG CA C 63 58.049 59.728 -1.679 1
1 721 . 30 1 1 A 63 63 ARG CB C 63 29.955 29.958 -0.003 1
1 724 . 30 1 1 A 63 63 ARG N N 63 116.700 121.403 -4.703 1
1 725 . 30 1 1 A 64 64 ALA H H 64 7.574 7.769 -0.195 1
1 726 . 30 1 1 A 64 64 ALA HA H 64 4.158 4.010 0.148 1
1 730 . 30 1 1 A 64 64 ALA C C 64 179.886 179.994 -0.108 1
1 731 . 30 1 1 A 64 64 ALA CA C 64 54.007 55.292 -1.285 1
1 732 . 30 1 1 A 64 64 ALA CB C 64 19.147 18.490 0.657 1
1 733 . 30 1 1 A 64 64 ALA N N 64 117.555 121.762 -4.207 1
1 734 . 30 1 1 A 65 65 VAL H H 65 7.554 8.102 -0.548 1
1 735 . 30 1 1 A 65 65 VAL HA H 65 4.253 3.752 0.501 1
1 743 . 30 1 1 A 65 65 VAL C C 65 174.180 176.251 -2.071 1
1 744 . 30 1 1 A 65 65 VAL CA C 65 62.683 65.483 -2.800 1
1 745 . 30 1 1 A 65 65 VAL CB C 65 33.458 31.404 2.054 1
1 748 . 30 1 1 A 65 65 VAL N N 65 110.013 116.170 -6.157 1
1 749 . 30 1 1 A 66 66 LEU H H 66 7.792 7.162 0.630 1
1 750 . 30 1 1 A 66 66 LEU HA H 66 4.790 4.683 0.107 1
1 760 . 30 1 1 A 66 66 LEU C C 66 177.537 175.724 1.813 1
1 761 . 30 1 1 A 66 66 LEU CA C 66 52.823 52.970 -0.147 1
1 762 . 30 1 1 A 66 66 LEU CB C 66 44.071 44.159 -0.088 1
1 766 . 30 1 1 A 66 66 LEU N N 66 118.967 121.233 -2.266 1
1 767 . 30 1 1 A 67 67 SER H H 67 9.208 8.289 0.919 1
1 768 . 30 1 1 A 67 67 SER HA H 67 4.414 4.729 -0.315 1
1 771 . 30 1 1 A 67 67 SER CA C 67 57.943 57.531 0.412 1
1 772 . 30 1 1 A 67 67 SER CB C 67 64.743 65.476 -0.733 1
1 773 . 30 1 1 A 67 67 SER N N 67 116.378 116.050 0.328 1
1 774 . 30 1 1 A 69 69 GLY HA2 H 69 3.916 3.731 0.185 1
1 775 . 30 1 1 A 69 69 GLY HA3 H 69 3.867 3.767 0.100 1
1 776 . 30 1 1 A 69 69 GLY C C 69 176.783 175.423 1.360 1
1 777 . 30 1 1 A 69 69 GLY CA C 69 46.977 46.934 0.043 1
1 778 . 30 1 1 A 70 70 ASP H H 70 7.674 8.019 -0.345 1
1 779 . 30 1 1 A 70 70 ASP HA H 70 4.511 3.323 1.188 1
1 782 . 30 1 1 A 70 70 ASP C C 70 178.096 177.999 0.097 1
1 783 . 30 1 1 A 70 70 ASP CA C 70 57.262 56.329 0.933 1
1 784 . 30 1 1 A 70 70 ASP CB C 70 40.594 39.692 0.902 1
1 785 . 30 1 1 A 70 70 ASP N N 70 123.930 122.046 1.884 1
1 786 . 30 1 1 A 71 71 HIS H H 71 8.729 8.035 0.694 1
1 787 . 30 1 1 A 71 71 HIS HA H 71 4.235 4.079 0.156 1
1 790 . 30 1 1 A 71 71 HIS C C 71 176.769 176.647 0.122 1
1 791 . 30 1 1 A 71 71 HIS CA C 71 60.041 59.863 0.178 1
1 792 . 30 1 1 A 71 71 HIS CB C 71 30.682 29.748 0.934 1
1 793 . 30 1 1 A 71 71 HIS N N 71 121.003 119.350 1.653 1
1 794 . 30 1 1 A 72 72 LEU H H 72 7.620 7.391 0.229 1
1 795 . 30 1 1 A 72 72 LEU HA H 72 3.769 3.852 -0.083 1
1 805 . 30 1 1 A 72 72 LEU C C 72 180.275 179.368 0.907 1
1 806 . 30 1 1 A 72 72 LEU CA C 72 58.192 57.987 0.205 1
1 807 . 30 1 1 A 72 72 LEU CB C 72 41.381 41.205 0.176 1
1 811 . 30 1 1 A 72 72 LEU N N 72 118.569 118.447 0.122 1
1 812 . 30 1 1 A 73 73 LEU H H 73 7.542 7.559 -0.017 1
1 813 . 30 1 1 A 73 73 LEU HA H 73 4.107 4.226 -0.119 1
1 823 . 30 1 1 A 73 73 LEU C C 73 179.436 178.989 0.447 1
1 824 . 30 1 1 A 73 73 LEU CA C 73 58.026 57.258 0.768 1
1 825 . 30 1 1 A 73 73 LEU CB C 73 41.638 42.052 -0.414 1
1 829 . 30 1 1 A 73 73 LEU N N 73 121.418 120.793 0.625 1
1 830 . 30 1 1 A 74 74 TRP H H 74 8.786 8.456 0.330 1
1 831 . 30 1 1 A 74 74 TRP HA H 74 3.589 5.283 -1.694 1
1 840 . 30 1 1 A 74 74 TRP C C 74 176.816 178.777 -1.961 1
1 841 . 30 1 1 A 74 74 TRP CA C 74 63.046 59.988 3.058 1
1 842 . 30 1 1 A 74 74 TRP CB C 74 28.065 29.343 -1.278 1
1 848 . 30 1 1 A 74 74 TRP N N 74 121.111 118.134 2.977 1
1 850 . 30 1 1 A 75 75 LYS H H 75 8.939 7.632 1.307 1
1 851 . 30 1 1 A 75 75 LYS HA H 75 3.055 4.222 -1.167 1
1 860 . 30 1 1 A 75 75 LYS C C 75 177.967 179.306 -1.339 1
1 861 . 30 1 1 A 75 75 LYS CA C 75 60.029 58.722 1.307 1
1 862 . 30 1 1 A 75 75 LYS CB C 75 32.533 33.009 -0.476 1
1 866 . 30 1 1 A 75 75 LYS N N 75 119.783 118.664 1.119 1
1 867 . 30 1 1 A 76 76 SER H H 76 7.832 7.858 -0.026 1
1 868 . 30 1 1 A 76 76 SER HA H 76 4.040 4.266 -0.226 1
1 871 . 30 1 1 A 76 76 SER C C 76 177.816 177.116 0.700 1
1 872 . 30 1 1 A 76 76 SER CA C 76 62.105 62.401 -0.296 1
1 873 . 30 1 1 A 76 76 SER CB C 76 62.679 62.940 -0.261 1
1 874 . 30 1 1 A 76 76 SER N N 76 113.395 116.913 -3.518 1
1 875 . 30 1 1 A 77 77 GLU H H 77 7.590 7.771 -0.181 1
1 876 . 30 1 1 A 77 77 GLU HA H 77 4.042 4.266 -0.224 1
1 881 . 30 1 1 A 77 77 GLU C C 77 177.809 178.501 -0.692 1
1 882 . 30 1 1 A 77 77 GLU CA C 77 58.270 58.695 -0.425 1
1 883 . 30 1 1 A 77 77 GLU CB C 77 29.208 29.391 -0.183 1
1 885 . 30 1 1 A 77 77 GLU N N 77 121.574 121.969 -0.395 1
1 886 . 30 1 1 A 78 78 PHE H H 78 9.081 7.875 1.206 1
1 887 . 30 1 1 A 78 78 PHE HA H 78 3.778 4.263 -0.485 1
1 895 . 30 1 1 A 78 78 PHE C C 78 178.114 177.377 0.737 1
1 896 . 30 1 1 A 78 78 PHE CA C 78 60.629 61.212 -0.583 1
1 897 . 30 1 1 A 78 78 PHE CB C 78 38.295 38.839 -0.544 1
1 902 . 30 1 1 A 78 78 PHE N N 78 122.682 122.119 0.563 1
1 903 . 30 1 1 A 79 79 PHE H H 79 8.890 8.174 0.716 1
1 904 . 30 1 1 A 79 79 PHE HA H 79 3.800 3.951 -0.151 1
1 912 . 30 1 1 A 79 79 PHE C C 79 178.354 178.242 0.112 1
1 913 . 30 1 1 A 79 79 PHE CA C 79 60.704 61.996 -1.292 1
1 914 . 30 1 1 A 79 79 PHE CB C 79 37.184 38.431 -1.247 1
1 920 . 30 1 1 A 79 79 PHE N N 79 121.056 117.633 3.423 1
1 921 . 30 1 1 A 80 80 GLU H H 80 7.793 8.243 -0.450 1
1 922 . 30 1 1 A 80 80 GLU HA H 80 4.082 3.967 0.115 1
1 927 . 30 1 1 A 80 80 GLU C C 80 179.068 179.330 -0.262 1
1 928 . 30 1 1 A 80 80 GLU CA C 80 59.735 59.785 -0.050 1
1 929 . 30 1 1 A 80 80 GLU CB C 80 28.722 29.274 -0.552 1
1 931 . 30 1 1 A 80 80 GLU N N 80 120.312 118.979 1.333 1
1 932 . 30 1 1 A 81 81 ASN H H 81 8.624 8.671 -0.047 1
1 933 . 30 1 1 A 81 81 ASN HA H 81 4.521 4.474 0.047 1
1 938 . 30 1 1 A 81 81 ASN C C 81 179.262 178.184 1.078 1
1 939 . 30 1 1 A 81 81 ASN CA C 81 55.504 56.629 -1.125 1
1 940 . 30 1 1 A 81 81 ASN CB C 81 37.517 38.050 -0.533 1
1 941 . 30 1 1 A 81 81 ASN N N 81 119.338 118.522 0.816 1
1 943 . 30 1 1 A 82 82 CYS H H 82 8.554 8.088 0.466 1
1 944 . 30 1 1 A 82 82 CYS HA H 82 3.792 3.998 -0.206 1
1 947 . 30 1 1 A 82 82 CYS C C 82 176.478 177.231 -0.753 1
1 948 . 30 1 1 A 82 82 CYS CA C 82 65.232 63.133 2.099 1
1 949 . 30 1 1 A 82 82 CYS CB C 82 26.762 27.141 -0.379 1
1 950 . 30 1 1 A 82 82 CYS N N 82 120.576 117.779 2.797 1
1 951 . 30 1 1 A 83 83 ARG H H 83 8.522 8.219 0.303 1
1 952 . 30 1 1 A 83 83 ARG HA H 83 3.932 4.169 -0.237 1
1 960 . 30 1 1 A 83 83 ARG C C 83 179.138 178.683 0.455 1
1 961 . 30 1 1 A 83 83 ARG CA C 83 60.443 58.886 1.557 1
1 962 . 30 1 1 A 83 83 ARG CB C 83 29.550 29.657 -0.107 1
1 965 . 30 1 1 A 83 83 ARG N N 83 123.035 119.939 3.096 1
1 967 . 30 1 1 A 84 84 ASP H H 84 7.791 8.360 -0.569 1
1 968 . 30 1 1 A 84 84 ASP HA H 84 4.353 4.420 -0.067 1
1 971 . 30 1 1 A 84 84 ASP C C 84 178.649 178.800 -0.151 1
1 972 . 30 1 1 A 84 84 ASP CA C 84 57.767 57.627 0.140 1
1 973 . 30 1 1 A 84 84 ASP CB C 84 41.305 41.599 -0.294 1
1 974 . 30 1 1 A 84 84 ASP N N 84 120.332 119.635 0.697 1
1 975 . 30 1 1 A 85 85 THR H H 85 8.370 8.108 0.262 1
1 976 . 30 1 1 A 85 85 THR HA H 85 3.730 3.881 -0.151 1
1 981 . 30 1 1 A 85 85 THR C C 85 175.198 176.194 -0.996 1
1 982 . 30 1 1 A 85 85 THR CA C 85 66.830 66.096 0.734 1
1 983 . 30 1 1 A 85 85 THR CB C 85 68.533 68.386 0.147 1
1 985 . 30 1 1 A 85 85 THR N N 85 117.360 115.739 1.621 1
1 986 . 30 1 1 A 86 86 ALA H H 86 8.845 8.251 0.594 1
1 987 . 30 1 1 A 86 86 ALA HA H 86 3.991 4.048 -0.057 1
1 991 . 30 1 1 A 86 86 ALA C C 86 179.980 179.746 0.234 1
1 992 . 30 1 1 A 86 86 ALA CA C 86 55.769 55.663 0.106 1
1 993 . 30 1 1 A 86 86 ALA CB C 86 17.881 18.493 -0.612 1
1 994 . 30 1 1 A 86 86 ALA N N 86 123.613 123.622 -0.009 1
1 995 . 30 1 1 A 87 87 LYS H H 87 7.686 8.188 -0.502 1
1 996 . 30 1 1 A 87 87 LYS HA H 87 4.099 4.023 0.076 1
1 1005 . 30 1 1 A 87 87 LYS C C 87 179.592 179.477 0.115 1
1 1006 . 30 1 1 A 87 87 LYS CA C 87 59.708 59.778 -0.070 1
1 1007 . 30 1 1 A 87 87 LYS CB C 87 32.054 32.233 -0.179 1
1 1011 . 30 1 1 A 87 87 LYS N N 87 119.623 117.482 2.141 1
1 1012 . 30 1 1 A 88 88 ARG H H 88 7.683 7.599 0.084 1
1 1013 . 30 1 1 A 88 88 ARG HA H 88 4.051 4.170 -0.119 1
1 1020 . 30 1 1 A 88 88 ARG C C 88 180.053 179.001 1.052 1
1 1021 . 30 1 1 A 88 88 ARG CA C 88 59.558 59.149 0.409 1
1 1022 . 30 1 1 A 88 88 ARG CB C 88 29.684 29.901 -0.217 1
1 1025 . 30 1 1 A 88 88 ARG N N 88 120.788 119.210 1.578 1
1 1026 . 30 1 1 A 89 89 ASN H H 89 8.973 8.212 0.761 1
1 1027 . 30 1 1 A 89 89 ASN HA H 89 4.354 4.551 -0.197 1
1 1032 . 30 1 1 A 89 89 ASN C C 89 178.382 177.939 0.443 1
1 1033 . 30 1 1 A 89 89 ASN CA C 89 55.334 56.005 -0.671 1
1 1034 . 30 1 1 A 89 89 ASN CB C 89 37.864 38.378 -0.514 1
1 1035 . 30 1 1 A 89 89 ASN N N 89 121.012 117.599 3.413 1
1 1037 . 30 1 1 A 90 90 GLN H H 90 8.152 8.507 -0.355 1
1 1038 . 30 1 1 A 90 90 GLN HA H 90 4.020 4.063 -0.043 1
1 1045 . 30 1 1 A 90 90 GLN C C 90 179.075 178.463 0.612 1
1 1046 . 30 1 1 A 90 90 GLN CA C 90 59.318 58.888 0.430 1
1 1047 . 30 1 1 A 90 90 GLN CB C 90 28.049 28.120 -0.071 1
1 1049 . 30 1 1 A 90 90 GLN N N 90 122.122 118.621 3.501 1
1 1051 . 30 1 1 A 91 91 GLN H H 91 7.514 8.135 -0.621 1
1 1052 . 30 1 1 A 91 91 GLN HA H 91 4.053 4.163 -0.110 1
1 1059 . 30 1 1 A 91 91 GLN C C 91 177.081 177.266 -0.185 1
1 1060 . 30 1 1 A 91 91 GLN CA C 91 58.031 57.314 0.717 1
1 1061 . 30 1 1 A 91 91 GLN CB C 91 28.365 27.414 0.951 1
1 1063 . 30 1 1 A 91 91 GLN N N 91 118.124 118.128 -0.004 1
1 1065 . 30 1 1 A 92 92 ALA H H 92 7.704 7.782 -0.078 1
1 1066 . 30 1 1 A 92 92 ALA HA H 92 4.246 4.341 -0.095 1
1 1070 . 30 1 1 A 92 92 ALA C C 92 178.450 178.309 0.141 1
1 1071 . 30 1 1 A 92 92 ALA CA C 92 52.671 52.776 -0.105 1
1 1072 . 30 1 1 A 92 92 ALA CB C 92 19.316 19.820 -0.504 1
1 1073 . 30 1 1 A 92 92 ALA N N 92 119.880 120.558 -0.678 1
1 1074 . 30 1 1 A 93 93 GLY H H 93 7.693 7.689 0.004 1
1 1075 . 30 1 1 A 93 93 GLY HA2 H 93 3.941 3.927 0.014 1
1 1076 . 30 1 1 A 93 93 GLY HA3 H 93 3.744 3.929 -0.185 1
1 1077 . 30 1 1 A 93 93 GLY C C 93 174.344 174.972 -0.628 1
1 1078 . 30 1 1 A 93 93 GLY CA C 93 45.949 46.311 -0.362 1
1 1079 . 30 1 1 A 93 93 GLY N N 93 105.347 106.504 -1.157 1
1 1080 . 30 1 1 A 94 94 ASN H H 94 7.076 8.154 -1.078 1
1 1081 . 30 1 1 A 94 94 ASN HA H 94 4.115 4.565 -0.450 1
1 1085 . 30 1 1 A 94 94 ASN C C 94 175.410 175.730 -0.320 1
1 1086 . 30 1 1 A 94 94 ASN CA C 94 52.651 52.655 -0.004 1
1 1087 . 30 1 1 A 94 94 ASN CB C 94 38.330 39.071 -0.741 1
1 1088 . 30 1 1 A 94 94 ASN N N 94 115.747 117.537 -1.790 1
1 1090 . 30 1 1 A 95 95 GLY H H 95 8.236 8.450 -0.214 1
1 1091 . 30 1 1 A 95 95 GLY HA2 H 95 3.633 3.794 -0.161 1
1 1092 . 30 1 1 A 95 95 GLY HA3 H 95 3.633 3.926 -0.293 1
1 1093 . 30 1 1 A 95 95 GLY C C 95 174.450 174.097 0.353 1
1 1094 . 30 1 1 A 95 95 GLY CA C 95 45.522 45.965 -0.443 1
1 1095 . 30 1 1 A 95 95 GLY N N 95 109.166 108.830 0.336 1
1 1096 . 30 1 1 A 96 96 TRP H H 96 7.899 7.723 0.176 1
1 1097 . 30 1 1 A 96 96 TRP HA H 96 5.241 5.044 0.197 1
1 1106 . 30 1 1 A 96 96 TRP C C 96 175.661 176.086 -0.425 1
1 1107 . 30 1 1 A 96 96 TRP CA C 96 55.090 57.214 -2.124 1
1 1108 . 30 1 1 A 96 96 TRP CB C 96 27.138 31.719 -4.581 1
1 1114 . 30 1 1 A 96 96 TRP N N 96 122.840 120.300 2.540 1
1 1116 . 30 1 1 A 97 97 ASP H H 97 7.344 9.053 -1.709 1
1 1117 . 30 1 1 A 97 97 ASP HA H 97 4.829 4.356 0.473 1
1 1120 . 30 1 1 A 97 97 ASP C C 97 175.019 176.276 -1.257 1
1 1121 . 30 1 1 A 97 97 ASP CA C 97 52.149 56.289 -4.140 1
1 1122 . 30 1 1 A 97 97 ASP CB C 97 42.697 38.583 4.114 1
1 1123 . 30 1 1 A 97 97 ASP N N 97 126.861 117.150 9.711 1
1 1124 . 30 1 1 A 98 98 PHE H H 98 8.566 8.604 -0.038 1
1 1125 . 30 1 1 A 98 98 PHE HA H 98 3.727 4.197 -0.470 1
1 1133 . 30 1 1 A 98 98 PHE C C 98 177.443 177.631 -0.188 1
1 1134 . 30 1 1 A 98 98 PHE CA C 98 62.471 61.535 0.936 1
1 1135 . 30 1 1 A 98 98 PHE CB C 98 39.919 39.840 0.079 1
1 1141 . 30 1 1 A 98 98 PHE N N 98 117.781 121.239 -3.458 1
1 1142 . 30 1 1 A 99 99 ASP H H 99 8.259 8.402 -0.143 1
1 1143 . 30 1 1 A 99 99 ASP HA H 99 3.960 4.110 -0.150 1
1 1146 . 30 1 1 A 99 99 ASP C C 99 178.132 178.834 -0.702 1
1 1147 . 30 1 1 A 99 99 ASP CA C 99 57.658 56.581 1.077 1
1 1148 . 30 1 1 A 99 99 ASP CB C 99 38.572 40.170 -1.598 1
1 1149 . 30 1 1 A 99 99 ASP N N 99 121.709 119.496 2.213 1
1 1150 . 30 1 1 A 100 100 MET H H 100 8.008 8.220 -0.212 1
1 1151 . 30 1 1 A 100 100 MET HA H 100 3.644 4.833 -1.189 1
1 1156 . 30 1 1 A 100 100 MET C C 100 180.008 177.584 2.424 1
1 1157 . 30 1 1 A 100 100 MET CA C 100 58.598 58.548 0.050 1
1 1158 . 30 1 1 A 100 100 MET CB C 100 33.423 33.426 -0.003 1
1 1160 . 30 1 1 A 100 100 MET N N 100 119.668 117.688 1.980 1
1 1161 . 30 1 1 A 101 101 LEU H H 101 7.961 7.685 0.276 1
1 1162 . 30 1 1 A 101 101 LEU HA H 101 3.523 4.491 -0.968 1
1 1172 . 30 1 1 A 101 101 LEU C C 101 173.873 175.181 -1.308 1
1 1173 . 30 1 1 A 101 101 LEU CA C 101 58.743 54.246 4.497 1
1 1174 . 30 1 1 A 101 101 LEU CB C 101 42.632 41.140 1.492 1
1 1178 . 30 1 1 A 101 101 LEU N N 101 119.752 119.090 0.662 1
1 1179 . 30 1 1 A 102 102 THR H H 102 6.955 8.159 -1.204 1
1 1180 . 30 1 1 A 102 102 THR HA H 102 4.134 4.354 -0.220 1
1 1185 . 30 1 1 A 102 102 THR C C 102 176.513 174.170 2.343 1
1 1186 . 30 1 1 A 102 102 THR CA C 102 61.125 60.428 0.697 1
1 1187 . 30 1 1 A 102 102 THR CB C 102 71.415 69.861 1.554 1
1 1189 . 30 1 1 A 102 102 THR N N 102 124.665 118.652 6.013 1
1 1190 . 30 1 1 A 103 103 GLY H H 103 7.816 9.063 -1.247 1
1 1191 . 30 1 1 A 103 103 GLY HA2 H 103 3.824 4.155 -0.331 1
1 1192 . 30 1 1 A 103 103 GLY HA3 H 103 3.824 4.164 -0.340 1
1 1193 . 30 1 1 A 103 103 GLY C C 103 174.126 174.825 -0.699 1
1 1194 . 30 1 1 A 103 103 GLY CA C 103 47.805 46.981 0.824 1
1 1195 . 30 1 1 A 103 103 GLY N N 103 114.191 113.839 0.352 1
1 1196 . 30 1 1 A 104 104 SER H H 104 8.860 7.761 1.099 1
1 1197 . 30 1 1 A 104 104 SER HA H 104 4.758 4.380 0.378 1
1 1200 . 30 1 1 A 104 104 SER C C 104 174.591 174.652 -0.061 1
1 1201 . 30 1 1 A 104 104 SER CA C 104 56.755 58.703 -1.948 1
1 1202 . 30 1 1 A 104 104 SER CB C 104 65.050 63.347 1.703 1
1 1203 . 30 1 1 A 104 104 SER N N 104 114.771 116.270 -1.499 1
1 1204 . 30 1 1 A 105 105 GLY H H 105 8.788 8.527 0.261 1
1 1205 . 30 1 1 A 105 105 GLY HA2 H 105 3.733 4.191 -0.458 1
1 1206 . 30 1 1 A 105 105 GLY HA3 H 105 3.733 4.239 -0.506 1
1 1207 . 30 1 1 A 105 105 GLY CA C 105 47.247 45.725 1.522 1
1 1208 . 30 1 1 A 105 105 GLY N N 105 110.394 112.815 -2.421 1
1 1209 . 30 1 1 A 106 106 ASN HA H 106 4.454 4.801 -0.347 1
1 1212 . 30 1 1 A 106 106 ASN C C 106 175.180 175.936 -0.756 1
1 1213 . 30 1 1 A 106 106 ASN CA C 106 54.492 54.905 -0.413 1
1 1214 . 30 1 1 A 106 106 ASN CB C 106 37.282 39.884 -2.602 1
1 1215 . 30 1 1 A 107 107 TYR H H 107 8.241 7.686 0.555 1
1 1216 . 30 1 1 A 107 107 TYR HA H 107 4.335 4.928 -0.593 1
1 1223 . 30 1 1 A 107 107 TYR C C 107 173.954 176.932 -2.978 1
1 1224 . 30 1 1 A 107 107 TYR CA C 107 57.727 57.189 0.538 1
1 1225 . 30 1 1 A 107 107 TYR CB C 107 37.063 40.321 -3.258 1
1 1230 . 30 1 1 A 107 107 TYR N N 107 120.708 114.666 6.042 1
1 1231 . 30 1 1 A 108 108 SER H H 108 7.117 8.160 -1.043 1
1 1232 . 30 1 1 A 108 108 SER HA H 108 4.221 4.297 -0.076 1
1 1235 . 30 1 1 A 108 108 SER C C 108 174.834 174.265 0.569 1
1 1236 . 30 1 1 A 108 108 SER CA C 108 59.859 61.065 -1.206 1
1 1237 . 30 1 1 A 108 108 SER CB C 108 63.846 63.474 0.372 1
1 1238 . 30 1 1 A 108 108 SER N N 108 113.362 117.481 -4.119 1
1 1239 . 30 1 1 A 109 109 SER H H 109 8.053 7.828 0.225 1
1 1240 . 30 1 1 A 109 109 SER HA H 109 4.560 4.215 0.345 1
1 1243 . 30 1 1 A 109 109 SER CA C 109 57.141 60.515 -3.374 1
1 1244 . 30 1 1 A 109 109 SER CB C 109 64.874 61.884 2.990 1
1 1245 . 30 1 1 A 109 109 SER N N 109 116.657 116.054 0.603 1
1 1246 . 30 1 1 A 110 110 THR HA H 110 3.541 4.073 -0.532 1
1 1251 . 30 1 1 A 110 110 THR C C 110 175.477 176.524 -1.047 1
1 1252 . 30 1 1 A 110 110 THR CA C 110 66.443 65.994 0.449 1
1 1253 . 30 1 1 A 110 110 THR CB C 110 68.091 68.578 -0.487 1
1 1255 . 30 1 1 A 111 111 ASP H H 111 8.224 8.503 -0.279 1
1 1256 . 30 1 1 A 111 111 ASP HA H 111 4.237 4.350 -0.113 1
1 1259 . 30 1 1 A 111 111 ASP C C 111 177.520 178.659 -1.139 1
1 1260 . 30 1 1 A 111 111 ASP CA C 111 57.559 57.309 0.250 1
1 1261 . 30 1 1 A 111 111 ASP CB C 111 40.292 40.578 -0.286 1
1 1262 . 30 1 1 A 111 111 ASP N N 111 119.490 120.660 -1.170 1
1 1263 . 30 1 1 A 112 112 ALA H H 112 7.431 8.424 -0.993 1
1 1264 . 30 1 1 A 112 112 ALA HA H 112 4.191 4.162 0.029 1
1 1268 . 30 1 1 A 112 112 ALA C C 112 180.646 179.754 0.892 1
1 1269 . 30 1 1 A 112 112 ALA CA C 112 54.534 55.018 -0.484 1
1 1270 . 30 1 1 A 112 112 ALA CB C 112 18.992 18.451 0.541 1
1 1271 . 30 1 1 A 112 112 ALA N N 112 119.710 121.714 -2.004 1
1 1272 . 30 1 1 A 113 113 GLN H H 113 7.576 8.268 -0.692 1
1 1273 . 30 1 1 A 113 113 GLN HA H 113 3.562 4.200 -0.638 1
1 1278 . 30 1 1 A 113 113 GLN C C 113 176.756 178.262 -1.506 1
1 1279 . 30 1 1 A 113 113 GLN CA C 113 57.736 58.806 -1.070 1
1 1280 . 30 1 1 A 113 113 GLN CB C 113 29.110 28.575 0.535 1
1 1281 . 30 1 1 A 113 113 GLN N N 113 117.518 118.563 -1.045 1
1 1283 . 30 1 1 A 114 114 MET H H 114 8.192 8.554 -0.362 1
1 1284 . 30 1 1 A 114 114 MET HA H 114 4.231 4.184 0.047 1
1 1289 . 30 1 1 A 114 114 MET C C 114 175.648 178.354 -2.706 1
1 1290 . 30 1 1 A 114 114 MET CA C 114 57.446 58.037 -0.591 1
1 1291 . 30 1 1 A 114 114 MET CB C 114 33.570 32.083 1.487 1
1 1293 . 30 1 1 A 114 114 MET N N 114 111.509 119.269 -7.760 1
1 1294 . 30 1 1 A 115 115 GLN H H 115 6.940 7.892 -0.952 1
1 1295 . 30 1 1 A 115 115 GLN HA H 115 4.307 4.240 0.067 1
1 1302 . 30 1 1 A 115 115 GLN C C 115 176.270 175.866 0.404 1
1 1303 . 30 1 1 A 115 115 GLN CA C 115 54.680 58.103 -3.423 1
1 1304 . 30 1 1 A 115 115 GLN CB C 115 28.233 29.121 -0.888 1
1 1306 . 30 1 1 A 115 115 GLN N N 115 114.300 116.145 -1.845 1
1 1308 . 30 1 1 A 116 116 TYR H H 116 6.677 7.978 -1.301 1
1 1309 . 30 1 1 A 116 116 TYR HA H 116 4.193 4.353 -0.160 1
1 1312 . 30 1 1 A 116 116 TYR C C 116 175.268 174.444 0.824 1
1 1313 . 30 1 1 A 116 116 TYR CA C 116 54.357 58.943 -4.586 1
1 1314 . 30 1 1 A 116 116 TYR CB C 116 35.498 36.809 -1.311 1
1 1315 . 30 1 1 A 116 116 TYR N N 116 117.919 119.180 -1.261 1
1 1316 . 30 1 1 A 117 117 ASP H H 117 8.081 8.439 -0.358 1
1 1317 . 30 1 1 A 117 117 ASP HA H 117 4.665 4.838 -0.173 1
1 1320 . 30 1 1 A 117 117 ASP CA C 117 52.422 50.576 1.846 1
1 1321 . 30 1 1 A 117 117 ASP CB C 117 42.416 41.374 1.042 1
1 1322 . 30 1 1 A 117 117 ASP N N 117 120.887 122.213 -1.326 1
1 1323 . 30 1 1 A 118 118 PRO C C 118 179.180 178.005 1.175 1
1 1324 . 30 1 1 A 118 118 PRO CA C 118 65.942 64.607 1.335 1
1 1325 . 30 1 1 A 118 118 PRO CB C 118 32.197 31.599 0.598 1
1 1326 . 30 1 1 A 119 119 GLY H H 119 9.742 8.089 1.653 1
1 1327 . 30 1 1 A 119 119 GLY C C 119 175.622 175.376 0.246 1
1 1328 . 30 1 1 A 119 119 GLY CA C 119 46.785 46.199 0.586 1
1 1329 . 30 1 1 A 119 119 GLY N N 119 106.412 106.107 0.305 1
1 1330 . 30 1 1 A 120 120 LEU H H 120 6.666 7.391 -0.725 1
1 1331 . 30 1 1 A 120 120 LEU HA H 120 3.365 3.825 -0.460 1
1 1341 . 30 1 1 A 120 120 LEU C C 120 179.262 178.289 0.973 1
1 1342 . 30 1 1 A 120 120 LEU CA C 120 56.605 56.922 -0.317 1
1 1343 . 30 1 1 A 120 120 LEU CB C 120 39.262 41.180 -1.918 1
1 1347 . 30 1 1 A 120 120 LEU N N 120 126.226 123.197 3.029 1
1 1348 . 30 1 1 A 121 121 PHE H H 121 7.356 8.843 -1.487 1
1 1349 . 30 1 1 A 121 121 PHE HA H 121 4.459 3.917 0.542 1
1 1352 . 30 1 1 A 121 121 PHE C C 121 179.716 177.122 2.594 1
1 1353 . 30 1 1 A 121 121 PHE CA C 121 62.838 62.110 0.728 1
1 1354 . 30 1 1 A 121 121 PHE CB C 121 37.603 39.282 -1.679 1
1 1355 . 30 1 1 A 121 121 PHE N N 121 117.437 119.310 -1.873 1
1 1356 . 30 1 1 A 122 122 ALA H H 122 7.926 7.847 0.079 1
1 1357 . 30 1 1 A 122 122 ALA HA H 122 4.523 4.050 0.473 1
1 1361 . 30 1 1 A 122 122 ALA C C 122 180.435 179.925 0.510 1
1 1362 . 30 1 1 A 122 122 ALA CA C 122 55.527 55.186 0.341 1
1 1363 . 30 1 1 A 122 122 ALA CB C 122 17.814 18.198 -0.384 1
1 1364 . 30 1 1 A 122 122 ALA N N 122 121.068 121.239 -0.171 1
1 1365 . 30 1 1 A 123 123 GLN H H 123 7.507 7.937 -0.430 1
1 1366 . 30 1 1 A 123 123 GLN HA H 123 4.153 3.875 0.278 1
1 1371 . 30 1 1 A 123 123 GLN C C 123 180.561 178.506 2.055 1
1 1372 . 30 1 1 A 123 123 GLN CA C 123 59.948 59.080 0.868 1
1 1373 . 30 1 1 A 123 123 GLN CB C 123 29.135 28.269 0.866 1
1 1375 . 30 1 1 A 123 123 GLN N N 123 120.324 116.781 3.543 1
1 1376 . 30 1 1 A 124 124 ILE H H 124 8.318 8.199 0.119 1
1 1377 . 30 1 1 A 124 124 ILE HA H 124 3.635 3.869 -0.234 1
1 1387 . 30 1 1 A 124 124 ILE C C 124 176.481 177.874 -1.393 1
1 1388 . 30 1 1 A 124 124 ILE CA C 124 66.432 64.499 1.933 1
1 1389 . 30 1 1 A 124 124 ILE CB C 124 39.168 37.567 1.601 1
1 1393 . 30 1 1 A 124 124 ILE N N 124 123.747 118.032 5.715 1
1 1394 . 30 1 1 A 125 125 GLN H H 125 8.474 7.768 0.706 1
1 1395 . 30 1 1 A 125 125 GLN HA H 125 4.264 3.999 0.265 1
1 1402 . 30 1 1 A 125 125 GLN C C 125 178.947 177.699 1.248 1
1 1403 . 30 1 1 A 125 125 GLN CA C 125 59.651 58.376 1.275 1
1 1404 . 30 1 1 A 125 125 GLN CB C 125 28.880 27.830 1.050 1
1 1406 . 30 1 1 A 125 125 GLN N N 125 120.368 121.283 -0.915 1
1 1408 . 30 1 1 A 126 126 ALA H H 126 8.002 7.517 0.485 1
1 1409 . 30 1 1 A 126 126 ALA HA H 126 4.144 4.072 0.072 1
1 1413 . 30 1 1 A 126 126 ALA C C 126 179.316 179.826 -0.510 1
1 1414 . 30 1 1 A 126 126 ALA CA C 126 55.036 54.712 0.324 1
1 1415 . 30 1 1 A 126 126 ALA CB C 126 18.087 18.153 -0.066 1
1 1416 . 30 1 1 A 126 126 ALA N N 126 121.661 122.328 -0.667 1
1 1417 . 30 1 1 A 127 127 ALA H H 127 7.823 8.159 -0.336 1
1 1418 . 30 1 1 A 127 127 ALA HA H 127 4.162 4.115 0.047 1
1 1422 . 30 1 1 A 127 127 ALA C C 127 180.707 179.330 1.377 1
1 1423 . 30 1 1 A 127 127 ALA CA C 127 55.080 54.847 0.233 1
1 1424 . 30 1 1 A 127 127 ALA CB C 127 19.354 18.415 0.939 1
1 1425 . 30 1 1 A 127 127 ALA N N 127 119.853 119.850 0.003 1
1 1426 . 30 1 1 A 128 128 ALA H H 128 8.936 7.828 1.108 1
1 1427 . 30 1 1 A 128 128 ALA HA H 128 3.928 3.762 0.166 1
1 1431 . 30 1 1 A 128 128 ALA C C 128 181.031 179.378 1.653 1
1 1432 . 30 1 1 A 128 128 ALA CA C 128 55.502 54.635 0.867 1
1 1433 . 30 1 1 A 128 128 ALA CB C 128 16.609 17.785 -1.176 1
1 1434 . 30 1 1 A 128 128 ALA N N 128 121.355 120.345 1.010 1
1 1435 . 30 1 1 A 129 129 THR H H 129 8.543 7.436 1.107 1
1 1436 . 30 1 1 A 129 129 THR HA H 129 4.015 3.631 0.384 1
1 1441 . 30 1 1 A 129 129 THR C C 129 177.332 176.333 0.999 1
1 1442 . 30 1 1 A 129 129 THR CA C 129 65.893 65.010 0.883 1
1 1443 . 30 1 1 A 129 129 THR CB C 129 68.566 68.561 0.005 1
1 1445 . 30 1 1 A 129 129 THR N N 129 112.709 112.112 0.597 1
1 1446 . 30 1 1 A 130 130 LYS H H 130 8.126 7.420 0.706 1
1 1447 . 30 1 1 A 130 130 LYS HA H 130 4.000 4.015 -0.015 1
1 1456 . 30 1 1 A 130 130 LYS C C 130 179.082 178.574 0.508 1
1 1457 . 30 1 1 A 130 130 LYS CA C 130 60.299 58.447 1.852 1
1 1458 . 30 1 1 A 130 130 LYS CB C 130 32.767 31.842 0.925 1
1 1462 . 30 1 1 A 130 130 LYS N N 130 123.879 120.498 3.381 1
1 1463 . 30 1 1 A 131 131 ALA H H 131 7.184 7.789 -0.605 1
1 1464 . 30 1 1 A 131 131 ALA HA H 131 4.005 4.325 -0.320 1
1 1468 . 30 1 1 A 131 131 ALA C C 131 178.482 179.570 -1.088 1
1 1469 . 30 1 1 A 131 131 ALA CA C 131 55.027 55.070 -0.043 1
1 1470 . 30 1 1 A 131 131 ALA CB C 131 18.669 19.716 -1.047 1
1 1471 . 30 1 1 A 131 131 ALA N N 131 118.590 121.145 -2.555 1
1 1472 . 30 1 1 A 132 132 TRP H H 132 7.977 8.693 -0.716 1
1 1473 . 30 1 1 A 132 132 TRP HA H 132 4.001 4.352 -0.351 1
1 1480 . 30 1 1 A 132 132 TRP C C 132 177.332 175.936 1.396 1
1 1481 . 30 1 1 A 132 132 TRP CA C 132 60.431 57.937 2.494 1
1 1482 . 30 1 1 A 132 132 TRP CB C 132 27.786 27.761 0.025 1
1 1486 . 30 1 1 A 132 132 TRP N N 132 119.168 117.300 1.868 1
1 1488 . 30 1 1 A 133 133 ARG H H 133 8.006 7.989 0.017 1
1 1489 . 30 1 1 A 133 133 ARG HA H 133 4.027 4.293 -0.266 1
1 1497 . 30 1 1 A 133 133 ARG C C 133 176.664 177.671 -1.007 1
1 1498 . 30 1 1 A 133 133 ARG CA C 133 59.355 56.863 2.492 1
1 1499 . 30 1 1 A 133 133 ARG CB C 133 30.451 32.315 -1.864 1
1 1502 . 30 1 1 A 133 133 ARG N N 133 113.062 120.649 -7.587 1
1 1504 . 30 1 1 A 134 134 LYS H H 134 7.322 7.653 -0.331 1
1 1505 . 30 1 1 A 134 134 LYS HA H 134 4.313 4.424 -0.111 1
1 1514 . 30 1 1 A 134 134 LYS C C 134 176.282 176.165 0.117 1
1 1515 . 30 1 1 A 134 134 LYS CA C 134 54.922 56.501 -1.579 1
1 1516 . 30 1 1 A 134 134 LYS CB C 134 32.633 31.534 1.099 1
1 1520 . 30 1 1 A 134 134 LYS N N 134 118.170 117.103 1.067 1
1 1521 . 30 1 1 A 135 135 LEU H H 135 7.440 7.969 -0.529 1
1 1522 . 30 1 1 A 135 135 LEU HA H 135 4.174 4.531 -0.357 1
1 1532 . 30 1 1 A 135 135 LEU CA C 135 54.408 53.337 1.071 1
1 1533 . 30 1 1 A 135 135 LEU CB C 135 40.407 40.617 -0.210 1
1 1537 . 30 1 1 A 135 135 LEU N N 135 123.358 121.719 1.639 1
1 1538 . 30 1 1 A 136 136 PRO HA H 136 4.437 4.654 -0.217 1
1 1545 . 30 1 1 A 136 136 PRO C C 136 177.106 176.410 0.696 1
1 1546 . 30 1 1 A 136 136 PRO CA C 136 62.889 62.317 0.572 1
1 1547 . 30 1 1 A 136 136 PRO CB C 136 32.192 33.078 -0.886 1
1 1550 . 30 1 1 A 137 137 VAL H H 137 8.219 8.361 -0.142 1
1 1551 . 30 1 1 A 137 137 VAL HA H 137 4.077 4.365 -0.288 1
1 1559 . 30 1 1 A 137 137 VAL C C 137 176.305 175.703 0.602 1
1 1560 . 30 1 1 A 137 137 VAL CA C 137 61.958 61.602 0.356 1
1 1561 . 30 1 1 A 137 137 VAL CB C 137 32.755 31.784 0.971 1
1 1564 . 30 1 1 A 137 137 VAL N N 137 120.079 119.428 0.651 1
1 1565 . 30 1 1 A 138 138 LYS H H 138 8.444 8.100 0.344 1
1 1566 . 30 1 1 A 138 138 LYS HA H 138 4.316 3.989 0.327 1
1 1575 . 30 1 1 A 138 138 LYS C C 138 176.790 177.201 -0.411 1
1 1576 . 30 1 1 A 138 138 LYS CA C 138 56.792 57.175 -0.383 1
1 1577 . 30 1 1 A 138 138 LYS CB C 138 33.205 30.928 2.277 1
1 1581 . 30 1 1 A 138 138 LYS N N 138 126.449 121.460 4.989 1
1 1582 . 30 1 1 A 139 139 GLY H H 139 8.518 8.314 0.204 1
1 1583 . 30 1 1 A 139 139 GLY HA2 H 139 4.070 3.968 0.102 1
1 1584 . 30 1 1 A 139 139 GLY HA3 H 139 3.897 3.968 -0.071 1
1 1585 . 30 1 1 A 139 139 GLY C C 139 172.874 173.189 -0.315 1
1 1586 . 30 1 1 A 139 139 GLY CA C 139 45.157 45.556 -0.399 1
1 1587 . 30 1 1 A 139 139 GLY N N 139 112.617 110.033 2.584 1
1 6 . 31 1 1 A 2 2 VAL H H 2 8.992 8.779 0.213 1
1 7 . 31 1 1 A 2 2 VAL HA H 2 5.370 4.400 0.970 1
1 15 . 31 1 1 A 2 2 VAL C C 2 174.325 175.790 -1.465 1
1 16 . 31 1 1 A 2 2 VAL CA C 2 61.267 62.835 -1.568 1
1 17 . 31 1 1 A 2 2 VAL CB C 2 33.890 32.282 1.608 1
1 20 . 31 1 1 A 2 2 VAL N N 2 126.939 121.028 5.911 1
1 21 . 31 1 1 A 3 3 THR H H 3 8.912 8.879 0.033 1
1 22 . 31 1 1 A 3 3 THR HA H 3 4.505 4.974 -0.469 1
1 27 . 31 1 1 A 3 3 THR C C 3 172.710 172.736 -0.026 1
1 28 . 31 1 1 A 3 3 THR CA C 3 59.689 61.277 -1.588 1
1 29 . 31 1 1 A 3 3 THR CB C 3 72.398 71.207 1.191 1
1 31 . 31 1 1 A 3 3 THR N N 3 118.091 119.881 -1.790 1
1 32 . 31 1 1 A 4 4 GLU H H 4 8.631 9.407 -0.776 1
1 33 . 31 1 1 A 4 4 GLU HA H 4 5.788 4.983 0.805 1
1 38 . 31 1 1 A 4 4 GLU C C 4 175.758 173.748 2.010 1
1 39 . 31 1 1 A 4 4 GLU CA C 4 54.902 54.979 -0.077 1
1 40 . 31 1 1 A 4 4 GLU CB C 4 35.097 32.794 2.303 1
1 42 . 31 1 1 A 4 4 GLU N N 4 120.966 125.629 -4.663 1
1 43 . 31 1 1 A 5 5 THR H H 5 9.188 8.611 0.577 1
1 44 . 31 1 1 A 5 5 THR HA H 5 4.739 5.178 -0.439 1
1 49 . 31 1 1 A 5 5 THR C C 5 172.757 172.667 0.090 1
1 50 . 31 1 1 A 5 5 THR CA C 5 60.382 59.505 0.877 1
1 51 . 31 1 1 A 5 5 THR CB C 5 71.558 72.342 -0.784 1
1 53 . 31 1 1 A 5 5 THR N N 5 119.366 114.969 4.397 1
1 54 . 31 1 1 A 6 6 VAL H H 6 8.476 8.868 -0.392 1
1 55 . 31 1 1 A 6 6 VAL HA H 6 5.026 5.495 -0.469 1
1 63 . 31 1 1 A 6 6 VAL C C 6 176.674 175.071 1.603 1
1 64 . 31 1 1 A 6 6 VAL CA C 6 61.008 61.041 -0.033 1
1 65 . 31 1 1 A 6 6 VAL CB C 6 33.861 34.940 -1.079 1
1 68 . 31 1 1 A 6 6 VAL N N 6 121.384 123.528 -2.144 1
1 69 . 31 1 1 A 7 7 ASP H H 7 8.848 8.649 0.199 1
1 70 . 31 1 1 A 7 7 ASP HA H 7 4.797 4.872 -0.075 1
1 73 . 31 1 1 A 7 7 ASP CA C 7 52.834 54.967 -2.133 1
1 74 . 31 1 1 A 7 7 ASP CB C 7 42.219 42.415 -0.196 1
1 75 . 31 1 1 A 7 7 ASP N N 7 127.061 127.162 -0.101 1
1 76 . 31 1 1 A 8 8 GLY C C 8 175.143 174.839 0.304 1
1 77 . 31 1 1 A 8 8 GLY CA C 8 46.553 46.781 -0.228 1
1 78 . 31 1 1 A 9 9 GLN H H 9 8.408 7.472 0.936 1
1 79 . 31 1 1 A 9 9 GLN HA H 9 4.541 4.217 0.324 1
1 86 . 31 1 1 A 9 9 GLN C C 9 176.463 176.673 -0.210 1
1 87 . 31 1 1 A 9 9 GLN CA C 9 55.167 55.295 -0.128 1
1 88 . 31 1 1 A 9 9 GLN CB C 9 29.376 27.897 1.479 1
1 90 . 31 1 1 A 9 9 GLN N N 9 118.300 116.850 1.450 1
1 92 . 31 1 1 A 10 10 GLY H H 10 8.162 8.931 -0.769 1
1 93 . 31 1 1 A 10 10 GLY HA2 H 10 4.174 3.928 0.246 1
1 94 . 31 1 1 A 10 10 GLY HA3 H 10 3.521 3.936 -0.415 1
1 95 . 31 1 1 A 10 10 GLY C C 10 174.092 173.646 0.446 1
1 96 . 31 1 1 A 10 10 GLY CA C 10 45.558 46.348 -0.790 1
1 97 . 31 1 1 A 10 10 GLY N N 10 108.747 111.124 -2.377 1
1 98 . 31 1 1 A 11 11 GLN H H 11 8.507 7.463 1.044 1
1 99 . 31 1 1 A 11 11 GLN HA H 11 4.202 4.899 -0.697 1
1 106 . 31 1 1 A 11 11 GLN C C 11 173.992 173.762 0.230 1
1 107 . 31 1 1 A 11 11 GLN CA C 11 55.098 53.597 1.501 1
1 108 . 31 1 1 A 11 11 GLN CB C 11 29.097 31.768 -2.671 1
1 110 . 31 1 1 A 11 11 GLN N N 11 122.979 114.424 8.555 1
1 112 . 31 1 1 A 12 12 ALA H H 12 8.259 8.677 -0.418 1
1 113 . 31 1 1 A 12 12 ALA HA H 12 5.156 6.140 -0.984 1
1 117 . 31 1 1 A 12 12 ALA C C 12 177.284 176.099 1.185 1
1 118 . 31 1 1 A 12 12 ALA CA C 12 51.087 50.256 0.831 1
1 119 . 31 1 1 A 12 12 ALA CB C 12 20.500 22.127 -1.627 1
1 120 . 31 1 1 A 12 12 ALA N N 12 127.100 122.103 4.997 1
1 121 . 31 1 1 A 13 13 TRP H H 13 9.245 9.131 0.114 1
1 122 . 31 1 1 A 13 13 TRP HA H 13 4.717 5.663 -0.946 1
1 131 . 31 1 1 A 13 13 TRP C C 13 175.108 174.435 0.673 1
1 132 . 31 1 1 A 13 13 TRP CA C 13 55.966 55.919 0.047 1
1 133 . 31 1 1 A 13 13 TRP CB C 13 31.912 31.917 -0.005 1
1 139 . 31 1 1 A 13 13 TRP N N 13 123.088 118.958 4.130 1
1 141 . 31 1 1 A 14 14 ARG H H 14 8.575 8.725 -0.150 1
1 142 . 31 1 1 A 14 14 ARG HA H 14 5.335 4.426 0.909 1
1 150 . 31 1 1 A 14 14 ARG C C 14 175.191 174.273 0.918 1
1 151 . 31 1 1 A 14 14 ARG CA C 14 53.106 55.136 -2.030 1
1 152 . 31 1 1 A 14 14 ARG CB C 14 32.749 31.605 1.144 1
1 154 . 31 1 1 A 14 14 ARG N N 14 121.163 121.394 -0.231 1
1 156 . 31 1 1 A 15 15 HIS H H 15 8.595 8.429 0.166 1
1 157 . 31 1 1 A 15 15 HIS HA H 15 4.790 4.983 -0.193 1
1 161 . 31 1 1 A 15 15 HIS C C 15 173.770 174.297 -0.527 1
1 162 . 31 1 1 A 15 15 HIS CA C 15 55.289 55.232 0.057 1
1 163 . 31 1 1 A 15 15 HIS CB C 15 33.208 30.377 2.831 1
1 165 . 31 1 1 A 15 15 HIS N N 15 117.643 120.586 -2.943 1
1 166 . 31 1 1 A 16 16 HIS H H 16 8.993 9.189 -0.196 1
1 167 . 31 1 1 A 16 16 HIS HA H 16 5.158 5.074 0.084 1
1 171 . 31 1 1 A 16 16 HIS C C 16 173.608 174.857 -1.249 1
1 172 . 31 1 1 A 16 16 HIS CA C 16 56.450 55.515 0.935 1
1 173 . 31 1 1 A 16 16 HIS CB C 16 34.171 31.129 3.042 1
1 175 . 31 1 1 A 16 16 HIS N N 16 123.520 123.003 0.517 1
1 176 . 31 1 1 A 17 17 ASN H H 17 7.829 8.609 -0.780 1
1 177 . 31 1 1 A 17 17 ASN HA H 17 4.713 5.359 -0.646 1
1 182 . 31 1 1 A 17 17 ASN C C 17 173.682 175.635 -1.953 1
1 183 . 31 1 1 A 17 17 ASN CA C 17 51.822 51.907 -0.085 1
1 184 . 31 1 1 A 17 17 ASN CB C 17 43.176 42.902 0.274 1
1 185 . 31 1 1 A 17 17 ASN N N 17 122.213 120.326 1.887 1
1 187 . 31 1 1 A 18 18 GLY H H 18 8.423 8.588 -0.165 1
1 188 . 31 1 1 A 18 18 GLY HA2 H 18 3.931 3.910 0.021 1
1 189 . 31 1 1 A 18 18 GLY HA3 H 18 3.707 4.025 -0.318 1
1 190 . 31 1 1 A 18 18 GLY C C 18 173.985 173.359 0.626 1
1 191 . 31 1 1 A 18 18 GLY CA C 18 43.949 46.268 -2.319 1
1 192 . 31 1 1 A 18 18 GLY N N 18 106.991 109.104 -2.113 1
1 193 . 31 1 1 A 19 19 PHE H H 19 8.338 7.980 0.358 1
1 194 . 31 1 1 A 19 19 PHE HA H 19 4.068 5.383 -1.315 1
1 197 . 31 1 1 A 19 19 PHE C C 19 176.568 175.288 1.280 1
1 198 . 31 1 1 A 19 19 PHE CA C 19 59.338 56.709 2.629 1
1 199 . 31 1 1 A 19 19 PHE CB C 19 40.201 43.240 -3.039 1
1 200 . 31 1 1 A 19 19 PHE N N 19 116.857 115.429 1.428 1
1 201 . 31 1 1 A 20 20 ASP H H 20 8.794 8.919 -0.125 1
1 202 . 31 1 1 A 20 20 ASP HA H 20 4.485 4.775 -0.290 1
1 205 . 31 1 1 A 20 20 ASP C C 20 177.379 177.295 0.084 1
1 206 . 31 1 1 A 20 20 ASP CA C 20 54.140 54.405 -0.265 1
1 207 . 31 1 1 A 20 20 ASP CB C 20 41.915 41.077 0.838 1
1 208 . 31 1 1 A 20 20 ASP N N 20 123.025 124.009 -0.984 1
1 209 . 31 1 1 A 21 21 PHE H H 21 8.862 9.196 -0.334 1
1 210 . 31 1 1 A 21 21 PHE HA H 21 4.087 4.152 -0.065 1
1 218 . 31 1 1 A 21 21 PHE C C 21 176.952 177.224 -0.272 1
1 219 . 31 1 1 A 21 21 PHE CA C 21 61.095 61.728 -0.633 1
1 220 . 31 1 1 A 21 21 PHE CB C 21 38.678 39.402 -0.724 1
1 226 . 31 1 1 A 21 21 PHE N N 21 127.163 123.739 3.424 1
1 227 . 31 1 1 A 22 22 ALA H H 22 8.561 8.353 0.208 1
1 228 . 31 1 1 A 22 22 ALA HA H 22 3.878 3.932 -0.054 1
1 232 . 31 1 1 A 22 22 ALA C C 22 180.710 180.002 0.708 1
1 233 . 31 1 1 A 22 22 ALA CA C 22 55.211 55.218 -0.007 1
1 234 . 31 1 1 A 22 22 ALA CB C 22 18.321 18.477 -0.156 1
1 235 . 31 1 1 A 22 22 ALA N N 22 120.293 121.243 -0.950 1
1 236 . 31 1 1 A 23 23 VAL H H 23 7.241 7.647 -0.406 1
1 237 . 31 1 1 A 23 23 VAL HA H 23 3.684 3.498 0.186 1
1 245 . 31 1 1 A 23 23 VAL C C 23 177.101 177.920 -0.819 1
1 246 . 31 1 1 A 23 23 VAL CA C 23 65.237 66.935 -1.698 1
1 247 . 31 1 1 A 23 23 VAL CB C 23 31.780 31.675 0.105 1
1 250 . 31 1 1 A 23 23 VAL N N 23 118.775 117.502 1.273 1
1 251 . 31 1 1 A 24 24 ILE H H 24 6.761 7.727 -0.966 1
1 252 . 31 1 1 A 24 24 ILE HA H 24 3.196 3.343 -0.147 1
1 262 . 31 1 1 A 24 24 ILE C C 24 177.287 177.832 -0.545 1
1 263 . 31 1 1 A 24 24 ILE CA C 24 63.404 65.483 -2.079 1
1 264 . 31 1 1 A 24 24 ILE CB C 24 36.294 37.625 -1.331 1
1 268 . 31 1 1 A 24 24 ILE N N 24 119.036 119.344 -0.308 1
1 269 . 31 1 1 A 25 25 LYS H H 25 8.032 8.032 0.000 1
1 270 . 31 1 1 A 25 25 LYS HA H 25 3.809 3.633 0.176 1
1 279 . 31 1 1 A 25 25 LYS C C 25 179.450 178.560 0.890 1
1 280 . 31 1 1 A 25 25 LYS CA C 25 59.621 59.406 0.215 1
1 281 . 31 1 1 A 25 25 LYS CB C 25 32.259 31.857 0.402 1
1 285 . 31 1 1 A 25 25 LYS N N 25 118.368 119.884 -1.516 1
1 286 . 31 1 1 A 26 26 GLU H H 26 7.845 7.855 -0.010 1
1 287 . 31 1 1 A 26 26 GLU HA H 26 4.021 4.050 -0.029 1
1 292 . 31 1 1 A 26 26 GLU C C 26 179.191 178.836 0.355 1
1 293 . 31 1 1 A 26 26 GLU CA C 26 59.530 59.093 0.437 1
1 294 . 31 1 1 A 26 26 GLU CB C 26 29.449 29.391 0.058 1
1 296 . 31 1 1 A 26 26 GLU N N 26 120.522 119.040 1.482 1
1 297 . 31 1 1 A 27 27 LEU H H 27 8.165 8.044 0.121 1
1 298 . 31 1 1 A 27 27 LEU HA H 27 4.163 4.106 0.057 1
1 308 . 31 1 1 A 27 27 LEU C C 27 177.256 178.356 -1.100 1
1 309 . 31 1 1 A 27 27 LEU CA C 27 58.049 57.499 0.550 1
1 310 . 31 1 1 A 27 27 LEU CB C 27 41.365 41.299 0.066 1
1 314 . 31 1 1 A 27 27 LEU N N 27 120.879 120.924 -0.045 1
1 315 . 31 1 1 A 28 28 LYS H H 28 8.902 8.076 0.826 1
1 316 . 31 1 1 A 28 28 LYS HA H 28 4.199 4.547 -0.348 1
1 317 . 31 1 1 A 28 28 LYS C C 28 179.707 179.269 0.438 1
1 318 . 31 1 1 A 28 28 LYS CA C 28 60.097 59.138 0.959 1
1 319 . 31 1 1 A 28 28 LYS CB C 28 33.420 31.877 1.543 1
1 320 . 31 1 1 A 28 28 LYS N N 28 120.050 119.612 0.438 1
1 321 . 31 1 1 A 29 29 THR H H 29 8.294 8.033 0.261 1
1 322 . 31 1 1 A 29 29 THR HA H 29 3.892 3.943 -0.051 1
1 327 . 31 1 1 A 29 29 THR C C 29 175.711 176.507 -0.796 1
1 328 . 31 1 1 A 29 29 THR CA C 29 66.846 66.459 0.387 1
1 329 . 31 1 1 A 29 29 THR CB C 29 68.794 68.783 0.011 1
1 331 . 31 1 1 A 29 29 THR N N 29 115.933 116.276 -0.343 1
1 332 . 31 1 1 A 30 30 ALA H H 30 8.244 8.349 -0.105 1
1 333 . 31 1 1 A 30 30 ALA HA H 30 4.241 4.279 -0.038 1
1 337 . 31 1 1 A 30 30 ALA C C 30 179.128 179.687 -0.559 1
1 338 . 31 1 1 A 30 30 ALA CA C 30 55.714 55.464 0.250 1
1 339 . 31 1 1 A 30 30 ALA CB C 30 18.955 18.503 0.452 1
1 340 . 31 1 1 A 30 30 ALA N N 30 124.617 123.519 1.098 1
1 341 . 31 1 1 A 31 31 ALA H H 31 8.968 8.530 0.438 1
1 342 . 31 1 1 A 31 31 ALA HA H 31 3.890 4.048 -0.158 1
1 346 . 31 1 1 A 31 31 ALA C C 31 180.352 179.735 0.617 1
1 347 . 31 1 1 A 31 31 ALA CA C 31 55.454 55.488 -0.034 1
1 348 . 31 1 1 A 31 31 ALA CB C 31 17.124 18.851 -1.727 1
1 349 . 31 1 1 A 31 31 ALA N N 31 119.327 120.381 -1.054 1
1 350 . 31 1 1 A 32 32 SER H H 32 7.995 8.022 -0.027 1
1 351 . 31 1 1 A 32 32 SER HA H 32 4.238 4.250 -0.012 1
1 354 . 31 1 1 A 32 32 SER C C 32 175.612 176.601 -0.989 1
1 355 . 31 1 1 A 32 32 SER CA C 32 61.203 60.992 0.211 1
1 356 . 31 1 1 A 32 32 SER CB C 32 63.406 62.849 0.557 1
1 357 . 31 1 1 A 32 32 SER N N 32 111.962 112.565 -0.603 1
1 358 . 31 1 1 A 33 33 GLN H H 33 8.333 7.736 0.597 1
1 359 . 31 1 1 A 33 33 GLN HA H 33 3.992 4.309 -0.317 1
1 366 . 31 1 1 A 33 33 GLN C C 33 177.486 177.107 0.379 1
1 367 . 31 1 1 A 33 33 GLN CA C 33 58.277 57.617 0.660 1
1 368 . 31 1 1 A 33 33 GLN CB C 33 29.140 30.151 -1.011 1
1 370 . 31 1 1 A 33 33 GLN N N 33 119.527 120.672 -1.145 1
1 372 . 31 1 1 A 34 34 TYR H H 34 8.587 8.299 0.288 1
1 373 . 31 1 1 A 34 34 TYR HA H 34 4.792 4.686 0.106 1
1 380 . 31 1 1 A 34 34 TYR C C 34 176.499 176.810 -0.311 1
1 381 . 31 1 1 A 34 34 TYR CA C 34 57.711 58.528 -0.817 1
1 382 . 31 1 1 A 34 34 TYR CB C 34 39.561 39.627 -0.066 1
1 387 . 31 1 1 A 34 34 TYR N N 34 114.610 114.523 0.087 1
1 388 . 31 1 1 A 35 35 GLY H H 35 7.346 8.175 -0.829 1
1 389 . 31 1 1 A 35 35 GLY HA2 H 35 4.785 4.092 0.693 1
1 390 . 31 1 1 A 35 35 GLY HA3 H 35 4.007 4.093 -0.086 1
1 391 . 31 1 1 A 35 35 GLY C C 35 175.796 173.138 2.658 1
1 392 . 31 1 1 A 35 35 GLY CA C 35 44.355 44.759 -0.404 1
1 393 . 31 1 1 A 35 35 GLY N N 35 108.501 106.529 1.972 1
1 394 . 31 1 1 A 36 36 ALA H H 36 9.363 8.261 1.102 1
1 395 . 31 1 1 A 36 36 ALA HA H 36 4.217 4.747 -0.530 1
1 399 . 31 1 1 A 36 36 ALA C C 36 178.039 177.682 0.357 1
1 400 . 31 1 1 A 36 36 ALA CA C 36 56.114 51.692 4.422 1
1 401 . 31 1 1 A 36 36 ALA CB C 36 19.179 19.230 -0.051 1
1 402 . 31 1 1 A 36 36 ALA N N 36 125.811 123.037 2.774 1
1 403 . 31 1 1 A 37 37 THR H H 37 8.070 8.770 -0.700 1
1 404 . 31 1 1 A 37 37 THR HA H 37 4.570 4.473 0.097 1
1 409 . 31 1 1 A 37 37 THR C C 37 173.685 174.421 -0.736 1
1 410 . 31 1 1 A 37 37 THR CA C 37 59.822 62.837 -3.015 1
1 411 . 31 1 1 A 37 37 THR CB C 37 68.267 71.680 -3.413 1
1 413 . 31 1 1 A 37 37 THR N N 37 129.410 119.155 10.255 1
1 414 . 31 1 1 A 38 38 ALA H H 38 6.853 7.613 -0.760 1
1 415 . 31 1 1 A 38 38 ALA HA H 38 4.601 4.585 0.016 1
1 419 . 31 1 1 A 38 38 ALA CA C 38 50.758 50.597 0.161 1
1 420 . 31 1 1 A 38 38 ALA CB C 38 18.325 19.740 -1.415 1
1 421 . 31 1 1 A 38 38 ALA N N 38 124.674 124.957 -0.283 1
1 422 . 31 1 1 A 40 40 TYR HA H 40 4.032 4.018 0.014 1
1 429 . 31 1 1 A 40 40 TYR C C 40 176.456 177.356 -0.900 1
1 430 . 31 1 1 A 40 40 TYR CA C 40 61.010 61.862 -0.852 1
1 431 . 31 1 1 A 40 40 TYR CB C 40 39.286 38.781 0.505 1
1 436 . 31 1 1 A 41 41 THR H H 41 6.874 8.015 -1.141 1
1 437 . 31 1 1 A 41 41 THR HA H 41 3.616 3.824 -0.208 1
1 442 . 31 1 1 A 41 41 THR C C 41 176.930 176.595 0.335 1
1 443 . 31 1 1 A 41 41 THR CA C 41 65.557 65.498 0.059 1
1 444 . 31 1 1 A 41 41 THR CB C 41 68.228 69.109 -0.881 1
1 446 . 31 1 1 A 41 41 THR N N 41 115.143 113.895 1.248 1
1 447 . 31 1 1 A 42 42 LEU H H 42 8.623 7.302 1.321 1
1 448 . 31 1 1 A 42 42 LEU HA H 42 3.708 4.138 -0.430 1
1 458 . 31 1 1 A 42 42 LEU C C 42 178.206 179.138 -0.932 1
1 459 . 31 1 1 A 42 42 LEU CA C 42 57.417 57.585 -0.168 1
1 460 . 31 1 1 A 42 42 LEU CB C 42 41.342 41.278 0.064 1
1 464 . 31 1 1 A 42 42 LEU N N 42 120.418 119.463 0.955 1
1 465 . 31 1 1 A 43 43 ALA H H 43 7.735 8.023 -0.288 1
1 466 . 31 1 1 A 43 43 ALA HA H 43 4.020 4.000 0.020 1
1 470 . 31 1 1 A 43 43 ALA C C 43 180.826 180.550 0.276 1
1 471 . 31 1 1 A 43 43 ALA CA C 43 54.925 55.075 -0.150 1
1 472 . 31 1 1 A 43 43 ALA CB C 43 17.506 18.258 -0.752 1
1 473 . 31 1 1 A 43 43 ALA N N 43 120.203 121.849 -1.646 1
1 474 . 31 1 1 A 44 44 ILE H H 44 7.149 7.367 -0.218 1
1 475 . 31 1 1 A 44 44 ILE HA H 44 3.603 3.604 -0.001 1
1 485 . 31 1 1 A 44 44 ILE C C 44 178.594 178.417 0.177 1
1 486 . 31 1 1 A 44 44 ILE CA C 44 64.782 64.234 0.548 1
1 487 . 31 1 1 A 44 44 ILE CB C 44 37.472 37.015 0.457 1
1 491 . 31 1 1 A 44 44 ILE N N 44 118.881 119.351 -0.470 1
1 492 . 31 1 1 A 45 45 VAL H H 45 7.968 7.823 0.145 1
1 493 . 31 1 1 A 45 45 VAL HA H 45 2.925 3.368 -0.443 1
1 501 . 31 1 1 A 45 45 VAL C C 45 177.023 177.558 -0.535 1
1 502 . 31 1 1 A 45 45 VAL CA C 45 67.081 66.838 0.243 1
1 503 . 31 1 1 A 45 45 VAL CB C 45 30.854 30.939 -0.085 1
1 506 . 31 1 1 A 45 45 VAL N N 45 120.764 120.111 0.653 1
1 507 . 31 1 1 A 46 46 GLU H H 46 8.399 8.732 -0.333 1
1 508 . 31 1 1 A 46 46 GLU HA H 46 3.848 3.842 0.006 1
1 513 . 31 1 1 A 46 46 GLU C C 46 178.656 179.333 -0.677 1
1 514 . 31 1 1 A 46 46 GLU CA C 46 59.491 59.730 -0.239 1
1 515 . 31 1 1 A 46 46 GLU CB C 46 28.991 29.205 -0.214 1
1 517 . 31 1 1 A 46 46 GLU N N 46 116.599 119.438 -2.839 1
1 518 . 31 1 1 A 47 47 SER H H 47 7.273 7.719 -0.446 1
1 519 . 31 1 1 A 47 47 SER HA H 47 4.287 4.187 0.100 1
1 521 . 31 1 1 A 47 47 SER CA C 47 61.047 62.429 -1.382 1
1 522 . 31 1 1 A 47 47 SER CB C 47 63.016 62.884 0.132 1
1 523 . 31 1 1 A 47 47 SER N N 47 113.609 116.900 -3.291 1
1 524 . 31 1 1 A 48 48 VAL H H 48 8.006 8.027 -0.021 1
1 525 . 31 1 1 A 48 48 VAL HA H 48 3.556 3.945 -0.389 1
1 533 . 31 1 1 A 48 48 VAL C C 48 177.257 176.858 0.399 1
1 534 . 31 1 1 A 48 48 VAL CA C 48 65.025 64.735 0.290 1
1 535 . 31 1 1 A 48 48 VAL CB C 48 31.841 31.733 0.108 1
1 538 . 31 1 1 A 48 48 VAL N N 48 122.327 119.096 3.231 1
1 539 . 31 1 1 A 49 49 ALA H H 49 8.369 7.678 0.691 1
1 540 . 31 1 1 A 49 49 ALA HA H 49 4.115 4.382 -0.267 1
1 544 . 31 1 1 A 49 49 ALA C C 49 177.307 177.282 0.025 1
1 545 . 31 1 1 A 49 49 ALA CA C 49 53.253 52.037 1.216 1
1 546 . 31 1 1 A 49 49 ALA CB C 49 20.131 18.816 1.315 1
1 547 . 31 1 1 A 49 49 ALA N N 49 118.050 123.916 -5.866 1
1 548 . 31 1 1 A 50 50 ASP H H 50 7.052 7.854 -0.802 1
1 549 . 31 1 1 A 50 50 ASP HA H 50 4.788 4.613 0.175 1
1 552 . 31 1 1 A 50 50 ASP C C 50 175.481 176.102 -0.621 1
1 553 . 31 1 1 A 50 50 ASP CA C 50 53.681 53.702 -0.021 1
1 554 . 31 1 1 A 50 50 ASP CB C 50 39.333 41.062 -1.729 1
1 555 . 31 1 1 A 50 50 ASP N N 50 116.997 117.541 -0.544 1
1 556 . 31 1 1 A 51 51 ASN H H 51 8.535 7.773 0.762 1
1 557 . 31 1 1 A 51 51 ASN HA H 51 4.628 5.098 -0.470 1
1 562 . 31 1 1 A 51 51 ASN C C 51 174.077 175.098 -1.021 1
1 563 . 31 1 1 A 51 51 ASN CA C 51 52.315 51.942 0.373 1
1 564 . 31 1 1 A 51 51 ASN CB C 51 41.928 41.189 0.739 1
1 565 . 31 1 1 A 51 51 ASN N N 51 118.626 117.513 1.113 1
1 567 . 31 1 1 A 52 52 TRP H H 52 8.555 8.543 0.012 1
1 574 . 31 1 1 A 52 52 TRP C C 52 173.269 176.411 -3.142 1
1 575 . 31 1 1 A 52 52 TRP CA C 52 55.031 57.002 -1.971 1
1 576 . 31 1 1 A 52 52 TRP CB C 52 26.801 29.936 -3.135 1
1 582 . 31 1 1 A 52 52 TRP N N 52 120.693 120.279 0.414 1
1 584 . 31 1 1 A 53 53 LEU H H 53 7.847 8.867 -1.020 1
1 585 . 31 1 1 A 53 53 LEU HA H 53 4.859 4.849 0.010 1
1 595 . 31 1 1 A 53 53 LEU C C 53 177.397 175.002 2.395 1
1 596 . 31 1 1 A 53 53 LEU CA C 53 53.619 53.582 0.037 1
1 597 . 31 1 1 A 53 53 LEU CB C 53 41.812 45.325 -3.513 1
1 601 . 31 1 1 A 53 53 LEU N N 53 124.741 120.642 4.099 1
1 602 . 31 1 1 A 54 54 THR H H 54 8.850 8.516 0.334 1
1 603 . 31 1 1 A 54 54 THR HA H 54 4.598 4.592 0.006 1
1 608 . 31 1 1 A 54 54 THR CA C 54 60.531 58.344 2.187 1
1 609 . 31 1 1 A 54 54 THR CB C 54 67.183 70.002 -2.819 1
1 611 . 31 1 1 A 54 54 THR N N 54 113.407 109.867 3.540 1
1 612 . 31 1 1 A 55 55 PRO HA H 55 4.511 4.462 0.049 1
1 619 . 31 1 1 A 55 55 PRO C C 55 179.383 178.028 1.355 1
1 620 . 31 1 1 A 55 55 PRO CA C 55 67.159 65.718 1.441 1
1 621 . 31 1 1 A 55 55 PRO CB C 55 32.095 31.650 0.445 1
1 622 . 31 1 1 A 56 56 THR H H 56 8.575 7.704 0.871 1
1 623 . 31 1 1 A 56 56 THR HA H 56 4.229 4.155 0.074 1
1 628 . 31 1 1 A 56 56 THR C C 56 176.668 176.617 0.051 1
1 629 . 31 1 1 A 56 56 THR CA C 56 66.943 65.047 1.896 1
1 630 . 31 1 1 A 56 56 THR CB C 56 68.129 68.761 -0.632 1
1 632 . 31 1 1 A 56 56 THR N N 56 114.855 110.676 4.179 1
1 633 . 31 1 1 A 57 57 ASP H H 57 8.730 7.943 0.787 1
1 634 . 31 1 1 A 57 57 ASP HA H 57 4.425 4.577 -0.152 1
1 637 . 31 1 1 A 57 57 ASP C C 57 178.351 179.640 -1.289 1
1 638 . 31 1 1 A 57 57 ASP CA C 57 57.963 57.517 0.446 1
1 639 . 31 1 1 A 57 57 ASP CB C 57 40.134 40.497 -0.363 1
1 640 . 31 1 1 A 57 57 ASP N N 57 126.239 121.994 4.245 1
1 641 . 31 1 1 A 58 58 TRP H H 58 8.244 8.482 -0.238 1
1 642 . 31 1 1 A 58 58 TRP HA H 58 4.030 4.562 -0.532 1
1 650 . 31 1 1 A 58 58 TRP C C 58 177.432 179.377 -1.945 1
1 651 . 31 1 1 A 58 58 TRP CA C 58 62.731 60.218 2.513 1
1 652 . 31 1 1 A 58 58 TRP CB C 58 29.122 29.291 -0.169 1
1 657 . 31 1 1 A 58 58 TRP N N 58 119.241 120.562 -1.321 1
1 659 . 31 1 1 A 59 59 ASN H H 59 8.098 8.805 -0.707 1
1 660 . 31 1 1 A 59 59 ASN HA H 59 4.424 4.407 0.017 1
1 663 . 31 1 1 A 59 59 ASN C C 59 176.952 178.059 -1.107 1
1 664 . 31 1 1 A 59 59 ASN CA C 59 58.135 56.499 1.636 1
1 665 . 31 1 1 A 59 59 ASN CB C 59 40.168 38.300 1.868 1
1 666 . 31 1 1 A 59 59 ASN N N 59 115.747 118.097 -2.350 1
1 667 . 31 1 1 A 60 60 THR H H 60 8.712 8.038 0.674 1
1 668 . 31 1 1 A 60 60 THR HA H 60 3.717 4.135 -0.418 1
1 673 . 31 1 1 A 60 60 THR C C 60 176.044 176.729 -0.685 1
1 674 . 31 1 1 A 60 60 THR CA C 60 66.576 67.149 -0.573 1
1 675 . 31 1 1 A 60 60 THR CB C 60 69.251 68.091 1.160 1
1 677 . 31 1 1 A 60 60 THR N N 60 114.896 118.467 -3.571 1
1 678 . 31 1 1 A 61 61 LEU H H 61 8.485 8.432 0.053 1
1 679 . 31 1 1 A 61 61 LEU HA H 61 3.391 3.842 -0.451 1
1 689 . 31 1 1 A 61 61 LEU C C 61 177.433 178.521 -1.088 1
1 690 . 31 1 1 A 61 61 LEU CA C 61 58.354 58.624 -0.270 1
1 691 . 31 1 1 A 61 61 LEU CB C 61 41.761 42.094 -0.333 1
1 695 . 31 1 1 A 61 61 LEU N N 61 123.433 121.866 1.567 1
1 696 . 31 1 1 A 62 62 VAL H H 62 8.073 8.288 -0.215 1
1 697 . 31 1 1 A 62 62 VAL HA H 62 3.207 3.855 -0.648 1
1 705 . 31 1 1 A 62 62 VAL C C 62 177.585 177.757 -0.172 1
1 706 . 31 1 1 A 62 62 VAL CA C 62 67.345 65.149 2.196 1
1 707 . 31 1 1 A 62 62 VAL CB C 62 30.905 30.571 0.334 1
1 710 . 31 1 1 A 62 62 VAL N N 62 116.018 118.406 -2.388 1
1 711 . 31 1 1 A 63 63 ARG H H 63 7.765 7.927 -0.162 1
1 712 . 31 1 1 A 63 63 ARG HA H 63 3.602 3.890 -0.288 1
1 719 . 31 1 1 A 63 63 ARG C C 63 177.818 178.492 -0.674 1
1 720 . 31 1 1 A 63 63 ARG CA C 63 58.049 59.821 -1.772 1
1 721 . 31 1 1 A 63 63 ARG CB C 63 29.955 30.061 -0.106 1
1 724 . 31 1 1 A 63 63 ARG N N 63 116.700 121.774 -5.074 1
1 725 . 31 1 1 A 64 64 ALA H H 64 7.574 7.680 -0.106 1
1 726 . 31 1 1 A 64 64 ALA HA H 64 4.158 4.411 -0.253 1
1 730 . 31 1 1 A 64 64 ALA C C 64 179.886 179.484 0.402 1
1 731 . 31 1 1 A 64 64 ALA CA C 64 54.007 53.954 0.053 1
1 732 . 31 1 1 A 64 64 ALA CB C 64 19.147 19.850 -0.703 1
1 733 . 31 1 1 A 64 64 ALA N N 64 117.555 120.653 -3.098 1
1 734 . 31 1 1 A 65 65 VAL H H 65 7.554 8.134 -0.580 1
1 735 . 31 1 1 A 65 65 VAL HA H 65 4.253 3.817 0.436 1
1 743 . 31 1 1 A 65 65 VAL C C 65 174.180 176.367 -2.187 1
1 744 . 31 1 1 A 65 65 VAL CA C 65 62.683 65.334 -2.651 1
1 745 . 31 1 1 A 65 65 VAL CB C 65 33.458 31.108 2.350 1
1 748 . 31 1 1 A 65 65 VAL N N 65 110.013 115.460 -5.447 1
1 749 . 31 1 1 A 66 66 LEU H H 66 7.792 7.069 0.723 1
1 750 . 31 1 1 A 66 66 LEU HA H 66 4.790 4.822 -0.032 1
1 760 . 31 1 1 A 66 66 LEU C C 66 177.537 175.800 1.737 1
1 761 . 31 1 1 A 66 66 LEU CA C 66 52.823 52.715 0.108 1
1 762 . 31 1 1 A 66 66 LEU CB C 66 44.071 45.093 -1.022 1
1 766 . 31 1 1 A 66 66 LEU N N 66 118.967 121.380 -2.413 1
1 767 . 31 1 1 A 67 67 SER H H 67 9.208 8.352 0.856 1
1 768 . 31 1 1 A 67 67 SER HA H 67 4.414 4.919 -0.505 1
1 771 . 31 1 1 A 67 67 SER CA C 67 57.943 57.490 0.453 1
1 772 . 31 1 1 A 67 67 SER CB C 67 64.743 66.451 -1.708 1
1 773 . 31 1 1 A 67 67 SER N N 67 116.378 116.444 -0.066 1
1 774 . 31 1 1 A 69 69 GLY HA2 H 69 3.916 3.778 0.138 1
1 775 . 31 1 1 A 69 69 GLY HA3 H 69 3.867 3.803 0.064 1
1 776 . 31 1 1 A 69 69 GLY C C 69 176.783 175.509 1.274 1
1 777 . 31 1 1 A 69 69 GLY CA C 69 46.977 46.761 0.216 1
1 778 . 31 1 1 A 70 70 ASP H H 70 7.674 8.123 -0.449 1
1 779 . 31 1 1 A 70 70 ASP HA H 70 4.511 3.518 0.993 1
1 782 . 31 1 1 A 70 70 ASP C C 70 178.096 178.173 -0.077 1
1 783 . 31 1 1 A 70 70 ASP CA C 70 57.262 56.394 0.868 1
1 784 . 31 1 1 A 70 70 ASP CB C 70 40.594 39.587 1.007 1
1 785 . 31 1 1 A 70 70 ASP N N 70 123.930 121.792 2.138 1
1 786 . 31 1 1 A 71 71 HIS H H 71 8.729 7.837 0.892 1
1 787 . 31 1 1 A 71 71 HIS HA H 71 4.235 4.124 0.111 1
1 790 . 31 1 1 A 71 71 HIS C C 71 176.769 176.708 0.061 1
1 791 . 31 1 1 A 71 71 HIS CA C 71 60.041 59.931 0.110 1
1 792 . 31 1 1 A 71 71 HIS CB C 71 30.682 30.066 0.616 1
1 793 . 31 1 1 A 71 71 HIS N N 71 121.003 119.215 1.788 1
1 794 . 31 1 1 A 72 72 LEU H H 72 7.620 7.997 -0.377 1
1 795 . 31 1 1 A 72 72 LEU HA H 72 3.769 3.999 -0.230 1
1 805 . 31 1 1 A 72 72 LEU C C 72 180.275 179.167 1.108 1
1 806 . 31 1 1 A 72 72 LEU CA C 72 58.192 58.002 0.190 1
1 807 . 31 1 1 A 72 72 LEU CB C 72 41.381 41.310 0.071 1
1 811 . 31 1 1 A 72 72 LEU N N 72 118.569 118.538 0.031 1
1 812 . 31 1 1 A 73 73 LEU H H 73 7.542 7.878 -0.336 1
1 813 . 31 1 1 A 73 73 LEU HA H 73 4.107 4.103 0.004 1
1 823 . 31 1 1 A 73 73 LEU C C 73 179.436 179.060 0.376 1
1 824 . 31 1 1 A 73 73 LEU CA C 73 58.026 57.595 0.431 1
1 825 . 31 1 1 A 73 73 LEU CB C 73 41.638 42.011 -0.373 1
1 829 . 31 1 1 A 73 73 LEU N N 73 121.418 120.645 0.773 1
1 830 . 31 1 1 A 74 74 TRP H H 74 8.786 8.053 0.733 1
1 831 . 31 1 1 A 74 74 TRP HA H 74 3.589 5.324 -1.735 1
1 840 . 31 1 1 A 74 74 TRP C C 74 176.816 178.700 -1.884 1
1 841 . 31 1 1 A 74 74 TRP CA C 74 63.046 60.054 2.992 1
1 842 . 31 1 1 A 74 74 TRP CB C 74 28.065 29.282 -1.217 1
1 848 . 31 1 1 A 74 74 TRP N N 74 121.111 118.451 2.660 1
1 850 . 31 1 1 A 75 75 LYS H H 75 8.939 7.786 1.153 1
1 851 . 31 1 1 A 75 75 LYS HA H 75 3.055 4.112 -1.057 1
1 860 . 31 1 1 A 75 75 LYS C C 75 177.967 179.391 -1.424 1
1 861 . 31 1 1 A 75 75 LYS CA C 75 60.029 58.831 1.198 1
1 862 . 31 1 1 A 75 75 LYS CB C 75 32.533 31.715 0.818 1
1 866 . 31 1 1 A 75 75 LYS N N 75 119.783 118.718 1.065 1
1 867 . 31 1 1 A 76 76 SER H H 76 7.832 7.745 0.087 1
1 868 . 31 1 1 A 76 76 SER HA H 76 4.040 4.386 -0.346 1
1 871 . 31 1 1 A 76 76 SER C C 76 177.816 177.079 0.737 1
1 872 . 31 1 1 A 76 76 SER CA C 76 62.105 61.480 0.625 1
1 873 . 31 1 1 A 76 76 SER CB C 76 62.679 63.134 -0.455 1
1 874 . 31 1 1 A 76 76 SER N N 76 113.395 115.720 -2.325 1
1 875 . 31 1 1 A 77 77 GLU H H 77 7.590 7.685 -0.095 1
1 876 . 31 1 1 A 77 77 GLU HA H 77 4.042 4.318 -0.276 1
1 881 . 31 1 1 A 77 77 GLU C C 77 177.809 178.643 -0.834 1
1 882 . 31 1 1 A 77 77 GLU CA C 77 58.270 58.633 -0.363 1
1 883 . 31 1 1 A 77 77 GLU CB C 77 29.208 29.352 -0.144 1
1 885 . 31 1 1 A 77 77 GLU N N 77 121.574 121.977 -0.403 1
1 886 . 31 1 1 A 78 78 PHE H H 78 9.081 7.943 1.138 1
1 887 . 31 1 1 A 78 78 PHE HA H 78 3.778 4.119 -0.341 1
1 895 . 31 1 1 A 78 78 PHE C C 78 178.114 177.189 0.925 1
1 896 . 31 1 1 A 78 78 PHE CA C 78 60.629 61.361 -0.732 1
1 897 . 31 1 1 A 78 78 PHE CB C 78 38.295 38.680 -0.385 1
1 902 . 31 1 1 A 78 78 PHE N N 78 122.682 122.543 0.139 1
1 903 . 31 1 1 A 79 79 PHE H H 79 8.890 8.000 0.890 1
1 904 . 31 1 1 A 79 79 PHE HA H 79 3.800 4.143 -0.343 1
1 912 . 31 1 1 A 79 79 PHE C C 79 178.354 178.286 0.068 1
1 913 . 31 1 1 A 79 79 PHE CA C 79 60.704 61.873 -1.169 1
1 914 . 31 1 1 A 79 79 PHE CB C 79 37.184 38.443 -1.259 1
1 920 . 31 1 1 A 79 79 PHE N N 79 121.056 118.124 2.932 1
1 921 . 31 1 1 A 80 80 GLU H H 80 7.793 8.509 -0.716 1
1 922 . 31 1 1 A 80 80 GLU HA H 80 4.082 4.062 0.020 1
1 927 . 31 1 1 A 80 80 GLU C C 80 179.068 179.019 0.049 1
1 928 . 31 1 1 A 80 80 GLU CA C 80 59.735 59.806 -0.071 1
1 929 . 31 1 1 A 80 80 GLU CB C 80 28.722 29.371 -0.649 1
1 931 . 31 1 1 A 80 80 GLU N N 80 120.312 118.952 1.360 1
1 932 . 31 1 1 A 81 81 ASN H H 81 8.624 8.778 -0.154 1
1 933 . 31 1 1 A 81 81 ASN HA H 81 4.521 4.492 0.029 1
1 938 . 31 1 1 A 81 81 ASN C C 81 179.262 177.514 1.748 1
1 939 . 31 1 1 A 81 81 ASN CA C 81 55.504 55.617 -0.113 1
1 940 . 31 1 1 A 81 81 ASN CB C 81 37.517 37.617 -0.100 1
1 941 . 31 1 1 A 81 81 ASN N N 81 119.338 117.087 2.251 1
1 943 . 31 1 1 A 82 82 CYS H H 82 8.554 7.948 0.606 1
1 944 . 31 1 1 A 82 82 CYS HA H 82 3.792 4.030 -0.238 1
1 947 . 31 1 1 A 82 82 CYS C C 82 176.478 177.107 -0.629 1
1 948 . 31 1 1 A 82 82 CYS CA C 82 65.232 63.873 1.359 1
1 949 . 31 1 1 A 82 82 CYS CB C 82 26.762 27.091 -0.329 1
1 950 . 31 1 1 A 82 82 CYS N N 82 120.576 117.366 3.210 1
1 951 . 31 1 1 A 83 83 ARG H H 83 8.522 7.852 0.670 1
1 952 . 31 1 1 A 83 83 ARG HA H 83 3.932 4.179 -0.247 1
1 960 . 31 1 1 A 83 83 ARG C C 83 179.138 178.663 0.475 1
1 961 . 31 1 1 A 83 83 ARG CA C 83 60.443 59.075 1.368 1
1 962 . 31 1 1 A 83 83 ARG CB C 83 29.550 29.732 -0.182 1
1 965 . 31 1 1 A 83 83 ARG N N 83 123.035 120.014 3.021 1
1 967 . 31 1 1 A 84 84 ASP H H 84 7.791 8.153 -0.362 1
1 968 . 31 1 1 A 84 84 ASP HA H 84 4.353 4.395 -0.042 1
1 971 . 31 1 1 A 84 84 ASP C C 84 178.649 178.656 -0.007 1
1 972 . 31 1 1 A 84 84 ASP CA C 84 57.767 57.621 0.146 1
1 973 . 31 1 1 A 84 84 ASP CB C 84 41.305 41.657 -0.352 1
1 974 . 31 1 1 A 84 84 ASP N N 84 120.332 119.621 0.711 1
1 975 . 31 1 1 A 85 85 THR H H 85 8.370 8.431 -0.061 1
1 976 . 31 1 1 A 85 85 THR HA H 85 3.730 3.920 -0.190 1
1 981 . 31 1 1 A 85 85 THR C C 85 175.198 176.269 -1.071 1
1 982 . 31 1 1 A 85 85 THR CA C 85 66.830 66.117 0.713 1
1 983 . 31 1 1 A 85 85 THR CB C 85 68.533 68.283 0.250 1
1 985 . 31 1 1 A 85 85 THR N N 85 117.360 115.427 1.933 1
1 986 . 31 1 1 A 86 86 ALA H H 86 8.845 8.155 0.690 1
1 987 . 31 1 1 A 86 86 ALA HA H 86 3.991 4.093 -0.102 1
1 991 . 31 1 1 A 86 86 ALA C C 86 179.980 179.900 0.080 1
1 992 . 31 1 1 A 86 86 ALA CA C 86 55.769 55.699 0.070 1
1 993 . 31 1 1 A 86 86 ALA CB C 86 17.881 18.865 -0.984 1
1 994 . 31 1 1 A 86 86 ALA N N 86 123.613 123.349 0.264 1
1 995 . 31 1 1 A 87 87 LYS H H 87 7.686 8.296 -0.610 1
1 996 . 31 1 1 A 87 87 LYS HA H 87 4.099 4.000 0.099 1
1 1005 . 31 1 1 A 87 87 LYS C C 87 179.592 179.565 0.027 1
1 1006 . 31 1 1 A 87 87 LYS CA C 87 59.708 59.800 -0.092 1
1 1007 . 31 1 1 A 87 87 LYS CB C 87 32.054 32.290 -0.236 1
1 1011 . 31 1 1 A 87 87 LYS N N 87 119.623 117.350 2.273 1
1 1012 . 31 1 1 A 88 88 ARG H H 88 7.683 7.603 0.080 1
1 1013 . 31 1 1 A 88 88 ARG HA H 88 4.051 4.166 -0.115 1
1 1020 . 31 1 1 A 88 88 ARG C C 88 180.053 178.862 1.191 1
1 1021 . 31 1 1 A 88 88 ARG CA C 88 59.558 58.787 0.771 1
1 1022 . 31 1 1 A 88 88 ARG CB C 88 29.684 29.645 0.039 1
1 1025 . 31 1 1 A 88 88 ARG N N 88 120.788 118.907 1.881 1
1 1026 . 31 1 1 A 89 89 ASN H H 89 8.973 8.128 0.845 1
1 1027 . 31 1 1 A 89 89 ASN HA H 89 4.354 4.559 -0.205 1
1 1032 . 31 1 1 A 89 89 ASN C C 89 178.382 178.415 -0.033 1
1 1033 . 31 1 1 A 89 89 ASN CA C 89 55.334 55.785 -0.451 1
1 1034 . 31 1 1 A 89 89 ASN CB C 89 37.864 38.289 -0.425 1
1 1035 . 31 1 1 A 89 89 ASN N N 89 121.012 117.841 3.171 1
1 1037 . 31 1 1 A 90 90 GLN H H 90 8.152 8.169 -0.017 1
1 1038 . 31 1 1 A 90 90 GLN HA H 90 4.020 4.018 0.002 1
1 1045 . 31 1 1 A 90 90 GLN C C 90 179.075 178.365 0.710 1
1 1046 . 31 1 1 A 90 90 GLN CA C 90 59.318 58.757 0.561 1
1 1047 . 31 1 1 A 90 90 GLN CB C 90 28.049 28.082 -0.033 1
1 1049 . 31 1 1 A 90 90 GLN N N 90 122.122 120.470 1.652 1
1 1051 . 31 1 1 A 91 91 GLN H H 91 7.514 8.308 -0.794 1
1 1052 . 31 1 1 A 91 91 GLN HA H 91 4.053 4.104 -0.051 1
1 1059 . 31 1 1 A 91 91 GLN C C 91 177.081 176.686 0.395 1
1 1060 . 31 1 1 A 91 91 GLN CA C 91 58.031 57.277 0.754 1
1 1061 . 31 1 1 A 91 91 GLN CB C 91 28.365 27.414 0.951 1
1 1063 . 31 1 1 A 91 91 GLN N N 91 118.124 118.007 0.117 1
1 1065 . 31 1 1 A 92 92 ALA H H 92 7.704 7.721 -0.017 1
1 1066 . 31 1 1 A 92 92 ALA HA H 92 4.246 4.383 -0.137 1
1 1070 . 31 1 1 A 92 92 ALA C C 92 178.450 177.980 0.470 1
1 1071 . 31 1 1 A 92 92 ALA CA C 92 52.671 52.223 0.448 1
1 1072 . 31 1 1 A 92 92 ALA CB C 92 19.316 19.914 -0.598 1
1 1073 . 31 1 1 A 92 92 ALA N N 92 119.880 121.003 -1.123 1
1 1074 . 31 1 1 A 93 93 GLY H H 93 7.693 7.929 -0.236 1
1 1075 . 31 1 1 A 93 93 GLY HA2 H 93 3.941 3.855 0.086 1
1 1076 . 31 1 1 A 93 93 GLY HA3 H 93 3.744 3.859 -0.115 1
1 1077 . 31 1 1 A 93 93 GLY C C 93 174.344 173.962 0.382 1
1 1078 . 31 1 1 A 93 93 GLY CA C 93 45.949 45.755 0.194 1
1 1079 . 31 1 1 A 93 93 GLY N N 93 105.347 107.153 -1.806 1
1 1080 . 31 1 1 A 94 94 ASN H H 94 7.076 8.153 -1.077 1
1 1081 . 31 1 1 A 94 94 ASN HA H 94 4.115 4.737 -0.622 1
1 1085 . 31 1 1 A 94 94 ASN C C 94 175.410 175.405 0.005 1
1 1086 . 31 1 1 A 94 94 ASN CA C 94 52.651 52.038 0.613 1
1 1087 . 31 1 1 A 94 94 ASN CB C 94 38.330 39.742 -1.412 1
1 1088 . 31 1 1 A 94 94 ASN N N 94 115.747 119.048 -3.301 1
1 1090 . 31 1 1 A 95 95 GLY H H 95 8.236 8.733 -0.497 1
1 1091 . 31 1 1 A 95 95 GLY HA2 H 95 3.633 3.784 -0.151 1
1 1092 . 31 1 1 A 95 95 GLY HA3 H 95 3.633 3.803 -0.170 1
1 1093 . 31 1 1 A 95 95 GLY C C 95 174.450 173.419 1.031 1
1 1094 . 31 1 1 A 95 95 GLY CA C 95 45.522 46.657 -1.135 1
1 1095 . 31 1 1 A 95 95 GLY N N 95 109.166 110.036 -0.870 1
1 1096 . 31 1 1 A 96 96 TRP H H 96 7.899 7.979 -0.080 1
1 1097 . 31 1 1 A 96 96 TRP HA H 96 5.241 5.097 0.144 1
1 1106 . 31 1 1 A 96 96 TRP C C 96 175.661 175.814 -0.153 1
1 1107 . 31 1 1 A 96 96 TRP CA C 96 55.090 56.335 -1.245 1
1 1108 . 31 1 1 A 96 96 TRP CB C 96 27.138 31.970 -4.832 1
1 1114 . 31 1 1 A 96 96 TRP N N 96 122.840 121.132 1.708 1
1 1116 . 31 1 1 A 97 97 ASP H H 97 7.344 8.986 -1.642 1
1 1117 . 31 1 1 A 97 97 ASP HA H 97 4.829 4.318 0.511 1
1 1120 . 31 1 1 A 97 97 ASP C C 97 175.019 176.100 -1.081 1
1 1121 . 31 1 1 A 97 97 ASP CA C 97 52.149 56.320 -4.171 1
1 1122 . 31 1 1 A 97 97 ASP CB C 97 42.697 38.584 4.113 1
1 1123 . 31 1 1 A 97 97 ASP N N 97 126.861 117.110 9.751 1
1 1124 . 31 1 1 A 98 98 PHE H H 98 8.566 8.647 -0.081 1
1 1125 . 31 1 1 A 98 98 PHE HA H 98 3.727 4.185 -0.458 1
1 1133 . 31 1 1 A 98 98 PHE C C 98 177.443 177.325 0.118 1
1 1134 . 31 1 1 A 98 98 PHE CA C 98 62.471 61.183 1.288 1
1 1135 . 31 1 1 A 98 98 PHE CB C 98 39.919 39.847 0.072 1
1 1141 . 31 1 1 A 98 98 PHE N N 98 117.781 121.187 -3.406 1
1 1142 . 31 1 1 A 99 99 ASP H H 99 8.259 8.419 -0.160 1
1 1143 . 31 1 1 A 99 99 ASP HA H 99 3.960 4.172 -0.212 1
1 1146 . 31 1 1 A 99 99 ASP C C 99 178.132 178.383 -0.251 1
1 1147 . 31 1 1 A 99 99 ASP CA C 99 57.658 56.560 1.098 1
1 1148 . 31 1 1 A 99 99 ASP CB C 99 38.572 40.876 -2.304 1
1 1149 . 31 1 1 A 99 99 ASP N N 99 121.709 118.608 3.101 1
1 1150 . 31 1 1 A 100 100 MET H H 100 8.008 8.194 -0.186 1
1 1151 . 31 1 1 A 100 100 MET HA H 100 3.644 4.167 -0.523 1
1 1156 . 31 1 1 A 100 100 MET C C 100 180.008 177.057 2.951 1
1 1157 . 31 1 1 A 100 100 MET CA C 100 58.598 58.226 0.372 1
1 1158 . 31 1 1 A 100 100 MET CB C 100 33.423 32.933 0.490 1
1 1160 . 31 1 1 A 100 100 MET N N 100 119.668 118.113 1.555 1
1 1161 . 31 1 1 A 101 101 LEU H H 101 7.961 7.827 0.134 1
1 1162 . 31 1 1 A 101 101 LEU HA H 101 3.523 4.099 -0.576 1
1 1172 . 31 1 1 A 101 101 LEU C C 101 173.873 176.120 -2.247 1
1 1173 . 31 1 1 A 101 101 LEU CA C 101 58.743 56.084 2.659 1
1 1174 . 31 1 1 A 101 101 LEU CB C 101 42.632 42.430 0.202 1
1 1178 . 31 1 1 A 101 101 LEU N N 101 119.752 119.799 -0.047 1
1 1179 . 31 1 1 A 102 102 THR H H 102 6.955 8.541 -1.586 1
1 1180 . 31 1 1 A 102 102 THR HA H 102 4.134 4.204 -0.070 1
1 1185 . 31 1 1 A 102 102 THR C C 102 176.513 175.482 1.031 1
1 1186 . 31 1 1 A 102 102 THR CA C 102 61.125 64.078 -2.953 1
1 1187 . 31 1 1 A 102 102 THR CB C 102 71.415 67.475 3.940 1
1 1189 . 31 1 1 A 102 102 THR N N 102 124.665 117.629 7.036 1
1 1190 . 31 1 1 A 103 103 GLY H H 103 7.816 9.094 -1.278 1
1 1191 . 31 1 1 A 103 103 GLY HA2 H 103 3.824 3.987 -0.163 1
1 1192 . 31 1 1 A 103 103 GLY HA3 H 103 3.824 4.024 -0.200 1
1 1193 . 31 1 1 A 103 103 GLY C C 103 174.126 174.292 -0.166 1
1 1194 . 31 1 1 A 103 103 GLY CA C 103 47.805 47.840 -0.035 1
1 1195 . 31 1 1 A 103 103 GLY N N 103 114.191 112.495 1.696 1
1 1196 . 31 1 1 A 104 104 SER H H 104 8.860 7.744 1.116 1
1 1197 . 31 1 1 A 104 104 SER HA H 104 4.758 4.991 -0.233 1
1 1200 . 31 1 1 A 104 104 SER C C 104 174.591 174.004 0.587 1
1 1201 . 31 1 1 A 104 104 SER CA C 104 56.755 57.939 -1.184 1
1 1202 . 31 1 1 A 104 104 SER CB C 104 65.050 66.123 -1.073 1
1 1203 . 31 1 1 A 104 104 SER N N 104 114.771 111.153 3.618 1
1 1204 . 31 1 1 A 105 105 GLY H H 105 8.788 8.486 0.302 1
1 1205 . 31 1 1 A 105 105 GLY HA2 H 105 3.733 3.691 0.042 1
1 1206 . 31 1 1 A 105 105 GLY HA3 H 105 3.733 3.775 -0.042 1
1 1207 . 31 1 1 A 105 105 GLY CA C 105 47.247 46.701 0.546 1
1 1208 . 31 1 1 A 105 105 GLY N N 105 110.394 112.932 -2.538 1
1 1209 . 31 1 1 A 106 106 ASN HA H 106 4.454 4.958 -0.504 1
1 1212 . 31 1 1 A 106 106 ASN C C 106 175.180 176.170 -0.990 1
1 1213 . 31 1 1 A 106 106 ASN CA C 106 54.492 54.141 0.351 1
1 1214 . 31 1 1 A 106 106 ASN CB C 106 37.282 41.270 -3.988 1
1 1215 . 31 1 1 A 107 107 TYR H H 107 8.241 7.813 0.428 1
1 1216 . 31 1 1 A 107 107 TYR HA H 107 4.335 4.863 -0.528 1
1 1223 . 31 1 1 A 107 107 TYR C C 107 173.954 176.266 -2.312 1
1 1224 . 31 1 1 A 107 107 TYR CA C 107 57.727 56.914 0.813 1
1 1225 . 31 1 1 A 107 107 TYR CB C 107 37.063 38.348 -1.285 1
1 1230 . 31 1 1 A 107 107 TYR N N 107 120.708 113.125 7.583 1
1 1231 . 31 1 1 A 108 108 SER H H 108 7.117 7.973 -0.856 1
1 1232 . 31 1 1 A 108 108 SER HA H 108 4.221 4.186 0.035 1
1 1235 . 31 1 1 A 108 108 SER C C 108 174.834 174.270 0.564 1
1 1236 . 31 1 1 A 108 108 SER CA C 108 59.859 61.128 -1.269 1
1 1237 . 31 1 1 A 108 108 SER CB C 108 63.846 63.356 0.490 1
1 1238 . 31 1 1 A 108 108 SER N N 108 113.362 115.910 -2.548 1
1 1239 . 31 1 1 A 109 109 SER H H 109 8.053 8.138 -0.085 1
1 1240 . 31 1 1 A 109 109 SER HA H 109 4.560 4.353 0.207 1
1 1243 . 31 1 1 A 109 109 SER CA C 109 57.141 59.549 -2.408 1
1 1244 . 31 1 1 A 109 109 SER CB C 109 64.874 62.847 2.027 1
1 1245 . 31 1 1 A 109 109 SER N N 109 116.657 115.085 1.572 1
1 1246 . 31 1 1 A 110 110 THR HA H 110 3.541 3.912 -0.371 1
1 1251 . 31 1 1 A 110 110 THR C C 110 175.477 176.258 -0.781 1
1 1252 . 31 1 1 A 110 110 THR CA C 110 66.443 65.730 0.713 1
1 1253 . 31 1 1 A 110 110 THR CB C 110 68.091 68.437 -0.346 1
1 1255 . 31 1 1 A 111 111 ASP H H 111 8.224 8.191 0.033 1
1 1256 . 31 1 1 A 111 111 ASP HA H 111 4.237 4.271 -0.034 1
1 1259 . 31 1 1 A 111 111 ASP C C 111 177.520 178.387 -0.867 1
1 1260 . 31 1 1 A 111 111 ASP CA C 111 57.559 57.056 0.503 1
1 1261 . 31 1 1 A 111 111 ASP CB C 111 40.292 40.498 -0.206 1
1 1262 . 31 1 1 A 111 111 ASP N N 111 119.490 120.263 -0.773 1
1 1263 . 31 1 1 A 112 112 ALA H H 112 7.431 8.286 -0.855 1
1 1264 . 31 1 1 A 112 112 ALA HA H 112 4.191 4.060 0.131 1
1 1268 . 31 1 1 A 112 112 ALA C C 112 180.646 179.856 0.790 1
1 1269 . 31 1 1 A 112 112 ALA CA C 112 54.534 54.953 -0.419 1
1 1270 . 31 1 1 A 112 112 ALA CB C 112 18.992 18.241 0.751 1
1 1271 . 31 1 1 A 112 112 ALA N N 112 119.710 121.617 -1.907 1
1 1272 . 31 1 1 A 113 113 GLN H H 113 7.576 7.679 -0.103 1
1 1273 . 31 1 1 A 113 113 GLN HA H 113 3.562 3.936 -0.374 1
1 1278 . 31 1 1 A 113 113 GLN C C 113 176.756 178.644 -1.888 1
1 1279 . 31 1 1 A 113 113 GLN CA C 113 57.736 58.620 -0.884 1
1 1280 . 31 1 1 A 113 113 GLN CB C 113 29.110 28.153 0.957 1
1 1281 . 31 1 1 A 113 113 GLN N N 113 117.518 117.777 -0.259 1
1 1283 . 31 1 1 A 114 114 MET H H 114 8.192 8.157 0.035 1
1 1284 . 31 1 1 A 114 114 MET HA H 114 4.231 3.089 1.142 1
1 1289 . 31 1 1 A 114 114 MET C C 114 175.648 177.339 -1.691 1
1 1290 . 31 1 1 A 114 114 MET CA C 114 57.446 56.400 1.046 1
1 1291 . 31 1 1 A 114 114 MET CB C 114 33.570 31.655 1.915 1
1 1293 . 31 1 1 A 114 114 MET N N 114 111.509 118.509 -7.000 1
1 1294 . 31 1 1 A 115 115 GLN H H 115 6.940 7.065 -0.125 1
1 1295 . 31 1 1 A 115 115 GLN HA H 115 4.307 3.819 0.488 1
1 1302 . 31 1 1 A 115 115 GLN C C 115 176.270 175.449 0.821 1
1 1303 . 31 1 1 A 115 115 GLN CA C 115 54.680 58.348 -3.668 1
1 1304 . 31 1 1 A 115 115 GLN CB C 115 28.233 28.624 -0.391 1
1 1306 . 31 1 1 A 115 115 GLN N N 115 114.300 118.814 -4.514 1
1 1308 . 31 1 1 A 116 116 TYR H H 116 6.677 7.574 -0.897 1
1 1309 . 31 1 1 A 116 116 TYR HA H 116 4.193 4.122 0.071 1
1 1312 . 31 1 1 A 116 116 TYR C C 116 175.268 174.412 0.856 1
1 1313 . 31 1 1 A 116 116 TYR CA C 116 54.357 58.983 -4.626 1
1 1314 . 31 1 1 A 116 116 TYR CB C 116 35.498 35.119 0.379 1
1 1315 . 31 1 1 A 116 116 TYR N N 116 117.919 115.869 2.050 1
1 1316 . 31 1 1 A 117 117 ASP H H 117 8.081 7.792 0.289 1
1 1317 . 31 1 1 A 117 117 ASP HA H 117 4.665 4.605 0.060 1
1 1320 . 31 1 1 A 117 117 ASP CA C 117 52.422 52.083 0.339 1
1 1321 . 31 1 1 A 117 117 ASP CB C 117 42.416 42.087 0.329 1
1 1322 . 31 1 1 A 117 117 ASP N N 117 120.887 121.000 -0.113 1
1 1323 . 31 1 1 A 118 118 PRO C C 118 179.180 178.808 0.372 1
1 1324 . 31 1 1 A 118 118 PRO CA C 118 65.942 66.077 -0.135 1
1 1325 . 31 1 1 A 118 118 PRO CB C 118 32.197 32.007 0.190 1
1 1326 . 31 1 1 A 119 119 GLY H H 119 9.742 8.155 1.587 1
1 1327 . 31 1 1 A 119 119 GLY C C 119 175.622 175.365 0.257 1
1 1328 . 31 1 1 A 119 119 GLY CA C 119 46.785 46.687 0.098 1
1 1329 . 31 1 1 A 119 119 GLY N N 119 106.412 106.024 0.388 1
1 1330 . 31 1 1 A 120 120 LEU H H 120 6.666 7.135 -0.469 1
1 1331 . 31 1 1 A 120 120 LEU HA H 120 3.365 3.655 -0.290 1
1 1341 . 31 1 1 A 120 120 LEU C C 120 179.262 178.632 0.630 1
1 1342 . 31 1 1 A 120 120 LEU CA C 120 56.605 56.820 -0.215 1
1 1343 . 31 1 1 A 120 120 LEU CB C 120 39.262 40.953 -1.691 1
1 1347 . 31 1 1 A 120 120 LEU N N 120 126.226 122.219 4.007 1
1 1348 . 31 1 1 A 121 121 PHE H H 121 7.356 8.543 -1.187 1
1 1349 . 31 1 1 A 121 121 PHE HA H 121 4.459 4.001 0.458 1
1 1352 . 31 1 1 A 121 121 PHE C C 121 179.716 178.245 1.471 1
1 1353 . 31 1 1 A 121 121 PHE CA C 121 62.838 62.138 0.700 1
1 1354 . 31 1 1 A 121 121 PHE CB C 121 37.603 39.239 -1.636 1
1 1355 . 31 1 1 A 121 121 PHE N N 121 117.437 119.159 -1.722 1
1 1356 . 31 1 1 A 122 122 ALA H H 122 7.926 8.057 -0.131 1
1 1357 . 31 1 1 A 122 122 ALA HA H 122 4.523 4.052 0.471 1
1 1361 . 31 1 1 A 122 122 ALA C C 122 180.435 179.483 0.952 1
1 1362 . 31 1 1 A 122 122 ALA CA C 122 55.527 54.876 0.651 1
1 1363 . 31 1 1 A 122 122 ALA CB C 122 17.814 18.318 -0.504 1
1 1364 . 31 1 1 A 122 122 ALA N N 122 121.068 121.415 -0.347 1
1 1365 . 31 1 1 A 123 123 GLN H H 123 7.507 7.597 -0.090 1
1 1366 . 31 1 1 A 123 123 GLN HA H 123 4.153 4.020 0.133 1
1 1371 . 31 1 1 A 123 123 GLN C C 123 180.561 178.691 1.870 1
1 1372 . 31 1 1 A 123 123 GLN CA C 123 59.948 58.992 0.956 1
1 1373 . 31 1 1 A 123 123 GLN CB C 123 29.135 28.518 0.617 1
1 1375 . 31 1 1 A 123 123 GLN N N 123 120.324 117.561 2.763 1
1 1376 . 31 1 1 A 124 124 ILE H H 124 8.318 8.007 0.311 1
1 1377 . 31 1 1 A 124 124 ILE HA H 124 3.635 3.879 -0.244 1
1 1387 . 31 1 1 A 124 124 ILE C C 124 176.481 178.092 -1.611 1
1 1388 . 31 1 1 A 124 124 ILE CA C 124 66.432 64.506 1.926 1
1 1389 . 31 1 1 A 124 124 ILE CB C 124 39.168 37.785 1.383 1
1 1393 . 31 1 1 A 124 124 ILE N N 124 123.747 118.364 5.383 1
1 1394 . 31 1 1 A 125 125 GLN H H 125 8.474 7.853 0.621 1
1 1395 . 31 1 1 A 125 125 GLN HA H 125 4.264 3.898 0.366 1
1 1402 . 31 1 1 A 125 125 GLN C C 125 178.947 178.066 0.881 1
1 1403 . 31 1 1 A 125 125 GLN CA C 125 59.651 58.378 1.273 1
1 1404 . 31 1 1 A 125 125 GLN CB C 125 28.880 28.691 0.189 1
1 1406 . 31 1 1 A 125 125 GLN N N 125 120.368 121.128 -0.760 1
1 1408 . 31 1 1 A 126 126 ALA H H 126 8.002 7.603 0.399 1
1 1409 . 31 1 1 A 126 126 ALA HA H 126 4.144 4.055 0.089 1
1 1413 . 31 1 1 A 126 126 ALA C C 126 179.316 179.746 -0.430 1
1 1414 . 31 1 1 A 126 126 ALA CA C 126 55.036 54.801 0.235 1
1 1415 . 31 1 1 A 126 126 ALA CB C 126 18.087 18.247 -0.160 1
1 1416 . 31 1 1 A 126 126 ALA N N 126 121.661 120.738 0.923 1
1 1417 . 31 1 1 A 127 127 ALA H H 127 7.823 8.111 -0.288 1
1 1418 . 31 1 1 A 127 127 ALA HA H 127 4.162 4.065 0.097 1
1 1422 . 31 1 1 A 127 127 ALA C C 127 180.707 179.496 1.211 1
1 1423 . 31 1 1 A 127 127 ALA CA C 127 55.080 54.894 0.186 1
1 1424 . 31 1 1 A 127 127 ALA CB C 127 19.354 18.209 1.145 1
1 1425 . 31 1 1 A 127 127 ALA N N 127 119.853 119.809 0.044 1
1 1426 . 31 1 1 A 128 128 ALA H H 128 8.936 7.647 1.289 1
1 1427 . 31 1 1 A 128 128 ALA HA H 128 3.928 3.677 0.251 1
1 1431 . 31 1 1 A 128 128 ALA C C 128 181.031 179.477 1.554 1
1 1432 . 31 1 1 A 128 128 ALA CA C 128 55.502 54.612 0.890 1
1 1433 . 31 1 1 A 128 128 ALA CB C 128 16.609 17.829 -1.220 1
1 1434 . 31 1 1 A 128 128 ALA N N 128 121.355 120.183 1.172 1
1 1435 . 31 1 1 A 129 129 THR H H 129 8.543 7.414 1.129 1
1 1436 . 31 1 1 A 129 129 THR HA H 129 4.015 3.664 0.351 1
1 1441 . 31 1 1 A 129 129 THR C C 129 177.332 176.273 1.059 1
1 1442 . 31 1 1 A 129 129 THR CA C 129 65.893 65.099 0.794 1
1 1443 . 31 1 1 A 129 129 THR CB C 129 68.566 68.589 -0.023 1
1 1445 . 31 1 1 A 129 129 THR N N 129 112.709 112.246 0.463 1
1 1446 . 31 1 1 A 130 130 LYS H H 130 8.126 7.434 0.692 1
1 1447 . 31 1 1 A 130 130 LYS HA H 130 4.000 3.981 0.019 1
1 1456 . 31 1 1 A 130 130 LYS C C 130 179.082 178.473 0.609 1
1 1457 . 31 1 1 A 130 130 LYS CA C 130 60.299 58.793 1.506 1
1 1458 . 31 1 1 A 130 130 LYS CB C 130 32.767 32.125 0.642 1
1 1462 . 31 1 1 A 130 130 LYS N N 130 123.879 120.444 3.435 1
1 1463 . 31 1 1 A 131 131 ALA H H 131 7.184 7.847 -0.663 1
1 1464 . 31 1 1 A 131 131 ALA HA H 131 4.005 4.213 -0.208 1
1 1468 . 31 1 1 A 131 131 ALA C C 131 178.482 179.557 -1.075 1
1 1469 . 31 1 1 A 131 131 ALA CA C 131 55.027 55.193 -0.166 1
1 1470 . 31 1 1 A 131 131 ALA CB C 131 18.669 19.354 -0.685 1
1 1471 . 31 1 1 A 131 131 ALA N N 131 118.590 120.732 -2.142 1
1 1472 . 31 1 1 A 132 132 TRP H H 132 7.977 8.586 -0.609 1
1 1473 . 31 1 1 A 132 132 TRP HA H 132 4.001 4.034 -0.033 1
1 1480 . 31 1 1 A 132 132 TRP C C 132 177.332 175.664 1.668 1
1 1481 . 31 1 1 A 132 132 TRP CA C 132 60.431 57.289 3.142 1
1 1482 . 31 1 1 A 132 132 TRP CB C 132 27.786 27.584 0.202 1
1 1486 . 31 1 1 A 132 132 TRP N N 132 119.168 116.944 2.224 1
1 1488 . 31 1 1 A 133 133 ARG H H 133 8.006 8.038 -0.032 1
1 1489 . 31 1 1 A 133 133 ARG HA H 133 4.027 4.447 -0.420 1
1 1497 . 31 1 1 A 133 133 ARG C C 133 176.664 178.396 -1.732 1
1 1498 . 31 1 1 A 133 133 ARG CA C 133 59.355 57.126 2.229 1
1 1499 . 31 1 1 A 133 133 ARG CB C 133 30.451 32.322 -1.871 1
1 1502 . 31 1 1 A 133 133 ARG N N 133 113.062 120.619 -7.557 1
1 1504 . 31 1 1 A 134 134 LYS H H 134 7.322 7.940 -0.618 1
1 1505 . 31 1 1 A 134 134 LYS HA H 134 4.313 4.205 0.108 1
1 1514 . 31 1 1 A 134 134 LYS C C 134 176.282 177.313 -1.031 1
1 1515 . 31 1 1 A 134 134 LYS CA C 134 54.922 57.661 -2.739 1
1 1516 . 31 1 1 A 134 134 LYS CB C 134 32.633 32.093 0.540 1
1 1520 . 31 1 1 A 134 134 LYS N N 134 118.170 119.819 -1.649 1
1 1521 . 31 1 1 A 135 135 LEU H H 135 7.440 7.944 -0.504 1
1 1522 . 31 1 1 A 135 135 LEU HA H 135 4.174 4.499 -0.325 1
1 1532 . 31 1 1 A 135 135 LEU CA C 135 54.408 53.131 1.277 1
1 1533 . 31 1 1 A 135 135 LEU CB C 135 40.407 41.587 -1.180 1
1 1537 . 31 1 1 A 135 135 LEU N N 135 123.358 121.853 1.505 1
1 1538 . 31 1 1 A 136 136 PRO HA H 136 4.437 4.554 -0.117 1
1 1545 . 31 1 1 A 136 136 PRO C C 136 177.106 176.513 0.593 1
1 1546 . 31 1 1 A 136 136 PRO CA C 136 62.889 64.514 -1.625 1
1 1547 . 31 1 1 A 136 136 PRO CB C 136 32.192 32.227 -0.035 1
1 1550 . 31 1 1 A 137 137 VAL H H 137 8.219 7.577 0.642 1
1 1551 . 31 1 1 A 137 137 VAL HA H 137 4.077 4.817 -0.740 1
1 1559 . 31 1 1 A 137 137 VAL C C 137 176.305 175.296 1.009 1
1 1560 . 31 1 1 A 137 137 VAL CA C 137 61.958 60.563 1.395 1
1 1561 . 31 1 1 A 137 137 VAL CB C 137 32.755 35.080 -2.325 1
1 1564 . 31 1 1 A 137 137 VAL N N 137 120.079 117.841 2.238 1
1 1565 . 31 1 1 A 138 138 LYS H H 138 8.444 8.702 -0.258 1
1 1566 . 31 1 1 A 138 138 LYS HA H 138 4.316 4.484 -0.168 1
1 1575 . 31 1 1 A 138 138 LYS C C 138 176.790 176.364 0.426 1
1 1576 . 31 1 1 A 138 138 LYS CA C 138 56.792 57.119 -0.327 1
1 1577 . 31 1 1 A 138 138 LYS CB C 138 33.205 35.339 -2.134 1
1 1581 . 31 1 1 A 138 138 LYS N N 138 126.449 125.601 0.848 1
1 1582 . 31 1 1 A 139 139 GLY H H 139 8.518 7.843 0.675 1
1 1583 . 31 1 1 A 139 139 GLY HA2 H 139 4.070 3.832 0.238 1
1 1584 . 31 1 1 A 139 139 GLY HA3 H 139 3.897 3.843 0.054 1
1 1585 . 31 1 1 A 139 139 GLY C C 139 172.874 172.632 0.242 1
1 1586 . 31 1 1 A 139 139 GLY CA C 139 45.157 45.754 -0.597 1
1 1587 . 31 1 1 A 139 139 GLY N N 139 112.617 107.064 5.553 1
1 6 . 32 1 1 A 2 2 VAL H H 2 8.992 7.919 1.073 1
1 7 . 32 1 1 A 2 2 VAL HA H 2 5.370 4.288 1.082 1
1 15 . 32 1 1 A 2 2 VAL C C 2 174.325 174.523 -0.198 1
1 16 . 32 1 1 A 2 2 VAL CA C 2 61.267 61.176 0.091 1
1 17 . 32 1 1 A 2 2 VAL CB C 2 33.890 33.300 0.590 1
1 20 . 32 1 1 A 2 2 VAL N N 2 126.939 116.065 10.874 1
1 21 . 32 1 1 A 3 3 THR H H 3 8.912 8.872 0.040 1
1 22 . 32 1 1 A 3 3 THR HA H 3 4.505 5.131 -0.626 1
1 27 . 32 1 1 A 3 3 THR C C 3 172.710 173.188 -0.478 1
1 28 . 32 1 1 A 3 3 THR CA C 3 59.689 60.155 -0.466 1
1 29 . 32 1 1 A 3 3 THR CB C 3 72.398 71.228 1.170 1
1 31 . 32 1 1 A 3 3 THR N N 3 118.091 123.108 -5.017 1
1 32 . 32 1 1 A 4 4 GLU H H 4 8.631 9.082 -0.451 1
1 33 . 32 1 1 A 4 4 GLU HA H 4 5.788 4.916 0.872 1
1 38 . 32 1 1 A 4 4 GLU C C 4 175.758 173.920 1.838 1
1 39 . 32 1 1 A 4 4 GLU CA C 4 54.902 54.310 0.592 1
1 40 . 32 1 1 A 4 4 GLU CB C 4 35.097 33.092 2.005 1
1 42 . 32 1 1 A 4 4 GLU N N 4 120.966 125.574 -4.608 1
1 43 . 32 1 1 A 5 5 THR H H 5 9.188 8.301 0.887 1
1 44 . 32 1 1 A 5 5 THR HA H 5 4.739 4.721 0.018 1
1 49 . 32 1 1 A 5 5 THR C C 5 172.757 171.988 0.769 1
1 50 . 32 1 1 A 5 5 THR CA C 5 60.382 60.147 0.235 1
1 51 . 32 1 1 A 5 5 THR CB C 5 71.558 70.270 1.288 1
1 53 . 32 1 1 A 5 5 THR N N 5 119.366 114.828 4.538 1
1 54 . 32 1 1 A 6 6 VAL H H 6 8.476 8.563 -0.087 1
1 55 . 32 1 1 A 6 6 VAL HA H 6 5.026 5.362 -0.336 1
1 63 . 32 1 1 A 6 6 VAL C C 6 176.674 174.934 1.740 1
1 64 . 32 1 1 A 6 6 VAL CA C 6 61.008 60.933 0.075 1
1 65 . 32 1 1 A 6 6 VAL CB C 6 33.861 35.421 -1.560 1
1 68 . 32 1 1 A 6 6 VAL N N 6 121.384 122.284 -0.900 1
1 69 . 32 1 1 A 7 7 ASP H H 7 8.848 8.960 -0.112 1
1 70 . 32 1 1 A 7 7 ASP HA H 7 4.797 4.805 -0.008 1
1 73 . 32 1 1 A 7 7 ASP CA C 7 52.834 55.168 -2.334 1
1 74 . 32 1 1 A 7 7 ASP CB C 7 42.219 42.532 -0.313 1
1 75 . 32 1 1 A 7 7 ASP N N 7 127.061 126.954 0.107 1
1 76 . 32 1 1 A 8 8 GLY C C 8 175.143 174.459 0.684 1
1 77 . 32 1 1 A 8 8 GLY CA C 8 46.553 46.728 -0.175 1
1 78 . 32 1 1 A 9 9 GLN H H 9 8.408 7.637 0.771 1
1 79 . 32 1 1 A 9 9 GLN HA H 9 4.541 4.238 0.303 1
1 86 . 32 1 1 A 9 9 GLN C C 9 176.463 176.957 -0.494 1
1 87 . 32 1 1 A 9 9 GLN CA C 9 55.167 55.208 -0.041 1
1 88 . 32 1 1 A 9 9 GLN CB C 9 29.376 28.080 1.296 1
1 90 . 32 1 1 A 9 9 GLN N N 9 118.300 116.230 2.070 1
1 92 . 32 1 1 A 10 10 GLY H H 10 8.162 8.942 -0.780 1
1 93 . 32 1 1 A 10 10 GLY HA2 H 10 4.174 3.941 0.233 1
1 94 . 32 1 1 A 10 10 GLY HA3 H 10 3.521 3.948 -0.427 1
1 95 . 32 1 1 A 10 10 GLY C C 10 174.092 173.560 0.532 1
1 96 . 32 1 1 A 10 10 GLY CA C 10 45.558 46.511 -0.953 1
1 97 . 32 1 1 A 10 10 GLY N N 10 108.747 111.068 -2.321 1
1 98 . 32 1 1 A 11 11 GLN H H 11 8.507 7.529 0.978 1
1 99 . 32 1 1 A 11 11 GLN HA H 11 4.202 4.906 -0.704 1
1 106 . 32 1 1 A 11 11 GLN C C 11 173.992 173.809 0.183 1
1 107 . 32 1 1 A 11 11 GLN CA C 11 55.098 53.728 1.370 1
1 108 . 32 1 1 A 11 11 GLN CB C 11 29.097 31.880 -2.783 1
1 110 . 32 1 1 A 11 11 GLN N N 11 122.979 115.089 7.890 1
1 112 . 32 1 1 A 12 12 ALA H H 12 8.259 8.594 -0.335 1
1 113 . 32 1 1 A 12 12 ALA HA H 12 5.156 5.606 -0.450 1
1 117 . 32 1 1 A 12 12 ALA C C 12 177.284 175.981 1.303 1
1 118 . 32 1 1 A 12 12 ALA CA C 12 51.087 50.159 0.928 1
1 119 . 32 1 1 A 12 12 ALA CB C 12 20.500 21.109 -0.609 1
1 120 . 32 1 1 A 12 12 ALA N N 12 127.100 121.883 5.217 1
1 121 . 32 1 1 A 13 13 TRP H H 13 9.245 8.512 0.733 1
1 122 . 32 1 1 A 13 13 TRP HA H 13 4.717 5.263 -0.546 1
1 131 . 32 1 1 A 13 13 TRP C C 13 175.108 174.247 0.861 1
1 132 . 32 1 1 A 13 13 TRP CA C 13 55.966 55.440 0.526 1
1 133 . 32 1 1 A 13 13 TRP CB C 13 31.912 32.129 -0.217 1
1 139 . 32 1 1 A 13 13 TRP N N 13 123.088 119.160 3.928 1
1 141 . 32 1 1 A 14 14 ARG H H 14 8.575 8.640 -0.065 1
1 142 . 32 1 1 A 14 14 ARG HA H 14 5.335 4.414 0.921 1
1 150 . 32 1 1 A 14 14 ARG C C 14 175.191 174.029 1.162 1
1 151 . 32 1 1 A 14 14 ARG CA C 14 53.106 54.909 -1.803 1
1 152 . 32 1 1 A 14 14 ARG CB C 14 32.749 31.654 1.095 1
1 154 . 32 1 1 A 14 14 ARG N N 14 121.163 120.342 0.821 1
1 156 . 32 1 1 A 15 15 HIS H H 15 8.595 8.011 0.584 1
1 157 . 32 1 1 A 15 15 HIS HA H 15 4.790 5.212 -0.422 1
1 161 . 32 1 1 A 15 15 HIS C C 15 173.770 174.280 -0.510 1
1 162 . 32 1 1 A 15 15 HIS CA C 15 55.289 54.873 0.416 1
1 163 . 32 1 1 A 15 15 HIS CB C 15 33.208 33.500 -0.292 1
1 165 . 32 1 1 A 15 15 HIS N N 15 117.643 119.207 -1.564 1
1 166 . 32 1 1 A 16 16 HIS H H 16 8.993 9.320 -0.327 1
1 167 . 32 1 1 A 16 16 HIS HA H 16 5.158 4.701 0.457 1
1 171 . 32 1 1 A 16 16 HIS C C 16 173.608 174.368 -0.760 1
1 172 . 32 1 1 A 16 16 HIS CA C 16 56.450 56.412 0.038 1
1 173 . 32 1 1 A 16 16 HIS CB C 16 34.171 30.652 3.519 1
1 175 . 32 1 1 A 16 16 HIS N N 16 123.520 120.255 3.265 1
1 176 . 32 1 1 A 17 17 ASN H H 17 7.829 9.032 -1.203 1
1 177 . 32 1 1 A 17 17 ASN HA H 17 4.713 5.238 -0.525 1
1 182 . 32 1 1 A 17 17 ASN C C 17 173.682 174.417 -0.735 1
1 183 . 32 1 1 A 17 17 ASN CA C 17 51.822 51.878 -0.056 1
1 184 . 32 1 1 A 17 17 ASN CB C 17 43.176 42.415 0.761 1
1 185 . 32 1 1 A 17 17 ASN N N 17 122.213 119.863 2.350 1
1 187 . 32 1 1 A 18 18 GLY H H 18 8.423 8.722 -0.299 1
1 188 . 32 1 1 A 18 18 GLY HA2 H 18 3.931 4.045 -0.114 1
1 189 . 32 1 1 A 18 18 GLY HA3 H 18 3.707 4.130 -0.423 1
1 190 . 32 1 1 A 18 18 GLY C C 18 173.985 173.925 0.060 1
1 191 . 32 1 1 A 18 18 GLY CA C 18 43.949 46.161 -2.212 1
1 192 . 32 1 1 A 18 18 GLY N N 18 106.991 110.335 -3.344 1
1 193 . 32 1 1 A 19 19 PHE H H 19 8.338 8.964 -0.626 1
1 194 . 32 1 1 A 19 19 PHE HA H 19 4.068 4.607 -0.539 1
1 197 . 32 1 1 A 19 19 PHE C C 19 176.568 175.387 1.181 1
1 198 . 32 1 1 A 19 19 PHE CA C 19 59.338 59.157 0.181 1
1 199 . 32 1 1 A 19 19 PHE CB C 19 40.201 39.739 0.462 1
1 200 . 32 1 1 A 19 19 PHE N N 19 116.857 125.140 -8.283 1
1 201 . 32 1 1 A 20 20 ASP H H 20 8.794 8.976 -0.182 1
1 202 . 32 1 1 A 20 20 ASP HA H 20 4.485 4.750 -0.265 1
1 205 . 32 1 1 A 20 20 ASP C C 20 177.379 177.179 0.200 1
1 206 . 32 1 1 A 20 20 ASP CA C 20 54.140 54.995 -0.855 1
1 207 . 32 1 1 A 20 20 ASP CB C 20 41.915 40.924 0.991 1
1 208 . 32 1 1 A 20 20 ASP N N 20 123.025 123.638 -0.613 1
1 209 . 32 1 1 A 21 21 PHE H H 21 8.862 9.151 -0.289 1
1 210 . 32 1 1 A 21 21 PHE HA H 21 4.087 4.126 -0.039 1
1 218 . 32 1 1 A 21 21 PHE C C 21 176.952 177.125 -0.173 1
1 219 . 32 1 1 A 21 21 PHE CA C 21 61.095 61.770 -0.675 1
1 220 . 32 1 1 A 21 21 PHE CB C 21 38.678 39.397 -0.719 1
1 226 . 32 1 1 A 21 21 PHE N N 21 127.163 125.575 1.588 1
1 227 . 32 1 1 A 22 22 ALA H H 22 8.561 8.359 0.202 1
1 228 . 32 1 1 A 22 22 ALA HA H 22 3.878 3.958 -0.080 1
1 232 . 32 1 1 A 22 22 ALA C C 22 180.710 180.173 0.537 1
1 233 . 32 1 1 A 22 22 ALA CA C 22 55.211 55.172 0.039 1
1 234 . 32 1 1 A 22 22 ALA CB C 22 18.321 18.252 0.069 1
1 235 . 32 1 1 A 22 22 ALA N N 22 120.293 121.210 -0.917 1
1 236 . 32 1 1 A 23 23 VAL H H 23 7.241 7.600 -0.359 1
1 237 . 32 1 1 A 23 23 VAL HA H 23 3.684 3.474 0.210 1
1 245 . 32 1 1 A 23 23 VAL C C 23 177.101 178.155 -1.054 1
1 246 . 32 1 1 A 23 23 VAL CA C 23 65.237 66.949 -1.712 1
1 247 . 32 1 1 A 23 23 VAL CB C 23 31.780 31.655 0.125 1
1 250 . 32 1 1 A 23 23 VAL N N 23 118.775 117.985 0.790 1
1 251 . 32 1 1 A 24 24 ILE H H 24 6.761 8.236 -1.475 1
1 252 . 32 1 1 A 24 24 ILE HA H 24 3.196 3.553 -0.357 1
1 262 . 32 1 1 A 24 24 ILE C C 24 177.287 178.007 -0.720 1
1 263 . 32 1 1 A 24 24 ILE CA C 24 63.404 65.125 -1.721 1
1 264 . 32 1 1 A 24 24 ILE CB C 24 36.294 37.236 -0.942 1
1 268 . 32 1 1 A 24 24 ILE N N 24 119.036 118.966 0.070 1
1 269 . 32 1 1 A 25 25 LYS H H 25 8.032 7.861 0.171 1
1 270 . 32 1 1 A 25 25 LYS HA H 25 3.809 3.625 0.184 1
1 279 . 32 1 1 A 25 25 LYS C C 25 179.450 177.180 2.270 1
1 280 . 32 1 1 A 25 25 LYS CA C 25 59.621 59.014 0.607 1
1 281 . 32 1 1 A 25 25 LYS CB C 25 32.259 31.880 0.379 1
1 285 . 32 1 1 A 25 25 LYS N N 25 118.368 121.074 -2.706 1
1 286 . 32 1 1 A 26 26 GLU H H 26 7.845 7.861 -0.016 1
1 287 . 32 1 1 A 26 26 GLU HA H 26 4.021 4.526 -0.505 1
1 292 . 32 1 1 A 26 26 GLU C C 26 179.191 178.839 0.352 1
1 293 . 32 1 1 A 26 26 GLU CA C 26 59.530 58.860 0.670 1
1 294 . 32 1 1 A 26 26 GLU CB C 26 29.449 29.525 -0.076 1
1 296 . 32 1 1 A 26 26 GLU N N 26 120.522 119.012 1.510 1
1 297 . 32 1 1 A 27 27 LEU H H 27 8.165 7.889 0.276 1
1 298 . 32 1 1 A 27 27 LEU HA H 27 4.163 4.075 0.088 1
1 308 . 32 1 1 A 27 27 LEU C C 27 177.256 178.323 -1.067 1
1 309 . 32 1 1 A 27 27 LEU CA C 27 58.049 57.605 0.444 1
1 310 . 32 1 1 A 27 27 LEU CB C 27 41.365 41.325 0.040 1
1 314 . 32 1 1 A 27 27 LEU N N 27 120.879 120.984 -0.105 1
1 315 . 32 1 1 A 28 28 LYS H H 28 8.902 7.716 1.186 1
1 316 . 32 1 1 A 28 28 LYS HA H 28 4.199 4.412 -0.213 1
1 317 . 32 1 1 A 28 28 LYS C C 28 179.707 179.248 0.459 1
1 318 . 32 1 1 A 28 28 LYS CA C 28 60.097 59.016 1.081 1
1 319 . 32 1 1 A 28 28 LYS CB C 28 33.420 31.645 1.775 1
1 320 . 32 1 1 A 28 28 LYS N N 28 120.050 119.300 0.750 1
1 321 . 32 1 1 A 29 29 THR H H 29 8.294 8.139 0.155 1
1 322 . 32 1 1 A 29 29 THR HA H 29 3.892 3.975 -0.083 1
1 327 . 32 1 1 A 29 29 THR C C 29 175.711 177.193 -1.482 1
1 328 . 32 1 1 A 29 29 THR CA C 29 66.846 66.460 0.386 1
1 329 . 32 1 1 A 29 29 THR CB C 29 68.794 68.755 0.039 1
1 331 . 32 1 1 A 29 29 THR N N 29 115.933 116.594 -0.661 1
1 332 . 32 1 1 A 30 30 ALA H H 30 8.244 8.361 -0.117 1
1 333 . 32 1 1 A 30 30 ALA HA H 30 4.241 4.325 -0.084 1
1 337 . 32 1 1 A 30 30 ALA C C 30 179.128 179.797 -0.669 1
1 338 . 32 1 1 A 30 30 ALA CA C 30 55.714 55.368 0.346 1
1 339 . 32 1 1 A 30 30 ALA CB C 30 18.955 18.549 0.406 1
1 340 . 32 1 1 A 30 30 ALA N N 30 124.617 124.001 0.616 1
1 341 . 32 1 1 A 31 31 ALA H H 31 8.968 8.272 0.696 1
1 342 . 32 1 1 A 31 31 ALA HA H 31 3.890 4.067 -0.177 1
1 346 . 32 1 1 A 31 31 ALA C C 31 180.352 179.389 0.963 1
1 347 . 32 1 1 A 31 31 ALA CA C 31 55.454 55.464 -0.010 1
1 348 . 32 1 1 A 31 31 ALA CB C 31 17.124 18.101 -0.977 1
1 349 . 32 1 1 A 31 31 ALA N N 31 119.327 120.767 -1.440 1
1 350 . 32 1 1 A 32 32 SER H H 32 7.995 7.703 0.292 1
1 351 . 32 1 1 A 32 32 SER HA H 32 4.238 4.233 0.005 1
1 354 . 32 1 1 A 32 32 SER C C 32 175.612 177.304 -1.692 1
1 355 . 32 1 1 A 32 32 SER CA C 32 61.203 61.448 -0.245 1
1 356 . 32 1 1 A 32 32 SER CB C 32 63.406 62.773 0.633 1
1 357 . 32 1 1 A 32 32 SER N N 32 111.962 113.302 -1.340 1
1 358 . 32 1 1 A 33 33 GLN H H 33 8.333 7.606 0.727 1
1 359 . 32 1 1 A 33 33 GLN HA H 33 3.992 4.124 -0.132 1
1 366 . 32 1 1 A 33 33 GLN C C 33 177.486 177.473 0.013 1
1 367 . 32 1 1 A 33 33 GLN CA C 33 58.277 58.465 -0.188 1
1 368 . 32 1 1 A 33 33 GLN CB C 33 29.140 29.466 -0.326 1
1 370 . 32 1 1 A 33 33 GLN N N 33 119.527 120.623 -1.096 1
1 372 . 32 1 1 A 34 34 TYR H H 34 8.587 8.403 0.184 1
1 373 . 32 1 1 A 34 34 TYR HA H 34 4.792 4.563 0.229 1
1 380 . 32 1 1 A 34 34 TYR C C 34 176.499 176.732 -0.233 1
1 381 . 32 1 1 A 34 34 TYR CA C 34 57.711 59.435 -1.724 1
1 382 . 32 1 1 A 34 34 TYR CB C 34 39.561 39.339 0.222 1
1 387 . 32 1 1 A 34 34 TYR N N 34 114.610 115.047 -0.437 1
1 388 . 32 1 1 A 35 35 GLY H H 35 7.346 8.455 -1.109 1
1 389 . 32 1 1 A 35 35 GLY HA2 H 35 4.785 4.103 0.682 1
1 390 . 32 1 1 A 35 35 GLY HA3 H 35 4.007 4.109 -0.102 1
1 391 . 32 1 1 A 35 35 GLY C C 35 175.796 172.925 2.871 1
1 392 . 32 1 1 A 35 35 GLY CA C 35 44.355 44.946 -0.591 1
1 393 . 32 1 1 A 35 35 GLY N N 35 108.501 106.918 1.583 1
1 394 . 32 1 1 A 36 36 ALA H H 36 9.363 8.290 1.073 1
1 395 . 32 1 1 A 36 36 ALA HA H 36 4.217 4.874 -0.657 1
1 399 . 32 1 1 A 36 36 ALA C C 36 178.039 177.790 0.249 1
1 400 . 32 1 1 A 36 36 ALA CA C 36 56.114 51.513 4.601 1
1 401 . 32 1 1 A 36 36 ALA CB C 36 19.179 20.019 -0.840 1
1 402 . 32 1 1 A 36 36 ALA N N 36 125.811 123.116 2.695 1
1 403 . 32 1 1 A 37 37 THR H H 37 8.070 8.835 -0.765 1
1 404 . 32 1 1 A 37 37 THR HA H 37 4.570 4.486 0.084 1
1 409 . 32 1 1 A 37 37 THR C C 37 173.685 174.448 -0.763 1
1 410 . 32 1 1 A 37 37 THR CA C 37 59.822 62.656 -2.834 1
1 411 . 32 1 1 A 37 37 THR CB C 37 68.267 70.536 -2.269 1
1 413 . 32 1 1 A 37 37 THR N N 37 129.410 117.002 12.408 1
1 414 . 32 1 1 A 38 38 ALA H H 38 6.853 7.374 -0.521 1
1 415 . 32 1 1 A 38 38 ALA HA H 38 4.601 4.604 -0.003 1
1 419 . 32 1 1 A 38 38 ALA CA C 38 50.758 50.563 0.195 1
1 420 . 32 1 1 A 38 38 ALA CB C 38 18.325 19.781 -1.456 1
1 421 . 32 1 1 A 38 38 ALA N N 38 124.674 125.065 -0.391 1
1 422 . 32 1 1 A 40 40 TYR HA H 40 4.032 3.985 0.047 1
1 429 . 32 1 1 A 40 40 TYR C C 40 176.456 177.209 -0.753 1
1 430 . 32 1 1 A 40 40 TYR CA C 40 61.010 61.834 -0.824 1
1 431 . 32 1 1 A 40 40 TYR CB C 40 39.286 38.610 0.676 1
1 436 . 32 1 1 A 41 41 THR H H 41 6.874 7.753 -0.879 1
1 437 . 32 1 1 A 41 41 THR HA H 41 3.616 3.711 -0.095 1
1 442 . 32 1 1 A 41 41 THR C C 41 176.930 176.625 0.305 1
1 443 . 32 1 1 A 41 41 THR CA C 41 65.557 65.422 0.135 1
1 444 . 32 1 1 A 41 41 THR CB C 41 68.228 69.020 -0.792 1
1 446 . 32 1 1 A 41 41 THR N N 41 115.143 113.811 1.332 1
1 447 . 32 1 1 A 42 42 LEU H H 42 8.623 7.318 1.305 1
1 448 . 32 1 1 A 42 42 LEU HA H 42 3.708 4.106 -0.398 1
1 458 . 32 1 1 A 42 42 LEU C C 42 178.206 179.139 -0.933 1
1 459 . 32 1 1 A 42 42 LEU CA C 42 57.417 57.659 -0.242 1
1 460 . 32 1 1 A 42 42 LEU CB C 42 41.342 41.243 0.099 1
1 464 . 32 1 1 A 42 42 LEU N N 42 120.418 119.116 1.302 1
1 465 . 32 1 1 A 43 43 ALA H H 43 7.735 8.146 -0.411 1
1 466 . 32 1 1 A 43 43 ALA HA H 43 4.020 3.950 0.070 1
1 470 . 32 1 1 A 43 43 ALA C C 43 180.826 180.531 0.295 1
1 471 . 32 1 1 A 43 43 ALA CA C 43 54.925 55.147 -0.222 1
1 472 . 32 1 1 A 43 43 ALA CB C 43 17.506 18.012 -0.506 1
1 473 . 32 1 1 A 43 43 ALA N N 43 120.203 121.916 -1.713 1
1 474 . 32 1 1 A 44 44 ILE H H 44 7.149 7.334 -0.185 1
1 475 . 32 1 1 A 44 44 ILE HA H 44 3.603 3.549 0.054 1
1 485 . 32 1 1 A 44 44 ILE C C 44 178.594 178.231 0.363 1
1 486 . 32 1 1 A 44 44 ILE CA C 44 64.782 64.607 0.175 1
1 487 . 32 1 1 A 44 44 ILE CB C 44 37.472 37.328 0.144 1
1 491 . 32 1 1 A 44 44 ILE N N 44 118.881 119.504 -0.623 1
1 492 . 32 1 1 A 45 45 VAL H H 45 7.968 7.796 0.172 1
1 493 . 32 1 1 A 45 45 VAL HA H 45 2.925 3.336 -0.411 1
1 501 . 32 1 1 A 45 45 VAL C C 45 177.023 177.014 0.009 1
1 502 . 32 1 1 A 45 45 VAL CA C 45 67.081 67.030 0.051 1
1 503 . 32 1 1 A 45 45 VAL CB C 45 30.854 30.863 -0.009 1
1 506 . 32 1 1 A 45 45 VAL N N 45 120.764 120.045 0.719 1
1 507 . 32 1 1 A 46 46 GLU H H 46 8.399 8.152 0.247 1
1 508 . 32 1 1 A 46 46 GLU HA H 46 3.848 3.885 -0.037 1
1 513 . 32 1 1 A 46 46 GLU C C 46 178.656 179.198 -0.542 1
1 514 . 32 1 1 A 46 46 GLU CA C 46 59.491 59.384 0.107 1
1 515 . 32 1 1 A 46 46 GLU CB C 46 28.991 28.858 0.133 1
1 517 . 32 1 1 A 46 46 GLU N N 46 116.599 120.011 -3.412 1
1 518 . 32 1 1 A 47 47 SER H H 47 7.273 8.151 -0.878 1
1 519 . 32 1 1 A 47 47 SER HA H 47 4.287 4.121 0.166 1
1 521 . 32 1 1 A 47 47 SER CA C 47 61.047 62.620 -1.573 1
1 522 . 32 1 1 A 47 47 SER CB C 47 63.016 62.951 0.065 1
1 523 . 32 1 1 A 47 47 SER N N 47 113.609 117.599 -3.990 1
1 524 . 32 1 1 A 48 48 VAL H H 48 8.006 8.434 -0.428 1
1 525 . 32 1 1 A 48 48 VAL HA H 48 3.556 3.530 0.026 1
1 533 . 32 1 1 A 48 48 VAL C C 48 177.257 178.204 -0.947 1
1 534 . 32 1 1 A 48 48 VAL CA C 48 65.025 65.995 -0.970 1
1 535 . 32 1 1 A 48 48 VAL CB C 48 31.841 31.143 0.698 1
1 538 . 32 1 1 A 48 48 VAL N N 48 122.327 121.462 0.865 1
1 539 . 32 1 1 A 49 49 ALA H H 49 8.369 7.604 0.765 1
1 540 . 32 1 1 A 49 49 ALA HA H 49 4.115 4.069 0.046 1
1 544 . 32 1 1 A 49 49 ALA C C 49 177.307 179.140 -1.833 1
1 545 . 32 1 1 A 49 49 ALA CA C 49 53.253 54.668 -1.415 1
1 546 . 32 1 1 A 49 49 ALA CB C 49 20.131 17.930 2.201 1
1 547 . 32 1 1 A 49 49 ALA N N 49 118.050 122.017 -3.967 1
1 548 . 32 1 1 A 50 50 ASP H H 50 7.052 7.902 -0.850 1
1 549 . 32 1 1 A 50 50 ASP HA H 50 4.788 4.641 0.147 1
1 552 . 32 1 1 A 50 50 ASP C C 50 175.481 175.826 -0.345 1
1 553 . 32 1 1 A 50 50 ASP CA C 50 53.681 54.111 -0.430 1
1 554 . 32 1 1 A 50 50 ASP CB C 50 39.333 41.043 -1.710 1
1 555 . 32 1 1 A 50 50 ASP N N 50 116.997 117.067 -0.070 1
1 556 . 32 1 1 A 51 51 ASN H H 51 8.535 7.486 1.049 1
1 557 . 32 1 1 A 51 51 ASN HA H 51 4.628 4.700 -0.072 1
1 562 . 32 1 1 A 51 51 ASN C C 51 174.077 174.787 -0.710 1
1 563 . 32 1 1 A 51 51 ASN CA C 51 52.315 51.751 0.564 1
1 564 . 32 1 1 A 51 51 ASN CB C 51 41.928 40.575 1.353 1
1 565 . 32 1 1 A 51 51 ASN N N 51 118.626 117.326 1.300 1
1 567 . 32 1 1 A 52 52 TRP H H 52 8.555 8.135 0.420 1
1 574 . 32 1 1 A 52 52 TRP C C 52 173.269 175.623 -2.354 1
1 575 . 32 1 1 A 52 52 TRP CA C 52 55.031 56.712 -1.681 1
1 576 . 32 1 1 A 52 52 TRP CB C 52 26.801 28.662 -1.861 1
1 582 . 32 1 1 A 52 52 TRP N N 52 120.693 121.788 -1.095 1
1 584 . 32 1 1 A 53 53 LEU H H 53 7.847 8.937 -1.090 1
1 585 . 32 1 1 A 53 53 LEU HA H 53 4.859 4.711 0.148 1
1 595 . 32 1 1 A 53 53 LEU C C 53 177.397 176.360 1.037 1
1 596 . 32 1 1 A 53 53 LEU CA C 53 53.619 55.435 -1.816 1
1 597 . 32 1 1 A 53 53 LEU CB C 53 41.812 42.105 -0.293 1
1 601 . 32 1 1 A 53 53 LEU N N 53 124.741 127.229 -2.488 1
1 602 . 32 1 1 A 54 54 THR H H 54 8.850 7.381 1.469 1
1 603 . 32 1 1 A 54 54 THR HA H 54 4.598 4.539 0.059 1
1 608 . 32 1 1 A 54 54 THR CA C 54 60.531 59.747 0.784 1
1 609 . 32 1 1 A 54 54 THR CB C 54 67.183 72.146 -4.963 1
1 611 . 32 1 1 A 54 54 THR N N 54 113.407 110.781 2.626 1
1 612 . 32 1 1 A 55 55 PRO HA H 55 4.511 4.324 0.187 1
1 619 . 32 1 1 A 55 55 PRO C C 55 179.383 178.806 0.577 1
1 620 . 32 1 1 A 55 55 PRO CA C 55 67.159 65.628 1.531 1
1 621 . 32 1 1 A 55 55 PRO CB C 55 32.095 31.975 0.120 1
1 622 . 32 1 1 A 56 56 THR H H 56 8.575 7.830 0.745 1
1 623 . 32 1 1 A 56 56 THR HA H 56 4.229 4.046 0.183 1
1 628 . 32 1 1 A 56 56 THR C C 56 176.668 176.016 0.652 1
1 629 . 32 1 1 A 56 56 THR CA C 56 66.943 65.588 1.355 1
1 630 . 32 1 1 A 56 56 THR CB C 56 68.129 68.469 -0.340 1
1 632 . 32 1 1 A 56 56 THR N N 56 114.855 109.964 4.891 1
1 633 . 32 1 1 A 57 57 ASP H H 57 8.730 7.967 0.763 1
1 634 . 32 1 1 A 57 57 ASP HA H 57 4.425 4.414 0.011 1
1 637 . 32 1 1 A 57 57 ASP C C 57 178.351 179.463 -1.112 1
1 638 . 32 1 1 A 57 57 ASP CA C 57 57.963 56.754 1.209 1
1 639 . 32 1 1 A 57 57 ASP CB C 57 40.134 40.446 -0.312 1
1 640 . 32 1 1 A 57 57 ASP N N 57 126.239 120.521 5.718 1
1 641 . 32 1 1 A 58 58 TRP H H 58 8.244 8.314 -0.070 1
1 642 . 32 1 1 A 58 58 TRP HA H 58 4.030 4.536 -0.506 1
1 650 . 32 1 1 A 58 58 TRP C C 58 177.432 179.363 -1.931 1
1 651 . 32 1 1 A 58 58 TRP CA C 58 62.731 60.270 2.461 1
1 652 . 32 1 1 A 58 58 TRP CB C 58 29.122 29.476 -0.354 1
1 657 . 32 1 1 A 58 58 TRP N N 58 119.241 120.078 -0.837 1
1 659 . 32 1 1 A 59 59 ASN H H 59 8.098 8.550 -0.452 1
1 660 . 32 1 1 A 59 59 ASN HA H 59 4.424 4.344 0.080 1
1 663 . 32 1 1 A 59 59 ASN C C 59 176.952 178.184 -1.232 1
1 664 . 32 1 1 A 59 59 ASN CA C 59 58.135 56.443 1.692 1
1 665 . 32 1 1 A 59 59 ASN CB C 59 40.168 37.699 2.469 1
1 666 . 32 1 1 A 59 59 ASN N N 59 115.747 117.990 -2.243 1
1 667 . 32 1 1 A 60 60 THR H H 60 8.712 8.054 0.658 1
1 668 . 32 1 1 A 60 60 THR HA H 60 3.717 3.987 -0.270 1
1 673 . 32 1 1 A 60 60 THR C C 60 176.044 176.644 -0.600 1
1 674 . 32 1 1 A 60 60 THR CA C 60 66.576 67.484 -0.908 1
1 675 . 32 1 1 A 60 60 THR CB C 60 69.251 68.521 0.730 1
1 677 . 32 1 1 A 60 60 THR N N 60 114.896 117.750 -2.854 1
1 678 . 32 1 1 A 61 61 LEU H H 61 8.485 8.480 0.005 1
1 679 . 32 1 1 A 61 61 LEU HA H 61 3.391 4.118 -0.727 1
1 689 . 32 1 1 A 61 61 LEU C C 61 177.433 178.561 -1.128 1
1 690 . 32 1 1 A 61 61 LEU CA C 61 58.354 58.576 -0.222 1
1 691 . 32 1 1 A 61 61 LEU CB C 61 41.761 42.268 -0.507 1
1 695 . 32 1 1 A 61 61 LEU N N 61 123.433 121.828 1.605 1
1 696 . 32 1 1 A 62 62 VAL H H 62 8.073 8.425 -0.352 1
1 697 . 32 1 1 A 62 62 VAL HA H 62 3.207 3.833 -0.626 1
1 705 . 32 1 1 A 62 62 VAL C C 62 177.585 177.449 0.136 1
1 706 . 32 1 1 A 62 62 VAL CA C 62 67.345 65.189 2.156 1
1 707 . 32 1 1 A 62 62 VAL CB C 62 30.905 30.586 0.319 1
1 710 . 32 1 1 A 62 62 VAL N N 62 116.018 118.476 -2.458 1
1 711 . 32 1 1 A 63 63 ARG H H 63 7.765 7.932 -0.167 1
1 712 . 32 1 1 A 63 63 ARG HA H 63 3.602 4.019 -0.417 1
1 719 . 32 1 1 A 63 63 ARG C C 63 177.818 178.257 -0.439 1
1 720 . 32 1 1 A 63 63 ARG CA C 63 58.049 57.956 0.093 1
1 721 . 32 1 1 A 63 63 ARG CB C 63 29.955 29.191 0.764 1
1 724 . 32 1 1 A 63 63 ARG N N 63 116.700 120.663 -3.963 1
1 725 . 32 1 1 A 64 64 ALA H H 64 7.574 7.626 -0.052 1
1 726 . 32 1 1 A 64 64 ALA HA H 64 4.158 4.400 -0.242 1
1 730 . 32 1 1 A 64 64 ALA C C 64 179.886 179.436 0.450 1
1 731 . 32 1 1 A 64 64 ALA CA C 64 54.007 54.046 -0.039 1
1 732 . 32 1 1 A 64 64 ALA CB C 64 19.147 19.688 -0.541 1
1 733 . 32 1 1 A 64 64 ALA N N 64 117.555 122.182 -4.627 1
1 734 . 32 1 1 A 65 65 VAL H H 65 7.554 8.262 -0.708 1
1 735 . 32 1 1 A 65 65 VAL HA H 65 4.253 3.838 0.415 1
1 743 . 32 1 1 A 65 65 VAL C C 65 174.180 176.392 -2.212 1
1 744 . 32 1 1 A 65 65 VAL CA C 65 62.683 65.337 -2.654 1
1 745 . 32 1 1 A 65 65 VAL CB C 65 33.458 31.156 2.302 1
1 748 . 32 1 1 A 65 65 VAL N N 65 110.013 115.435 -5.422 1
1 749 . 32 1 1 A 66 66 LEU H H 66 7.792 7.191 0.601 1
1 750 . 32 1 1 A 66 66 LEU HA H 66 4.790 4.799 -0.009 1
1 760 . 32 1 1 A 66 66 LEU C C 66 177.537 175.602 1.935 1
1 761 . 32 1 1 A 66 66 LEU CA C 66 52.823 52.779 0.044 1
1 762 . 32 1 1 A 66 66 LEU CB C 66 44.071 45.699 -1.628 1
1 766 . 32 1 1 A 66 66 LEU N N 66 118.967 121.385 -2.418 1
1 767 . 32 1 1 A 67 67 SER H H 67 9.208 8.387 0.821 1
1 768 . 32 1 1 A 67 67 SER HA H 67 4.414 4.940 -0.526 1
1 771 . 32 1 1 A 67 67 SER CA C 67 57.943 57.612 0.331 1
1 772 . 32 1 1 A 67 67 SER CB C 67 64.743 66.626 -1.883 1
1 773 . 32 1 1 A 67 67 SER N N 67 116.378 116.357 0.021 1
1 774 . 32 1 1 A 69 69 GLY HA2 H 69 3.916 3.792 0.124 1
1 775 . 32 1 1 A 69 69 GLY HA3 H 69 3.867 3.814 0.053 1
1 776 . 32 1 1 A 69 69 GLY C C 69 176.783 175.478 1.305 1
1 777 . 32 1 1 A 69 69 GLY CA C 69 46.977 46.513 0.464 1
1 778 . 32 1 1 A 70 70 ASP H H 70 7.674 8.088 -0.414 1
1 779 . 32 1 1 A 70 70 ASP HA H 70 4.511 3.549 0.962 1
1 782 . 32 1 1 A 70 70 ASP C C 70 178.096 178.274 -0.178 1
1 783 . 32 1 1 A 70 70 ASP CA C 70 57.262 56.328 0.934 1
1 784 . 32 1 1 A 70 70 ASP CB C 70 40.594 39.511 1.083 1
1 785 . 32 1 1 A 70 70 ASP N N 70 123.930 121.794 2.136 1
1 786 . 32 1 1 A 71 71 HIS H H 71 8.729 7.769 0.960 1
1 787 . 32 1 1 A 71 71 HIS HA H 71 4.235 4.175 0.060 1
1 790 . 32 1 1 A 71 71 HIS C C 71 176.769 176.863 -0.094 1
1 791 . 32 1 1 A 71 71 HIS CA C 71 60.041 59.846 0.195 1
1 792 . 32 1 1 A 71 71 HIS CB C 71 30.682 30.343 0.339 1
1 793 . 32 1 1 A 71 71 HIS N N 71 121.003 119.495 1.508 1
1 794 . 32 1 1 A 72 72 LEU H H 72 7.620 7.923 -0.303 1
1 795 . 32 1 1 A 72 72 LEU HA H 72 3.769 3.856 -0.087 1
1 805 . 32 1 1 A 72 72 LEU C C 72 180.275 179.186 1.089 1
1 806 . 32 1 1 A 72 72 LEU CA C 72 58.192 57.961 0.231 1
1 807 . 32 1 1 A 72 72 LEU CB C 72 41.381 41.242 0.139 1
1 811 . 32 1 1 A 72 72 LEU N N 72 118.569 118.678 -0.109 1
1 812 . 32 1 1 A 73 73 LEU H H 73 7.542 7.545 -0.003 1
1 813 . 32 1 1 A 73 73 LEU HA H 73 4.107 4.238 -0.131 1
1 823 . 32 1 1 A 73 73 LEU C C 73 179.436 179.129 0.307 1
1 824 . 32 1 1 A 73 73 LEU CA C 73 58.026 57.215 0.811 1
1 825 . 32 1 1 A 73 73 LEU CB C 73 41.638 42.148 -0.510 1
1 829 . 32 1 1 A 73 73 LEU N N 73 121.418 120.364 1.054 1
1 830 . 32 1 1 A 74 74 TRP H H 74 8.786 7.979 0.807 1
1 831 . 32 1 1 A 74 74 TRP HA H 74 3.589 5.385 -1.796 1
1 840 . 32 1 1 A 74 74 TRP C C 74 176.816 178.768 -1.952 1
1 841 . 32 1 1 A 74 74 TRP CA C 74 63.046 59.721 3.325 1
1 842 . 32 1 1 A 74 74 TRP CB C 74 28.065 28.947 -0.882 1
1 848 . 32 1 1 A 74 74 TRP N N 74 121.111 118.498 2.613 1
1 850 . 32 1 1 A 75 75 LYS H H 75 8.939 7.523 1.416 1
1 851 . 32 1 1 A 75 75 LYS HA H 75 3.055 4.139 -1.084 1
1 860 . 32 1 1 A 75 75 LYS C C 75 177.967 179.203 -1.236 1
1 861 . 32 1 1 A 75 75 LYS CA C 75 60.029 58.690 1.339 1
1 862 . 32 1 1 A 75 75 LYS CB C 75 32.533 32.775 -0.242 1
1 866 . 32 1 1 A 75 75 LYS N N 75 119.783 118.581 1.202 1
1 867 . 32 1 1 A 76 76 SER H H 76 7.832 7.862 -0.030 1
1 868 . 32 1 1 A 76 76 SER HA H 76 4.040 4.330 -0.290 1
1 871 . 32 1 1 A 76 76 SER C C 76 177.816 177.158 0.658 1
1 872 . 32 1 1 A 76 76 SER CA C 76 62.105 62.439 -0.334 1
1 873 . 32 1 1 A 76 76 SER CB C 76 62.679 62.870 -0.191 1
1 874 . 32 1 1 A 76 76 SER N N 76 113.395 116.898 -3.503 1
1 875 . 32 1 1 A 77 77 GLU H H 77 7.590 7.659 -0.069 1
1 876 . 32 1 1 A 77 77 GLU HA H 77 4.042 4.240 -0.198 1
1 881 . 32 1 1 A 77 77 GLU C C 77 177.809 178.549 -0.740 1
1 882 . 32 1 1 A 77 77 GLU CA C 77 58.270 58.722 -0.452 1
1 883 . 32 1 1 A 77 77 GLU CB C 77 29.208 29.476 -0.268 1
1 885 . 32 1 1 A 77 77 GLU N N 77 121.574 122.374 -0.800 1
1 886 . 32 1 1 A 78 78 PHE H H 78 9.081 7.843 1.238 1
1 887 . 32 1 1 A 78 78 PHE HA H 78 3.778 4.182 -0.404 1
1 895 . 32 1 1 A 78 78 PHE C C 78 178.114 177.428 0.686 1
1 896 . 32 1 1 A 78 78 PHE CA C 78 60.629 61.233 -0.604 1
1 897 . 32 1 1 A 78 78 PHE CB C 78 38.295 38.459 -0.164 1
1 902 . 32 1 1 A 78 78 PHE N N 78 122.682 122.028 0.654 1
1 903 . 32 1 1 A 79 79 PHE H H 79 8.890 8.001 0.889 1
1 904 . 32 1 1 A 79 79 PHE HA H 79 3.800 3.963 -0.163 1
1 912 . 32 1 1 A 79 79 PHE C C 79 178.354 178.192 0.162 1
1 913 . 32 1 1 A 79 79 PHE CA C 79 60.704 62.176 -1.472 1
1 914 . 32 1 1 A 79 79 PHE CB C 79 37.184 38.513 -1.329 1
1 920 . 32 1 1 A 79 79 PHE N N 79 121.056 118.097 2.959 1
1 921 . 32 1 1 A 80 80 GLU H H 80 7.793 8.151 -0.358 1
1 922 . 32 1 1 A 80 80 GLU HA H 80 4.082 4.020 0.062 1
1 927 . 32 1 1 A 80 80 GLU C C 80 179.068 179.385 -0.317 1
1 928 . 32 1 1 A 80 80 GLU CA C 80 59.735 59.773 -0.038 1
1 929 . 32 1 1 A 80 80 GLU CB C 80 28.722 29.320 -0.598 1
1 931 . 32 1 1 A 80 80 GLU N N 80 120.312 118.977 1.335 1
1 932 . 32 1 1 A 81 81 ASN H H 81 8.624 8.647 -0.023 1
1 933 . 32 1 1 A 81 81 ASN HA H 81 4.521 4.493 0.028 1
1 938 . 32 1 1 A 81 81 ASN C C 81 179.262 178.314 0.948 1
1 939 . 32 1 1 A 81 81 ASN CA C 81 55.504 56.313 -0.809 1
1 940 . 32 1 1 A 81 81 ASN CB C 81 37.517 37.638 -0.121 1
1 941 . 32 1 1 A 81 81 ASN N N 81 119.338 118.623 0.715 1
1 943 . 32 1 1 A 82 82 CYS H H 82 8.554 7.850 0.704 1
1 944 . 32 1 1 A 82 82 CYS HA H 82 3.792 3.974 -0.182 1
1 947 . 32 1 1 A 82 82 CYS C C 82 176.478 177.220 -0.742 1
1 948 . 32 1 1 A 82 82 CYS CA C 82 65.232 62.971 2.261 1
1 949 . 32 1 1 A 82 82 CYS CB C 82 26.762 27.385 -0.623 1
1 950 . 32 1 1 A 82 82 CYS N N 82 120.576 117.933 2.643 1
1 951 . 32 1 1 A 83 83 ARG H H 83 8.522 8.010 0.512 1
1 952 . 32 1 1 A 83 83 ARG HA H 83 3.932 4.143 -0.211 1
1 960 . 32 1 1 A 83 83 ARG C C 83 179.138 178.789 0.349 1
1 961 . 32 1 1 A 83 83 ARG CA C 83 60.443 58.991 1.452 1
1 962 . 32 1 1 A 83 83 ARG CB C 83 29.550 29.895 -0.345 1
1 965 . 32 1 1 A 83 83 ARG N N 83 123.035 119.925 3.110 1
1 967 . 32 1 1 A 84 84 ASP H H 84 7.791 8.254 -0.463 1
1 968 . 32 1 1 A 84 84 ASP HA H 84 4.353 4.415 -0.062 1
1 971 . 32 1 1 A 84 84 ASP C C 84 178.649 178.684 -0.035 1
1 972 . 32 1 1 A 84 84 ASP CA C 84 57.767 57.609 0.158 1
1 973 . 32 1 1 A 84 84 ASP CB C 84 41.305 41.614 -0.309 1
1 974 . 32 1 1 A 84 84 ASP N N 84 120.332 119.637 0.695 1
1 975 . 32 1 1 A 85 85 THR H H 85 8.370 7.891 0.479 1
1 976 . 32 1 1 A 85 85 THR HA H 85 3.730 3.870 -0.140 1
1 981 . 32 1 1 A 85 85 THR C C 85 175.198 176.405 -1.207 1
1 982 . 32 1 1 A 85 85 THR CA C 85 66.830 66.290 0.540 1
1 983 . 32 1 1 A 85 85 THR CB C 85 68.533 68.400 0.133 1
1 985 . 32 1 1 A 85 85 THR N N 85 117.360 115.939 1.421 1
1 986 . 32 1 1 A 86 86 ALA H H 86 8.845 8.489 0.356 1
1 987 . 32 1 1 A 86 86 ALA HA H 86 3.991 5.086 -1.095 1
1 991 . 32 1 1 A 86 86 ALA C C 86 179.980 179.709 0.271 1
1 992 . 32 1 1 A 86 86 ALA CA C 86 55.769 55.633 0.136 1
1 993 . 32 1 1 A 86 86 ALA CB C 86 17.881 18.690 -0.809 1
1 994 . 32 1 1 A 86 86 ALA N N 86 123.613 123.456 0.157 1
1 995 . 32 1 1 A 87 87 LYS H H 87 7.686 8.228 -0.542 1
1 996 . 32 1 1 A 87 87 LYS HA H 87 4.099 4.090 0.009 1
1 1005 . 32 1 1 A 87 87 LYS C C 87 179.592 179.471 0.121 1
1 1006 . 32 1 1 A 87 87 LYS CA C 87 59.708 59.593 0.115 1
1 1007 . 32 1 1 A 87 87 LYS CB C 87 32.054 32.240 -0.186 1
1 1011 . 32 1 1 A 87 87 LYS N N 87 119.623 117.416 2.207 1
1 1012 . 32 1 1 A 88 88 ARG H H 88 7.683 7.600 0.083 1
1 1013 . 32 1 1 A 88 88 ARG HA H 88 4.051 4.148 -0.097 1
1 1020 . 32 1 1 A 88 88 ARG C C 88 180.053 178.606 1.447 1
1 1021 . 32 1 1 A 88 88 ARG CA C 88 59.558 59.090 0.468 1
1 1022 . 32 1 1 A 88 88 ARG CB C 88 29.684 29.875 -0.191 1
1 1025 . 32 1 1 A 88 88 ARG N N 88 120.788 119.615 1.173 1
1 1026 . 32 1 1 A 89 89 ASN H H 89 8.973 7.760 1.213 1
1 1027 . 32 1 1 A 89 89 ASN HA H 89 4.354 4.624 -0.270 1
1 1032 . 32 1 1 A 89 89 ASN C C 89 178.382 178.218 0.164 1
1 1033 . 32 1 1 A 89 89 ASN CA C 89 55.334 55.615 -0.281 1
1 1034 . 32 1 1 A 89 89 ASN CB C 89 37.864 38.503 -0.639 1
1 1035 . 32 1 1 A 89 89 ASN N N 89 121.012 117.368 3.644 1
1 1037 . 32 1 1 A 90 90 GLN H H 90 8.152 8.569 -0.417 1
1 1038 . 32 1 1 A 90 90 GLN HA H 90 4.020 4.131 -0.111 1
1 1045 . 32 1 1 A 90 90 GLN C C 90 179.075 179.024 0.051 1
1 1046 . 32 1 1 A 90 90 GLN CA C 90 59.318 58.974 0.344 1
1 1047 . 32 1 1 A 90 90 GLN CB C 90 28.049 28.476 -0.427 1
1 1049 . 32 1 1 A 90 90 GLN N N 90 122.122 120.679 1.443 1
1 1051 . 32 1 1 A 91 91 GLN H H 91 7.514 8.210 -0.696 1
1 1052 . 32 1 1 A 91 91 GLN HA H 91 4.053 4.177 -0.124 1
1 1059 . 32 1 1 A 91 91 GLN C C 91 177.081 177.719 -0.638 1
1 1060 . 32 1 1 A 91 91 GLN CA C 91 58.031 57.377 0.654 1
1 1061 . 32 1 1 A 91 91 GLN CB C 91 28.365 27.143 1.222 1
1 1063 . 32 1 1 A 91 91 GLN N N 91 118.124 118.028 0.096 1
1 1065 . 32 1 1 A 92 92 ALA H H 92 7.704 7.748 -0.044 1
1 1066 . 32 1 1 A 92 92 ALA HA H 92 4.246 4.353 -0.107 1
1 1070 . 32 1 1 A 92 92 ALA C C 92 178.450 178.134 0.316 1
1 1071 . 32 1 1 A 92 92 ALA CA C 92 52.671 52.587 0.084 1
1 1072 . 32 1 1 A 92 92 ALA CB C 92 19.316 19.865 -0.549 1
1 1073 . 32 1 1 A 92 92 ALA N N 92 119.880 120.892 -1.012 1
1 1074 . 32 1 1 A 93 93 GLY H H 93 7.693 8.103 -0.410 1
1 1075 . 32 1 1 A 93 93 GLY HA2 H 93 3.941 3.951 -0.010 1
1 1076 . 32 1 1 A 93 93 GLY HA3 H 93 3.744 3.968 -0.224 1
1 1077 . 32 1 1 A 93 93 GLY C C 93 174.344 175.269 -0.925 1
1 1078 . 32 1 1 A 93 93 GLY CA C 93 45.949 46.419 -0.470 1
1 1079 . 32 1 1 A 93 93 GLY N N 93 105.347 106.486 -1.139 1
1 1080 . 32 1 1 A 94 94 ASN H H 94 7.076 8.388 -1.312 1
1 1081 . 32 1 1 A 94 94 ASN HA H 94 4.115 4.788 -0.673 1
1 1085 . 32 1 1 A 94 94 ASN C C 94 175.410 175.754 -0.344 1
1 1086 . 32 1 1 A 94 94 ASN CA C 94 52.651 52.794 -0.143 1
1 1087 . 32 1 1 A 94 94 ASN CB C 94 38.330 39.293 -0.963 1
1 1088 . 32 1 1 A 94 94 ASN N N 94 115.747 116.530 -0.783 1
1 1090 . 32 1 1 A 95 95 GLY H H 95 8.236 8.574 -0.338 1
1 1091 . 32 1 1 A 95 95 GLY HA2 H 95 3.633 3.804 -0.171 1
1 1092 . 32 1 1 A 95 95 GLY HA3 H 95 3.633 3.981 -0.348 1
1 1093 . 32 1 1 A 95 95 GLY C C 95 174.450 173.757 0.693 1
1 1094 . 32 1 1 A 95 95 GLY CA C 95 45.522 46.563 -1.041 1
1 1095 . 32 1 1 A 95 95 GLY N N 95 109.166 108.871 0.295 1
1 1096 . 32 1 1 A 96 96 TRP H H 96 7.899 7.968 -0.069 1
1 1097 . 32 1 1 A 96 96 TRP HA H 96 5.241 5.217 0.024 1
1 1106 . 32 1 1 A 96 96 TRP C C 96 175.661 175.809 -0.148 1
1 1107 . 32 1 1 A 96 96 TRP CA C 96 55.090 56.019 -0.929 1
1 1108 . 32 1 1 A 96 96 TRP CB C 96 27.138 33.928 -6.790 1
1 1114 . 32 1 1 A 96 96 TRP N N 96 122.840 119.981 2.859 1
1 1116 . 32 1 1 A 97 97 ASP H H 97 7.344 9.094 -1.750 1
1 1117 . 32 1 1 A 97 97 ASP HA H 97 4.829 4.615 0.214 1
1 1120 . 32 1 1 A 97 97 ASP C C 97 175.019 176.946 -1.927 1
1 1121 . 32 1 1 A 97 97 ASP CA C 97 52.149 56.422 -4.273 1
1 1122 . 32 1 1 A 97 97 ASP CB C 97 42.697 40.528 2.169 1
1 1123 . 32 1 1 A 97 97 ASP N N 97 126.861 121.623 5.238 1
1 1124 . 32 1 1 A 98 98 PHE H H 98 8.566 8.242 0.324 1
1 1125 . 32 1 1 A 98 98 PHE HA H 98 3.727 3.985 -0.258 1
1 1133 . 32 1 1 A 98 98 PHE C C 98 177.443 177.610 -0.167 1
1 1134 . 32 1 1 A 98 98 PHE CA C 98 62.471 62.134 0.337 1
1 1135 . 32 1 1 A 98 98 PHE CB C 98 39.919 39.221 0.698 1
1 1141 . 32 1 1 A 98 98 PHE N N 98 117.781 119.893 -2.112 1
1 1142 . 32 1 1 A 99 99 ASP H H 99 8.259 8.395 -0.136 1
1 1143 . 32 1 1 A 99 99 ASP HA H 99 3.960 4.734 -0.774 1
1 1146 . 32 1 1 A 99 99 ASP C C 99 178.132 178.421 -0.289 1
1 1147 . 32 1 1 A 99 99 ASP CA C 99 57.658 56.779 0.879 1
1 1148 . 32 1 1 A 99 99 ASP CB C 99 38.572 40.818 -2.246 1
1 1149 . 32 1 1 A 99 99 ASP N N 99 121.709 118.792 2.917 1
1 1150 . 32 1 1 A 100 100 MET H H 100 8.008 8.055 -0.047 1
1 1151 . 32 1 1 A 100 100 MET HA H 100 3.644 4.660 -1.016 1
1 1156 . 32 1 1 A 100 100 MET C C 100 180.008 177.278 2.730 1
1 1157 . 32 1 1 A 100 100 MET CA C 100 58.598 58.385 0.213 1
1 1158 . 32 1 1 A 100 100 MET CB C 100 33.423 32.788 0.635 1
1 1160 . 32 1 1 A 100 100 MET N N 100 119.668 117.917 1.751 1
1 1161 . 32 1 1 A 101 101 LEU H H 101 7.961 8.575 -0.614 1
1 1162 . 32 1 1 A 101 101 LEU HA H 101 3.523 4.341 -0.818 1
1 1172 . 32 1 1 A 101 101 LEU C C 101 173.873 176.546 -2.673 1
1 1173 . 32 1 1 A 101 101 LEU CA C 101 58.743 54.273 4.470 1
1 1174 . 32 1 1 A 101 101 LEU CB C 101 42.632 41.245 1.387 1
1 1178 . 32 1 1 A 101 101 LEU N N 101 119.752 119.632 0.120 1
1 1179 . 32 1 1 A 102 102 THR H H 102 6.955 8.238 -1.283 1
1 1180 . 32 1 1 A 102 102 THR HA H 102 4.134 4.369 -0.235 1
1 1185 . 32 1 1 A 102 102 THR C C 102 176.513 175.333 1.180 1
1 1186 . 32 1 1 A 102 102 THR CA C 102 61.125 62.504 -1.379 1
1 1187 . 32 1 1 A 102 102 THR CB C 102 71.415 70.541 0.874 1
1 1189 . 32 1 1 A 102 102 THR N N 102 124.665 117.074 7.591 1
1 1190 . 32 1 1 A 103 103 GLY H H 103 7.816 7.970 -0.154 1
1 1191 . 32 1 1 A 103 103 GLY HA2 H 103 3.824 3.983 -0.159 1
1 1192 . 32 1 1 A 103 103 GLY HA3 H 103 3.824 4.041 -0.217 1
1 1193 . 32 1 1 A 103 103 GLY C C 103 174.126 173.468 0.658 1
1 1194 . 32 1 1 A 103 103 GLY CA C 103 47.805 46.667 1.138 1
1 1195 . 32 1 1 A 103 103 GLY N N 103 114.191 112.100 2.091 1
1 1196 . 32 1 1 A 104 104 SER H H 104 8.860 7.911 0.949 1
1 1197 . 32 1 1 A 104 104 SER HA H 104 4.758 5.030 -0.272 1
1 1200 . 32 1 1 A 104 104 SER C C 104 174.591 172.782 1.809 1
1 1201 . 32 1 1 A 104 104 SER CA C 104 56.755 57.614 -0.859 1
1 1202 . 32 1 1 A 104 104 SER CB C 104 65.050 65.891 -0.841 1
1 1203 . 32 1 1 A 104 104 SER N N 104 114.771 110.651 4.120 1
1 1204 . 32 1 1 A 105 105 GLY H H 105 8.788 8.393 0.395 1
1 1205 . 32 1 1 A 105 105 GLY HA2 H 105 3.733 4.274 -0.541 1
1 1206 . 32 1 1 A 105 105 GLY HA3 H 105 3.733 4.321 -0.588 1
1 1207 . 32 1 1 A 105 105 GLY CA C 105 47.247 45.641 1.606 1
1 1208 . 32 1 1 A 105 105 GLY N N 105 110.394 108.313 2.081 1
1 1209 . 32 1 1 A 106 106 ASN HA H 106 4.454 5.009 -0.555 1
1 1212 . 32 1 1 A 106 106 ASN C C 106 175.180 176.096 -0.916 1
1 1213 . 32 1 1 A 106 106 ASN CA C 106 54.492 54.639 -0.147 1
1 1214 . 32 1 1 A 106 106 ASN CB C 106 37.282 40.734 -3.452 1
1 1215 . 32 1 1 A 107 107 TYR H H 107 8.241 8.190 0.051 1
1 1216 . 32 1 1 A 107 107 TYR HA H 107 4.335 4.927 -0.592 1
1 1223 . 32 1 1 A 107 107 TYR C C 107 173.954 176.806 -2.852 1
1 1224 . 32 1 1 A 107 107 TYR CA C 107 57.727 57.261 0.466 1
1 1225 . 32 1 1 A 107 107 TYR CB C 107 37.063 39.557 -2.494 1
1 1230 . 32 1 1 A 107 107 TYR N N 107 120.708 114.852 5.856 1
1 1231 . 32 1 1 A 108 108 SER H H 108 7.117 8.056 -0.939 1
1 1232 . 32 1 1 A 108 108 SER HA H 108 4.221 4.203 0.018 1
1 1235 . 32 1 1 A 108 108 SER C C 108 174.834 174.116 0.718 1
1 1236 . 32 1 1 A 108 108 SER CA C 108 59.859 61.196 -1.337 1
1 1237 . 32 1 1 A 108 108 SER CB C 108 63.846 63.036 0.810 1
1 1238 . 32 1 1 A 108 108 SER N N 108 113.362 116.685 -3.323 1
1 1239 . 32 1 1 A 109 109 SER H H 109 8.053 7.846 0.207 1
1 1240 . 32 1 1 A 109 109 SER HA H 109 4.560 4.287 0.273 1
1 1243 . 32 1 1 A 109 109 SER CA C 109 57.141 60.871 -3.730 1
1 1244 . 32 1 1 A 109 109 SER CB C 109 64.874 61.900 2.974 1
1 1245 . 32 1 1 A 109 109 SER N N 109 116.657 114.699 1.958 1
1 1246 . 32 1 1 A 110 110 THR HA H 110 3.541 4.001 -0.460 1
1 1251 . 32 1 1 A 110 110 THR C C 110 175.477 176.520 -1.043 1
1 1252 . 32 1 1 A 110 110 THR CA C 110 66.443 65.611 0.832 1
1 1253 . 32 1 1 A 110 110 THR CB C 110 68.091 68.621 -0.530 1
1 1255 . 32 1 1 A 111 111 ASP H H 111 8.224 8.040 0.184 1
1 1256 . 32 1 1 A 111 111 ASP HA H 111 4.237 4.345 -0.108 1
1 1259 . 32 1 1 A 111 111 ASP C C 111 177.520 178.956 -1.436 1
1 1260 . 32 1 1 A 111 111 ASP CA C 111 57.559 57.205 0.354 1
1 1261 . 32 1 1 A 111 111 ASP CB C 111 40.292 40.621 -0.329 1
1 1262 . 32 1 1 A 111 111 ASP N N 111 119.490 120.112 -0.622 1
1 1263 . 32 1 1 A 112 112 ALA H H 112 7.431 8.184 -0.753 1
1 1264 . 32 1 1 A 112 112 ALA HA H 112 4.191 4.155 0.036 1
1 1268 . 32 1 1 A 112 112 ALA C C 112 180.646 179.379 1.267 1
1 1269 . 32 1 1 A 112 112 ALA CA C 112 54.534 54.453 0.081 1
1 1270 . 32 1 1 A 112 112 ALA CB C 112 18.992 18.512 0.480 1
1 1271 . 32 1 1 A 112 112 ALA N N 112 119.710 121.859 -2.149 1
1 1272 . 32 1 1 A 113 113 GLN H H 113 7.576 7.488 0.088 1
1 1273 . 32 1 1 A 113 113 GLN HA H 113 3.562 4.286 -0.724 1
1 1278 . 32 1 1 A 113 113 GLN C C 113 176.756 178.350 -1.594 1
1 1279 . 32 1 1 A 113 113 GLN CA C 113 57.736 58.392 -0.656 1
1 1280 . 32 1 1 A 113 113 GLN CB C 113 29.110 28.992 0.118 1
1 1281 . 32 1 1 A 113 113 GLN N N 113 117.518 117.217 0.301 1
1 1283 . 32 1 1 A 114 114 MET H H 114 8.192 8.051 0.141 1
1 1284 . 32 1 1 A 114 114 MET HA H 114 4.231 4.973 -0.742 1
1 1289 . 32 1 1 A 114 114 MET C C 114 175.648 177.175 -1.527 1
1 1290 . 32 1 1 A 114 114 MET CA C 114 57.446 58.061 -0.615 1
1 1291 . 32 1 1 A 114 114 MET CB C 114 33.570 32.646 0.924 1
1 1293 . 32 1 1 A 114 114 MET N N 114 111.509 119.880 -8.371 1
1 1294 . 32 1 1 A 115 115 GLN H H 115 6.940 7.971 -1.031 1
1 1295 . 32 1 1 A 115 115 GLN HA H 115 4.307 4.342 -0.035 1
1 1302 . 32 1 1 A 115 115 GLN C C 115 176.270 174.172 2.098 1
1 1303 . 32 1 1 A 115 115 GLN CA C 115 54.680 54.871 -0.191 1
1 1304 . 32 1 1 A 115 115 GLN CB C 115 28.233 29.003 -0.770 1
1 1306 . 32 1 1 A 115 115 GLN N N 115 114.300 116.340 -2.040 1
1 1308 . 32 1 1 A 116 116 TYR H H 116 6.677 7.561 -0.884 1
1 1309 . 32 1 1 A 116 116 TYR HA H 116 4.193 4.738 -0.545 1
1 1312 . 32 1 1 A 116 116 TYR C C 116 175.268 174.790 0.478 1
1 1313 . 32 1 1 A 116 116 TYR CA C 116 54.357 58.028 -3.671 1
1 1314 . 32 1 1 A 116 116 TYR CB C 116 35.498 38.895 -3.397 1
1 1315 . 32 1 1 A 116 116 TYR N N 116 117.919 119.130 -1.211 1
1 1316 . 32 1 1 A 117 117 ASP H H 117 8.081 8.435 -0.354 1
1 1317 . 32 1 1 A 117 117 ASP HA H 117 4.665 4.953 -0.288 1
1 1320 . 32 1 1 A 117 117 ASP CA C 117 52.422 51.590 0.832 1
1 1321 . 32 1 1 A 117 117 ASP CB C 117 42.416 42.134 0.282 1
1 1322 . 32 1 1 A 117 117 ASP N N 117 120.887 124.322 -3.435 1
1 1323 . 32 1 1 A 118 118 PRO C C 118 179.180 177.845 1.335 1
1 1324 . 32 1 1 A 118 118 PRO CA C 118 65.942 64.665 1.277 1
1 1325 . 32 1 1 A 118 118 PRO CB C 118 32.197 31.828 0.369 1
1 1326 . 32 1 1 A 119 119 GLY H H 119 9.742 8.790 0.952 1
1 1327 . 32 1 1 A 119 119 GLY C C 119 175.622 175.489 0.133 1
1 1328 . 32 1 1 A 119 119 GLY CA C 119 46.785 46.497 0.288 1
1 1329 . 32 1 1 A 119 119 GLY N N 119 106.412 106.537 -0.125 1
1 1330 . 32 1 1 A 120 120 LEU H H 120 6.666 7.569 -0.903 1
1 1331 . 32 1 1 A 120 120 LEU HA H 120 3.365 3.830 -0.465 1
1 1341 . 32 1 1 A 120 120 LEU C C 120 179.262 178.467 0.795 1
1 1342 . 32 1 1 A 120 120 LEU CA C 120 56.605 57.268 -0.663 1
1 1343 . 32 1 1 A 120 120 LEU CB C 120 39.262 41.622 -2.360 1
1 1347 . 32 1 1 A 120 120 LEU N N 120 126.226 122.773 3.453 1
1 1348 . 32 1 1 A 121 121 PHE H H 121 7.356 9.119 -1.763 1
1 1349 . 32 1 1 A 121 121 PHE HA H 121 4.459 3.978 0.481 1
1 1352 . 32 1 1 A 121 121 PHE C C 121 179.716 177.142 2.574 1
1 1353 . 32 1 1 A 121 121 PHE CA C 121 62.838 62.195 0.643 1
1 1354 . 32 1 1 A 121 121 PHE CB C 121 37.603 39.362 -1.759 1
1 1355 . 32 1 1 A 121 121 PHE N N 121 117.437 119.593 -2.156 1
1 1356 . 32 1 1 A 122 122 ALA H H 122 7.926 7.934 -0.008 1
1 1357 . 32 1 1 A 122 122 ALA HA H 122 4.523 3.834 0.689 1
1 1361 . 32 1 1 A 122 122 ALA C C 122 180.435 179.867 0.568 1
1 1362 . 32 1 1 A 122 122 ALA CA C 122 55.527 55.259 0.268 1
1 1363 . 32 1 1 A 122 122 ALA CB C 122 17.814 17.985 -0.171 1
1 1364 . 32 1 1 A 122 122 ALA N N 122 121.068 121.271 -0.203 1
1 1365 . 32 1 1 A 123 123 GLN H H 123 7.507 7.919 -0.412 1
1 1366 . 32 1 1 A 123 123 GLN HA H 123 4.153 3.941 0.212 1
1 1371 . 32 1 1 A 123 123 GLN C C 123 180.561 179.030 1.531 1
1 1372 . 32 1 1 A 123 123 GLN CA C 123 59.948 59.131 0.817 1
1 1373 . 32 1 1 A 123 123 GLN CB C 123 29.135 28.292 0.843 1
1 1375 . 32 1 1 A 123 123 GLN N N 123 120.324 117.090 3.234 1
1 1376 . 32 1 1 A 124 124 ILE H H 124 8.318 7.976 0.342 1
1 1377 . 32 1 1 A 124 124 ILE HA H 124 3.635 3.860 -0.225 1
1 1387 . 32 1 1 A 124 124 ILE C C 124 176.481 178.069 -1.588 1
1 1388 . 32 1 1 A 124 124 ILE CA C 124 66.432 64.460 1.972 1
1 1389 . 32 1 1 A 124 124 ILE CB C 124 39.168 37.652 1.516 1
1 1393 . 32 1 1 A 124 124 ILE N N 124 123.747 118.140 5.607 1
1 1394 . 32 1 1 A 125 125 GLN H H 125 8.474 8.054 0.420 1
1 1395 . 32 1 1 A 125 125 GLN HA H 125 4.264 3.878 0.386 1
1 1402 . 32 1 1 A 125 125 GLN C C 125 178.947 177.706 1.241 1
1 1403 . 32 1 1 A 125 125 GLN CA C 125 59.651 58.433 1.218 1
1 1404 . 32 1 1 A 125 125 GLN CB C 125 28.880 28.361 0.519 1
1 1406 . 32 1 1 A 125 125 GLN N N 125 120.368 121.023 -0.655 1
1 1408 . 32 1 1 A 126 126 ALA H H 126 8.002 8.033 -0.031 1
1 1409 . 32 1 1 A 126 126 ALA HA H 126 4.144 3.938 0.206 1
1 1413 . 32 1 1 A 126 126 ALA C C 126 179.316 179.906 -0.590 1
1 1414 . 32 1 1 A 126 126 ALA CA C 126 55.036 55.030 0.006 1
1 1415 . 32 1 1 A 126 126 ALA CB C 126 18.087 18.073 0.014 1
1 1416 . 32 1 1 A 126 126 ALA N N 126 121.661 121.294 0.367 1
1 1417 . 32 1 1 A 127 127 ALA H H 127 7.823 8.353 -0.530 1
1 1418 . 32 1 1 A 127 127 ALA HA H 127 4.162 3.982 0.180 1
1 1422 . 32 1 1 A 127 127 ALA C C 127 180.707 179.313 1.394 1
1 1423 . 32 1 1 A 127 127 ALA CA C 127 55.080 54.821 0.259 1
1 1424 . 32 1 1 A 127 127 ALA CB C 127 19.354 18.265 1.089 1
1 1425 . 32 1 1 A 127 127 ALA N N 127 119.853 119.846 0.007 1
1 1426 . 32 1 1 A 128 128 ALA H H 128 8.936 7.629 1.307 1
1 1427 . 32 1 1 A 128 128 ALA HA H 128 3.928 3.686 0.242 1
1 1431 . 32 1 1 A 128 128 ALA C C 128 181.031 179.369 1.662 1
1 1432 . 32 1 1 A 128 128 ALA CA C 128 55.502 54.590 0.912 1
1 1433 . 32 1 1 A 128 128 ALA CB C 128 16.609 17.771 -1.162 1
1 1434 . 32 1 1 A 128 128 ALA N N 128 121.355 120.491 0.864 1
1 1435 . 32 1 1 A 129 129 THR H H 129 8.543 7.486 1.057 1
1 1436 . 32 1 1 A 129 129 THR HA H 129 4.015 3.613 0.402 1
1 1441 . 32 1 1 A 129 129 THR C C 129 177.332 176.430 0.902 1
1 1442 . 32 1 1 A 129 129 THR CA C 129 65.893 65.254 0.639 1
1 1443 . 32 1 1 A 129 129 THR CB C 129 68.566 68.501 0.065 1
1 1445 . 32 1 1 A 129 129 THR N N 129 112.709 112.160 0.549 1
1 1446 . 32 1 1 A 130 130 LYS H H 130 8.126 7.397 0.729 1
1 1447 . 32 1 1 A 130 130 LYS HA H 130 4.000 4.030 -0.030 1
1 1456 . 32 1 1 A 130 130 LYS C C 130 179.082 178.439 0.643 1
1 1457 . 32 1 1 A 130 130 LYS CA C 130 60.299 58.597 1.702 1
1 1458 . 32 1 1 A 130 130 LYS CB C 130 32.767 32.088 0.679 1
1 1462 . 32 1 1 A 130 130 LYS N N 130 123.879 120.313 3.566 1
1 1463 . 32 1 1 A 131 131 ALA H H 131 7.184 7.729 -0.545 1
1 1464 . 32 1 1 A 131 131 ALA HA H 131 4.005 4.250 -0.245 1
1 1468 . 32 1 1 A 131 131 ALA C C 131 178.482 179.562 -1.080 1
1 1469 . 32 1 1 A 131 131 ALA CA C 131 55.027 55.157 -0.130 1
1 1470 . 32 1 1 A 131 131 ALA CB C 131 18.669 19.508 -0.839 1
1 1471 . 32 1 1 A 131 131 ALA N N 131 118.590 121.153 -2.563 1
1 1472 . 32 1 1 A 132 132 TRP H H 132 7.977 8.531 -0.554 1
1 1473 . 32 1 1 A 132 132 TRP HA H 132 4.001 4.282 -0.281 1
1 1480 . 32 1 1 A 132 132 TRP C C 132 177.332 175.792 1.540 1
1 1481 . 32 1 1 A 132 132 TRP CA C 132 60.431 57.418 3.013 1
1 1482 . 32 1 1 A 132 132 TRP CB C 132 27.786 27.705 0.081 1
1 1486 . 32 1 1 A 132 132 TRP N N 132 119.168 117.032 2.136 1
1 1488 . 32 1 1 A 133 133 ARG H H 133 8.006 8.091 -0.085 1
1 1489 . 32 1 1 A 133 133 ARG HA H 133 4.027 4.392 -0.365 1
1 1497 . 32 1 1 A 133 133 ARG C C 133 176.664 177.801 -1.137 1
1 1498 . 32 1 1 A 133 133 ARG CA C 133 59.355 57.400 1.955 1
1 1499 . 32 1 1 A 133 133 ARG CB C 133 30.451 32.196 -1.745 1
1 1502 . 32 1 1 A 133 133 ARG N N 133 113.062 120.691 -7.629 1
1 1504 . 32 1 1 A 134 134 LYS H H 134 7.322 7.729 -0.407 1
1 1505 . 32 1 1 A 134 134 LYS HA H 134 4.313 4.358 -0.045 1
1 1514 . 32 1 1 A 134 134 LYS C C 134 176.282 176.057 0.225 1
1 1515 . 32 1 1 A 134 134 LYS CA C 134 54.922 56.671 -1.749 1
1 1516 . 32 1 1 A 134 134 LYS CB C 134 32.633 31.156 1.477 1
1 1520 . 32 1 1 A 134 134 LYS N N 134 118.170 119.225 -1.055 1
1 1521 . 32 1 1 A 135 135 LEU H H 135 7.440 8.304 -0.864 1
1 1522 . 32 1 1 A 135 135 LEU HA H 135 4.174 4.635 -0.461 1
1 1532 . 32 1 1 A 135 135 LEU CA C 135 54.408 51.828 2.580 1
1 1533 . 32 1 1 A 135 135 LEU CB C 135 40.407 41.916 -1.509 1
1 1537 . 32 1 1 A 135 135 LEU N N 135 123.358 121.584 1.774 1
1 1538 . 32 1 1 A 136 136 PRO HA H 136 4.437 4.549 -0.112 1
1 1545 . 32 1 1 A 136 136 PRO C C 136 177.106 175.538 1.568 1
1 1546 . 32 1 1 A 136 136 PRO CA C 136 62.889 64.354 -1.465 1
1 1547 . 32 1 1 A 136 136 PRO CB C 136 32.192 32.281 -0.089 1
1 1550 . 32 1 1 A 137 137 VAL H H 137 8.219 7.240 0.979 1
1 1551 . 32 1 1 A 137 137 VAL HA H 137 4.077 4.400 -0.323 1
1 1559 . 32 1 1 A 137 137 VAL C C 137 176.305 176.136 0.169 1
1 1560 . 32 1 1 A 137 137 VAL CA C 137 61.958 59.301 2.657 1
1 1561 . 32 1 1 A 137 137 VAL CB C 137 32.755 35.131 -2.376 1
1 1564 . 32 1 1 A 137 137 VAL N N 137 120.079 111.076 9.003 1
1 1565 . 32 1 1 A 138 138 LYS H H 138 8.444 8.598 -0.154 1
1 1566 . 32 1 1 A 138 138 LYS HA H 138 4.316 4.027 0.289 1
1 1575 . 32 1 1 A 138 138 LYS C C 138 176.790 176.571 0.219 1
1 1576 . 32 1 1 A 138 138 LYS CA C 138 56.792 58.289 -1.497 1
1 1577 . 32 1 1 A 138 138 LYS CB C 138 33.205 32.909 0.296 1
1 1581 . 32 1 1 A 138 138 LYS N N 138 126.449 121.787 4.662 1
1 1582 . 32 1 1 A 139 139 GLY H H 139 8.518 7.840 0.678 1
1 1583 . 32 1 1 A 139 139 GLY HA2 H 139 4.070 3.974 0.096 1
1 1584 . 32 1 1 A 139 139 GLY HA3 H 139 3.897 3.997 -0.100 1
1 1585 . 32 1 1 A 139 139 GLY C C 139 172.874 173.915 -1.041 1
1 1586 . 32 1 1 A 139 139 GLY CA C 139 45.157 45.073 0.084 1
1 1587 . 32 1 1 A 139 139 GLY N N 139 112.617 106.341 6.276 1
1 6 . 33 1 1 A 2 2 VAL H H 2 8.992 8.366 0.626 1
1 7 . 33 1 1 A 2 2 VAL HA H 2 5.370 4.582 0.788 1
1 15 . 33 1 1 A 2 2 VAL C C 2 174.325 174.089 0.236 1
1 16 . 33 1 1 A 2 2 VAL CA C 2 61.267 60.887 0.380 1
1 17 . 33 1 1 A 2 2 VAL CB C 2 33.890 33.780 0.110 1
1 20 . 33 1 1 A 2 2 VAL N N 2 126.939 119.628 7.311 1
1 21 . 33 1 1 A 3 3 THR H H 3 8.912 8.965 -0.053 1
1 22 . 33 1 1 A 3 3 THR HA H 3 4.505 5.030 -0.525 1
1 27 . 33 1 1 A 3 3 THR C C 3 172.710 173.230 -0.520 1
1 28 . 33 1 1 A 3 3 THR CA C 3 59.689 59.757 -0.068 1
1 29 . 33 1 1 A 3 3 THR CB C 3 72.398 71.153 1.245 1
1 31 . 33 1 1 A 3 3 THR N N 3 118.091 122.325 -4.234 1
1 32 . 33 1 1 A 4 4 GLU H H 4 8.631 8.815 -0.184 1
1 33 . 33 1 1 A 4 4 GLU HA H 4 5.788 4.924 0.864 1
1 38 . 33 1 1 A 4 4 GLU C C 4 175.758 173.933 1.825 1
1 39 . 33 1 1 A 4 4 GLU CA C 4 54.902 54.115 0.787 1
1 40 . 33 1 1 A 4 4 GLU CB C 4 35.097 33.526 1.571 1
1 42 . 33 1 1 A 4 4 GLU N N 4 120.966 125.567 -4.601 1
1 43 . 33 1 1 A 5 5 THR H H 5 9.188 8.374 0.814 1
1 44 . 33 1 1 A 5 5 THR HA H 5 4.739 4.692 0.047 1
1 49 . 33 1 1 A 5 5 THR C C 5 172.757 171.969 0.788 1
1 50 . 33 1 1 A 5 5 THR CA C 5 60.382 60.234 0.148 1
1 51 . 33 1 1 A 5 5 THR CB C 5 71.558 70.591 0.967 1
1 53 . 33 1 1 A 5 5 THR N N 5 119.366 114.749 4.617 1
1 54 . 33 1 1 A 6 6 VAL H H 6 8.476 8.500 -0.024 1
1 55 . 33 1 1 A 6 6 VAL HA H 6 5.026 5.546 -0.520 1
1 63 . 33 1 1 A 6 6 VAL C C 6 176.674 175.090 1.584 1
1 64 . 33 1 1 A 6 6 VAL CA C 6 61.008 61.011 -0.003 1
1 65 . 33 1 1 A 6 6 VAL CB C 6 33.861 34.457 -0.596 1
1 68 . 33 1 1 A 6 6 VAL N N 6 121.384 123.351 -1.967 1
1 69 . 33 1 1 A 7 7 ASP H H 7 8.848 9.220 -0.372 1
1 70 . 33 1 1 A 7 7 ASP HA H 7 4.797 4.928 -0.131 1
1 73 . 33 1 1 A 7 7 ASP CA C 7 52.834 54.766 -1.932 1
1 74 . 33 1 1 A 7 7 ASP CB C 7 42.219 42.161 0.058 1
1 75 . 33 1 1 A 7 7 ASP N N 7 127.061 127.030 0.031 1
1 76 . 33 1 1 A 8 8 GLY C C 8 175.143 174.607 0.536 1
1 77 . 33 1 1 A 8 8 GLY CA C 8 46.553 46.888 -0.335 1
1 78 . 33 1 1 A 9 9 GLN H H 9 8.408 7.715 0.693 1
1 79 . 33 1 1 A 9 9 GLN HA H 9 4.541 4.244 0.297 1
1 86 . 33 1 1 A 9 9 GLN C C 9 176.463 177.057 -0.594 1
1 87 . 33 1 1 A 9 9 GLN CA C 9 55.167 55.200 -0.033 1
1 88 . 33 1 1 A 9 9 GLN CB C 9 29.376 28.028 1.348 1
1 90 . 33 1 1 A 9 9 GLN N N 9 118.300 116.540 1.760 1
1 92 . 33 1 1 A 10 10 GLY H H 10 8.162 8.747 -0.585 1
1 93 . 33 1 1 A 10 10 GLY HA2 H 10 4.174 3.967 0.207 1
1 94 . 33 1 1 A 10 10 GLY HA3 H 10 3.521 3.980 -0.459 1
1 95 . 33 1 1 A 10 10 GLY C C 10 174.092 173.784 0.308 1
1 96 . 33 1 1 A 10 10 GLY CA C 10 45.558 46.265 -0.707 1
1 97 . 33 1 1 A 10 10 GLY N N 10 108.747 110.795 -2.048 1
1 98 . 33 1 1 A 11 11 GLN H H 11 8.507 7.662 0.845 1
1 99 . 33 1 1 A 11 11 GLN HA H 11 4.202 4.986 -0.784 1
1 106 . 33 1 1 A 11 11 GLN C C 11 173.992 174.114 -0.122 1
1 107 . 33 1 1 A 11 11 GLN CA C 11 55.098 53.682 1.416 1
1 108 . 33 1 1 A 11 11 GLN CB C 11 29.097 32.165 -3.068 1
1 110 . 33 1 1 A 11 11 GLN N N 11 122.979 114.633 8.346 1
1 112 . 33 1 1 A 12 12 ALA H H 12 8.259 8.796 -0.537 1
1 113 . 33 1 1 A 12 12 ALA HA H 12 5.156 6.110 -0.954 1
1 117 . 33 1 1 A 12 12 ALA C C 12 177.284 176.516 0.768 1
1 118 . 33 1 1 A 12 12 ALA CA C 12 51.087 50.549 0.538 1
1 119 . 33 1 1 A 12 12 ALA CB C 12 20.500 21.507 -1.007 1
1 120 . 33 1 1 A 12 12 ALA N N 12 127.100 122.551 4.549 1
1 121 . 33 1 1 A 13 13 TRP H H 13 9.245 9.051 0.194 1
1 122 . 33 1 1 A 13 13 TRP HA H 13 4.717 5.499 -0.782 1
1 131 . 33 1 1 A 13 13 TRP C C 13 175.108 174.366 0.742 1
1 132 . 33 1 1 A 13 13 TRP CA C 13 55.966 55.562 0.404 1
1 133 . 33 1 1 A 13 13 TRP CB C 13 31.912 32.358 -0.446 1
1 139 . 33 1 1 A 13 13 TRP N N 13 123.088 119.372 3.716 1
1 141 . 33 1 1 A 14 14 ARG H H 14 8.575 8.761 -0.186 1
1 142 . 33 1 1 A 14 14 ARG HA H 14 5.335 4.333 1.002 1
1 150 . 33 1 1 A 14 14 ARG C C 14 175.191 174.370 0.821 1
1 151 . 33 1 1 A 14 14 ARG CA C 14 53.106 54.961 -1.855 1
1 152 . 33 1 1 A 14 14 ARG CB C 14 32.749 31.826 0.923 1
1 154 . 33 1 1 A 14 14 ARG N N 14 121.163 119.821 1.342 1
1 156 . 33 1 1 A 15 15 HIS H H 15 8.595 8.168 0.427 1
1 157 . 33 1 1 A 15 15 HIS HA H 15 4.790 5.370 -0.580 1
1 161 . 33 1 1 A 15 15 HIS C C 15 173.770 174.765 -0.995 1
1 162 . 33 1 1 A 15 15 HIS CA C 15 55.289 54.423 0.866 1
1 163 . 33 1 1 A 15 15 HIS CB C 15 33.208 32.847 0.361 1
1 165 . 33 1 1 A 15 15 HIS N N 15 117.643 119.479 -1.836 1
1 166 . 33 1 1 A 16 16 HIS H H 16 8.993 9.267 -0.274 1
1 167 . 33 1 1 A 16 16 HIS HA H 16 5.158 5.105 0.053 1
1 171 . 33 1 1 A 16 16 HIS C C 16 173.608 175.147 -1.539 1
1 172 . 33 1 1 A 16 16 HIS CA C 16 56.450 55.479 0.971 1
1 173 . 33 1 1 A 16 16 HIS CB C 16 34.171 31.149 3.022 1
1 175 . 33 1 1 A 16 16 HIS N N 16 123.520 119.634 3.886 1
1 176 . 33 1 1 A 17 17 ASN H H 17 7.829 9.619 -1.790 1
1 177 . 33 1 1 A 17 17 ASN HA H 17 4.713 5.345 -0.632 1
1 182 . 33 1 1 A 17 17 ASN C C 17 173.682 175.229 -1.547 1
1 183 . 33 1 1 A 17 17 ASN CA C 17 51.822 51.717 0.105 1
1 184 . 33 1 1 A 17 17 ASN CB C 17 43.176 42.843 0.333 1
1 185 . 33 1 1 A 17 17 ASN N N 17 122.213 120.448 1.765 1
1 187 . 33 1 1 A 18 18 GLY H H 18 8.423 8.495 -0.072 1
1 188 . 33 1 1 A 18 18 GLY HA2 H 18 3.931 4.045 -0.114 1
1 189 . 33 1 1 A 18 18 GLY HA3 H 18 3.707 4.145 -0.438 1
1 190 . 33 1 1 A 18 18 GLY C C 18 173.985 173.028 0.957 1
1 191 . 33 1 1 A 18 18 GLY CA C 18 43.949 44.330 -0.381 1
1 192 . 33 1 1 A 18 18 GLY N N 18 106.991 107.685 -0.694 1
1 193 . 33 1 1 A 19 19 PHE H H 19 8.338 8.569 -0.231 1
1 194 . 33 1 1 A 19 19 PHE HA H 19 4.068 4.801 -0.733 1
1 197 . 33 1 1 A 19 19 PHE C C 19 176.568 175.754 0.814 1
1 198 . 33 1 1 A 19 19 PHE CA C 19 59.338 58.673 0.665 1
1 199 . 33 1 1 A 19 19 PHE CB C 19 40.201 39.660 0.541 1
1 200 . 33 1 1 A 19 19 PHE N N 19 116.857 118.657 -1.800 1
1 201 . 33 1 1 A 20 20 ASP H H 20 8.794 8.645 0.149 1
1 202 . 33 1 1 A 20 20 ASP HA H 20 4.485 4.786 -0.301 1
1 205 . 33 1 1 A 20 20 ASP C C 20 177.379 177.090 0.289 1
1 206 . 33 1 1 A 20 20 ASP CA C 20 54.140 54.279 -0.139 1
1 207 . 33 1 1 A 20 20 ASP CB C 20 41.915 41.825 0.090 1
1 208 . 33 1 1 A 20 20 ASP N N 20 123.025 123.174 -0.149 1
1 209 . 33 1 1 A 21 21 PHE H H 21 8.862 9.158 -0.296 1
1 210 . 33 1 1 A 21 21 PHE HA H 21 4.087 4.076 0.011 1
1 218 . 33 1 1 A 21 21 PHE C C 21 176.952 177.218 -0.266 1
1 219 . 33 1 1 A 21 21 PHE CA C 21 61.095 62.442 -1.347 1
1 220 . 33 1 1 A 21 21 PHE CB C 21 38.678 39.453 -0.775 1
1 226 . 33 1 1 A 21 21 PHE N N 21 127.163 127.501 -0.338 1
1 227 . 33 1 1 A 22 22 ALA H H 22 8.561 8.374 0.187 1
1 228 . 33 1 1 A 22 22 ALA HA H 22 3.878 3.989 -0.111 1
1 232 . 33 1 1 A 22 22 ALA C C 22 180.710 180.212 0.498 1
1 233 . 33 1 1 A 22 22 ALA CA C 22 55.211 55.166 0.045 1
1 234 . 33 1 1 A 22 22 ALA CB C 22 18.321 18.114 0.207 1
1 235 . 33 1 1 A 22 22 ALA N N 22 120.293 121.459 -1.166 1
1 236 . 33 1 1 A 23 23 VAL H H 23 7.241 7.887 -0.646 1
1 237 . 33 1 1 A 23 23 VAL HA H 23 3.684 3.501 0.183 1
1 245 . 33 1 1 A 23 23 VAL C C 23 177.101 178.168 -1.067 1
1 246 . 33 1 1 A 23 23 VAL CA C 23 65.237 66.930 -1.693 1
1 247 . 33 1 1 A 23 23 VAL CB C 23 31.780 31.584 0.196 1
1 250 . 33 1 1 A 23 23 VAL N N 23 118.775 118.261 0.514 1
1 251 . 33 1 1 A 24 24 ILE H H 24 6.761 8.104 -1.343 1
1 252 . 33 1 1 A 24 24 ILE HA H 24 3.196 3.336 -0.140 1
1 262 . 33 1 1 A 24 24 ILE C C 24 177.287 177.905 -0.618 1
1 263 . 33 1 1 A 24 24 ILE CA C 24 63.404 65.653 -2.249 1
1 264 . 33 1 1 A 24 24 ILE CB C 24 36.294 37.502 -1.208 1
1 268 . 33 1 1 A 24 24 ILE N N 24 119.036 119.998 -0.962 1
1 269 . 33 1 1 A 25 25 LYS H H 25 8.032 8.135 -0.103 1
1 270 . 33 1 1 A 25 25 LYS HA H 25 3.809 3.669 0.140 1
1 279 . 33 1 1 A 25 25 LYS C C 25 179.450 178.667 0.783 1
1 280 . 33 1 1 A 25 25 LYS CA C 25 59.621 59.691 -0.070 1
1 281 . 33 1 1 A 25 25 LYS CB C 25 32.259 31.965 0.294 1
1 285 . 33 1 1 A 25 25 LYS N N 25 118.368 120.458 -2.090 1
1 286 . 33 1 1 A 26 26 GLU H H 26 7.845 7.912 -0.067 1
1 287 . 33 1 1 A 26 26 GLU HA H 26 4.021 4.172 -0.151 1
1 292 . 33 1 1 A 26 26 GLU C C 26 179.191 178.847 0.344 1
1 293 . 33 1 1 A 26 26 GLU CA C 26 59.530 58.915 0.615 1
1 294 . 33 1 1 A 26 26 GLU CB C 26 29.449 29.511 -0.062 1
1 296 . 33 1 1 A 26 26 GLU N N 26 120.522 118.808 1.714 1
1 297 . 33 1 1 A 27 27 LEU H H 27 8.165 8.017 0.148 1
1 298 . 33 1 1 A 27 27 LEU HA H 27 4.163 4.123 0.040 1
1 308 . 33 1 1 A 27 27 LEU C C 27 177.256 178.327 -1.071 1
1 309 . 33 1 1 A 27 27 LEU CA C 27 58.049 57.505 0.544 1
1 310 . 33 1 1 A 27 27 LEU CB C 27 41.365 41.278 0.087 1
1 314 . 33 1 1 A 27 27 LEU N N 27 120.879 121.162 -0.283 1
1 315 . 33 1 1 A 28 28 LYS H H 28 8.902 8.124 0.778 1
1 316 . 33 1 1 A 28 28 LYS HA H 28 4.199 4.685 -0.486 1
1 317 . 33 1 1 A 28 28 LYS C C 28 179.707 179.517 0.190 1
1 318 . 33 1 1 A 28 28 LYS CA C 28 60.097 58.827 1.270 1
1 319 . 33 1 1 A 28 28 LYS CB C 28 33.420 31.534 1.886 1
1 320 . 33 1 1 A 28 28 LYS N N 28 120.050 119.543 0.507 1
1 321 . 33 1 1 A 29 29 THR H H 29 8.294 8.049 0.245 1
1 322 . 33 1 1 A 29 29 THR HA H 29 3.892 3.909 -0.017 1
1 327 . 33 1 1 A 29 29 THR C C 29 175.711 176.326 -0.615 1
1 328 . 33 1 1 A 29 29 THR CA C 29 66.846 66.423 0.423 1
1 329 . 33 1 1 A 29 29 THR CB C 29 68.794 68.609 0.185 1
1 331 . 33 1 1 A 29 29 THR N N 29 115.933 116.814 -0.881 1
1 332 . 33 1 1 A 30 30 ALA H H 30 8.244 8.605 -0.361 1
1 333 . 33 1 1 A 30 30 ALA HA H 30 4.241 4.183 0.058 1
1 337 . 33 1 1 A 30 30 ALA C C 30 179.128 179.611 -0.483 1
1 338 . 33 1 1 A 30 30 ALA CA C 30 55.714 55.345 0.369 1
1 339 . 33 1 1 A 30 30 ALA CB C 30 18.955 18.357 0.598 1
1 340 . 33 1 1 A 30 30 ALA N N 30 124.617 122.937 1.680 1
1 341 . 33 1 1 A 31 31 ALA H H 31 8.968 8.449 0.519 1
1 342 . 33 1 1 A 31 31 ALA HA H 31 3.890 3.999 -0.109 1
1 346 . 33 1 1 A 31 31 ALA C C 31 180.352 179.506 0.846 1
1 347 . 33 1 1 A 31 31 ALA CA C 31 55.454 55.484 -0.030 1
1 348 . 33 1 1 A 31 31 ALA CB C 31 17.124 18.239 -1.115 1
1 349 . 33 1 1 A 31 31 ALA N N 31 119.327 120.652 -1.325 1
1 350 . 33 1 1 A 32 32 SER H H 32 7.995 7.841 0.154 1
1 351 . 33 1 1 A 32 32 SER HA H 32 4.238 4.210 0.028 1
1 354 . 33 1 1 A 32 32 SER C C 32 175.612 175.728 -0.116 1
1 355 . 33 1 1 A 32 32 SER CA C 32 61.203 61.481 -0.278 1
1 356 . 33 1 1 A 32 32 SER CB C 32 63.406 63.300 0.106 1
1 357 . 33 1 1 A 32 32 SER N N 32 111.962 113.604 -1.642 1
1 358 . 33 1 1 A 33 33 GLN H H 33 8.333 7.846 0.487 1
1 359 . 33 1 1 A 33 33 GLN HA H 33 3.992 4.269 -0.277 1
1 366 . 33 1 1 A 33 33 GLN C C 33 177.486 177.572 -0.086 1
1 367 . 33 1 1 A 33 33 GLN CA C 33 58.277 58.067 0.210 1
1 368 . 33 1 1 A 33 33 GLN CB C 33 29.140 29.870 -0.730 1
1 370 . 33 1 1 A 33 33 GLN N N 33 119.527 119.580 -0.053 1
1 372 . 33 1 1 A 34 34 TYR H H 34 8.587 8.230 0.357 1
1 373 . 33 1 1 A 34 34 TYR HA H 34 4.792 4.440 0.352 1
1 380 . 33 1 1 A 34 34 TYR C C 34 176.499 176.652 -0.153 1
1 381 . 33 1 1 A 34 34 TYR CA C 34 57.711 60.018 -2.307 1
1 382 . 33 1 1 A 34 34 TYR CB C 34 39.561 38.958 0.603 1
1 387 . 33 1 1 A 34 34 TYR N N 34 114.610 115.312 -0.702 1
1 388 . 33 1 1 A 35 35 GLY H H 35 7.346 8.186 -0.840 1
1 389 . 33 1 1 A 35 35 GLY HA2 H 35 4.785 4.073 0.712 1
1 390 . 33 1 1 A 35 35 GLY HA3 H 35 4.007 4.078 -0.071 1
1 391 . 33 1 1 A 35 35 GLY C C 35 175.796 173.118 2.678 1
1 392 . 33 1 1 A 35 35 GLY CA C 35 44.355 44.902 -0.547 1
1 393 . 33 1 1 A 35 35 GLY N N 35 108.501 106.509 1.992 1
1 394 . 33 1 1 A 36 36 ALA H H 36 9.363 8.234 1.129 1
1 395 . 33 1 1 A 36 36 ALA HA H 36 4.217 4.667 -0.450 1
1 399 . 33 1 1 A 36 36 ALA C C 36 178.039 177.291 0.748 1
1 400 . 33 1 1 A 36 36 ALA CA C 36 56.114 51.801 4.313 1
1 401 . 33 1 1 A 36 36 ALA CB C 36 19.179 19.408 -0.229 1
1 402 . 33 1 1 A 36 36 ALA N N 36 125.811 123.159 2.652 1
1 403 . 33 1 1 A 37 37 THR H H 37 8.070 8.838 -0.768 1
1 404 . 33 1 1 A 37 37 THR HA H 37 4.570 4.537 0.033 1
1 409 . 33 1 1 A 37 37 THR C C 37 173.685 174.164 -0.479 1
1 410 . 33 1 1 A 37 37 THR CA C 37 59.822 63.187 -3.365 1
1 411 . 33 1 1 A 37 37 THR CB C 37 68.267 71.614 -3.347 1
1 413 . 33 1 1 A 37 37 THR N N 37 129.410 118.741 10.669 1
1 414 . 33 1 1 A 38 38 ALA H H 38 6.853 7.243 -0.390 1
1 415 . 33 1 1 A 38 38 ALA HA H 38 4.601 4.600 0.001 1
1 419 . 33 1 1 A 38 38 ALA CA C 38 50.758 50.752 0.006 1
1 420 . 33 1 1 A 38 38 ALA CB C 38 18.325 19.368 -1.043 1
1 421 . 33 1 1 A 38 38 ALA N N 38 124.674 124.483 0.191 1
1 422 . 33 1 1 A 40 40 TYR HA H 40 4.032 4.027 0.005 1
1 429 . 33 1 1 A 40 40 TYR C C 40 176.456 177.287 -0.831 1
1 430 . 33 1 1 A 40 40 TYR CA C 40 61.010 61.886 -0.876 1
1 431 . 33 1 1 A 40 40 TYR CB C 40 39.286 38.588 0.698 1
1 436 . 33 1 1 A 41 41 THR H H 41 6.874 8.234 -1.360 1
1 437 . 33 1 1 A 41 41 THR HA H 41 3.616 3.855 -0.239 1
1 442 . 33 1 1 A 41 41 THR C C 41 176.930 176.594 0.336 1
1 443 . 33 1 1 A 41 41 THR CA C 41 65.557 65.695 -0.138 1
1 444 . 33 1 1 A 41 41 THR CB C 41 68.228 69.256 -1.028 1
1 446 . 33 1 1 A 41 41 THR N N 41 115.143 113.793 1.350 1
1 447 . 33 1 1 A 42 42 LEU H H 42 8.623 7.871 0.752 1
1 448 . 33 1 1 A 42 42 LEU HA H 42 3.708 3.994 -0.286 1
1 458 . 33 1 1 A 42 42 LEU C C 42 178.206 178.965 -0.759 1
1 459 . 33 1 1 A 42 42 LEU CA C 42 57.417 57.672 -0.255 1
1 460 . 33 1 1 A 42 42 LEU CB C 42 41.342 41.139 0.203 1
1 464 . 33 1 1 A 42 42 LEU N N 42 120.418 118.048 2.370 1
1 465 . 33 1 1 A 43 43 ALA H H 43 7.735 7.640 0.095 1
1 466 . 33 1 1 A 43 43 ALA HA H 43 4.020 4.017 0.003 1
1 470 . 33 1 1 A 43 43 ALA C C 43 180.826 180.194 0.632 1
1 471 . 33 1 1 A 43 43 ALA CA C 43 54.925 54.889 0.036 1
1 472 . 33 1 1 A 43 43 ALA CB C 43 17.506 18.207 -0.701 1
1 473 . 33 1 1 A 43 43 ALA N N 43 120.203 121.715 -1.512 1
1 474 . 33 1 1 A 44 44 ILE H H 44 7.149 7.345 -0.196 1
1 475 . 33 1 1 A 44 44 ILE HA H 44 3.603 3.628 -0.025 1
1 485 . 33 1 1 A 44 44 ILE C C 44 178.594 178.255 0.339 1
1 486 . 33 1 1 A 44 44 ILE CA C 44 64.782 64.096 0.686 1
1 487 . 33 1 1 A 44 44 ILE CB C 44 37.472 37.452 0.020 1
1 491 . 33 1 1 A 44 44 ILE N N 44 118.881 119.147 -0.266 1
1 492 . 33 1 1 A 45 45 VAL H H 45 7.968 7.959 0.009 1
1 493 . 33 1 1 A 45 45 VAL HA H 45 2.925 3.381 -0.456 1
1 501 . 33 1 1 A 45 45 VAL C C 45 177.023 177.991 -0.968 1
1 502 . 33 1 1 A 45 45 VAL CA C 45 67.081 67.010 0.071 1
1 503 . 33 1 1 A 45 45 VAL CB C 45 30.854 31.334 -0.480 1
1 506 . 33 1 1 A 45 45 VAL N N 45 120.764 119.692 1.072 1
1 507 . 33 1 1 A 46 46 GLU H H 46 8.399 8.414 -0.015 1
1 508 . 33 1 1 A 46 46 GLU HA H 46 3.848 3.942 -0.094 1
1 513 . 33 1 1 A 46 46 GLU C C 46 178.656 178.658 -0.002 1
1 514 . 33 1 1 A 46 46 GLU CA C 46 59.491 59.035 0.456 1
1 515 . 33 1 1 A 46 46 GLU CB C 46 28.991 28.736 0.255 1
1 517 . 33 1 1 A 46 46 GLU N N 46 116.599 119.774 -3.175 1
1 518 . 33 1 1 A 47 47 SER H H 47 7.273 7.433 -0.160 1
1 519 . 33 1 1 A 47 47 SER HA H 47 4.287 4.222 0.065 1
1 521 . 33 1 1 A 47 47 SER CA C 47 61.047 61.283 -0.236 1
1 522 . 33 1 1 A 47 47 SER CB C 47 63.016 62.731 0.285 1
1 523 . 33 1 1 A 47 47 SER N N 47 113.609 115.993 -2.384 1
1 524 . 33 1 1 A 48 48 VAL H H 48 8.006 8.116 -0.110 1
1 525 . 33 1 1 A 48 48 VAL HA H 48 3.556 3.642 -0.086 1
1 533 . 33 1 1 A 48 48 VAL C C 48 177.257 177.485 -0.228 1
1 534 . 33 1 1 A 48 48 VAL CA C 48 65.025 66.515 -1.490 1
1 535 . 33 1 1 A 48 48 VAL CB C 48 31.841 31.557 0.284 1
1 538 . 33 1 1 A 48 48 VAL N N 48 122.327 121.387 0.940 1
1 539 . 33 1 1 A 49 49 ALA H H 49 8.369 8.113 0.256 1
1 540 . 33 1 1 A 49 49 ALA HA H 49 4.115 4.327 -0.212 1
1 544 . 33 1 1 A 49 49 ALA C C 49 177.307 177.544 -0.237 1
1 545 . 33 1 1 A 49 49 ALA CA C 49 53.253 53.353 -0.100 1
1 546 . 33 1 1 A 49 49 ALA CB C 49 20.131 18.263 1.868 1
1 547 . 33 1 1 A 49 49 ALA N N 49 118.050 121.104 -3.054 1
1 548 . 33 1 1 A 50 50 ASP H H 50 7.052 8.013 -0.961 1
1 549 . 33 1 1 A 50 50 ASP HA H 50 4.788 4.757 0.031 1
1 552 . 33 1 1 A 50 50 ASP C C 50 175.481 175.943 -0.462 1
1 553 . 33 1 1 A 50 50 ASP CA C 50 53.681 53.562 0.119 1
1 554 . 33 1 1 A 50 50 ASP CB C 50 39.333 41.254 -1.921 1
1 555 . 33 1 1 A 50 50 ASP N N 50 116.997 116.701 0.296 1
1 556 . 33 1 1 A 51 51 ASN H H 51 8.535 7.751 0.784 1
1 557 . 33 1 1 A 51 51 ASN HA H 51 4.628 5.174 -0.546 1
1 562 . 33 1 1 A 51 51 ASN C C 51 174.077 175.395 -1.318 1
1 563 . 33 1 1 A 51 51 ASN CA C 51 52.315 52.014 0.301 1
1 564 . 33 1 1 A 51 51 ASN CB C 51 41.928 41.543 0.385 1
1 565 . 33 1 1 A 51 51 ASN N N 51 118.626 117.893 0.733 1
1 567 . 33 1 1 A 52 52 TRP H H 52 8.555 8.552 0.003 1
1 574 . 33 1 1 A 52 52 TRP C C 52 173.269 176.178 -2.909 1
1 575 . 33 1 1 A 52 52 TRP CA C 52 55.031 57.811 -2.780 1
1 576 . 33 1 1 A 52 52 TRP CB C 52 26.801 29.307 -2.506 1
1 582 . 33 1 1 A 52 52 TRP N N 52 120.693 120.753 -0.060 1
1 584 . 33 1 1 A 53 53 LEU H H 53 7.847 7.588 0.259 1
1 585 . 33 1 1 A 53 53 LEU HA H 53 4.859 4.270 0.589 1
1 595 . 33 1 1 A 53 53 LEU C C 53 177.397 176.728 0.669 1
1 596 . 33 1 1 A 53 53 LEU CA C 53 53.619 55.406 -1.787 1
1 597 . 33 1 1 A 53 53 LEU CB C 53 41.812 42.601 -0.789 1
1 601 . 33 1 1 A 53 53 LEU N N 53 124.741 119.694 5.047 1
1 602 . 33 1 1 A 54 54 THR H H 54 8.850 8.575 0.275 1
1 603 . 33 1 1 A 54 54 THR HA H 54 4.598 4.611 -0.013 1
1 608 . 33 1 1 A 54 54 THR CA C 54 60.531 60.232 0.299 1
1 609 . 33 1 1 A 54 54 THR CB C 54 67.183 68.945 -1.762 1
1 611 . 33 1 1 A 54 54 THR N N 54 113.407 114.284 -0.877 1
1 612 . 33 1 1 A 55 55 PRO HA H 55 4.511 4.290 0.221 1
1 619 . 33 1 1 A 55 55 PRO C C 55 179.383 177.776 1.607 1
1 620 . 33 1 1 A 55 55 PRO CA C 55 67.159 65.662 1.497 1
1 621 . 33 1 1 A 55 55 PRO CB C 55 32.095 31.734 0.361 1
1 622 . 33 1 1 A 56 56 THR H H 56 8.575 7.683 0.892 1
1 623 . 33 1 1 A 56 56 THR HA H 56 4.229 4.189 0.040 1
1 628 . 33 1 1 A 56 56 THR C C 56 176.668 176.794 -0.126 1
1 629 . 33 1 1 A 56 56 THR CA C 56 66.943 64.964 1.979 1
1 630 . 33 1 1 A 56 56 THR CB C 56 68.129 68.780 -0.651 1
1 632 . 33 1 1 A 56 56 THR N N 56 114.855 111.446 3.409 1
1 633 . 33 1 1 A 57 57 ASP H H 57 8.730 8.237 0.493 1
1 634 . 33 1 1 A 57 57 ASP HA H 57 4.425 4.589 -0.164 1
1 637 . 33 1 1 A 57 57 ASP C C 57 178.351 179.446 -1.095 1
1 638 . 33 1 1 A 57 57 ASP CA C 57 57.963 57.592 0.371 1
1 639 . 33 1 1 A 57 57 ASP CB C 57 40.134 40.773 -0.639 1
1 640 . 33 1 1 A 57 57 ASP N N 57 126.239 121.946 4.293 1
1 641 . 33 1 1 A 58 58 TRP H H 58 8.244 8.740 -0.496 1
1 642 . 33 1 1 A 58 58 TRP HA H 58 4.030 4.634 -0.604 1
1 650 . 33 1 1 A 58 58 TRP C C 58 177.432 179.187 -1.755 1
1 651 . 33 1 1 A 58 58 TRP CA C 58 62.731 60.106 2.625 1
1 652 . 33 1 1 A 58 58 TRP CB C 58 29.122 29.415 -0.293 1
1 657 . 33 1 1 A 58 58 TRP N N 58 119.241 120.391 -1.150 1
1 659 . 33 1 1 A 59 59 ASN H H 59 8.098 8.695 -0.597 1
1 660 . 33 1 1 A 59 59 ASN HA H 59 4.424 4.445 -0.021 1
1 663 . 33 1 1 A 59 59 ASN C C 59 176.952 178.035 -1.083 1
1 664 . 33 1 1 A 59 59 ASN CA C 59 58.135 56.552 1.583 1
1 665 . 33 1 1 A 59 59 ASN CB C 59 40.168 37.882 2.286 1
1 666 . 33 1 1 A 59 59 ASN N N 59 115.747 118.066 -2.319 1
1 667 . 33 1 1 A 60 60 THR H H 60 8.712 7.996 0.716 1
1 668 . 33 1 1 A 60 60 THR HA H 60 3.717 4.080 -0.363 1
1 673 . 33 1 1 A 60 60 THR C C 60 176.044 176.653 -0.609 1
1 674 . 33 1 1 A 60 60 THR CA C 60 66.576 67.110 -0.534 1
1 675 . 33 1 1 A 60 60 THR CB C 60 69.251 68.046 1.205 1
1 677 . 33 1 1 A 60 60 THR N N 60 114.896 117.578 -2.682 1
1 678 . 33 1 1 A 61 61 LEU H H 61 8.485 8.584 -0.099 1
1 679 . 33 1 1 A 61 61 LEU HA H 61 3.391 3.673 -0.282 1
1 689 . 33 1 1 A 61 61 LEU C C 61 177.433 178.434 -1.001 1
1 690 . 33 1 1 A 61 61 LEU CA C 61 58.354 58.441 -0.087 1
1 691 . 33 1 1 A 61 61 LEU CB C 61 41.761 42.231 -0.470 1
1 695 . 33 1 1 A 61 61 LEU N N 61 123.433 122.040 1.393 1
1 696 . 33 1 1 A 62 62 VAL H H 62 8.073 8.104 -0.031 1
1 697 . 33 1 1 A 62 62 VAL HA H 62 3.207 3.733 -0.526 1
1 705 . 33 1 1 A 62 62 VAL C C 62 177.585 177.619 -0.034 1
1 706 . 33 1 1 A 62 62 VAL CA C 62 67.345 65.114 2.231 1
1 707 . 33 1 1 A 62 62 VAL CB C 62 30.905 30.555 0.350 1
1 710 . 33 1 1 A 62 62 VAL N N 62 116.018 118.299 -2.281 1
1 711 . 33 1 1 A 63 63 ARG H H 63 7.765 7.674 0.091 1
1 712 . 33 1 1 A 63 63 ARG HA H 63 3.602 3.910 -0.308 1
1 719 . 33 1 1 A 63 63 ARG C C 63 177.818 178.078 -0.260 1
1 720 . 33 1 1 A 63 63 ARG CA C 63 58.049 59.393 -1.344 1
1 721 . 33 1 1 A 63 63 ARG CB C 63 29.955 30.158 -0.203 1
1 724 . 33 1 1 A 63 63 ARG N N 63 116.700 121.705 -5.005 1
1 725 . 33 1 1 A 64 64 ALA H H 64 7.574 7.560 0.014 1
1 726 . 33 1 1 A 64 64 ALA HA H 64 4.158 4.400 -0.242 1
1 730 . 33 1 1 A 64 64 ALA C C 64 179.886 179.159 0.727 1
1 731 . 33 1 1 A 64 64 ALA CA C 64 54.007 53.849 0.158 1
1 732 . 33 1 1 A 64 64 ALA CB C 64 19.147 19.810 -0.663 1
1 733 . 33 1 1 A 64 64 ALA N N 64 117.555 121.508 -3.953 1
1 734 . 33 1 1 A 65 65 VAL H H 65 7.554 8.061 -0.507 1
1 735 . 33 1 1 A 65 65 VAL HA H 65 4.253 3.809 0.444 1
1 743 . 33 1 1 A 65 65 VAL C C 65 174.180 176.468 -2.288 1
1 744 . 33 1 1 A 65 65 VAL CA C 65 62.683 65.564 -2.881 1
1 745 . 33 1 1 A 65 65 VAL CB C 65 33.458 31.384 2.074 1
1 748 . 33 1 1 A 65 65 VAL N N 65 110.013 115.553 -5.540 1
1 749 . 33 1 1 A 66 66 LEU H H 66 7.792 7.075 0.717 1
1 750 . 33 1 1 A 66 66 LEU HA H 66 4.790 4.673 0.117 1
1 760 . 33 1 1 A 66 66 LEU C C 66 177.537 175.510 2.027 1
1 761 . 33 1 1 A 66 66 LEU CA C 66 52.823 52.881 -0.058 1
1 762 . 33 1 1 A 66 66 LEU CB C 66 44.071 44.273 -0.202 1
1 766 . 33 1 1 A 66 66 LEU N N 66 118.967 121.768 -2.801 1
1 767 . 33 1 1 A 67 67 SER H H 67 9.208 8.360 0.848 1
1 768 . 33 1 1 A 67 67 SER HA H 67 4.414 5.100 -0.686 1
1 771 . 33 1 1 A 67 67 SER CA C 67 57.943 56.274 1.669 1
1 772 . 33 1 1 A 67 67 SER CB C 67 64.743 65.871 -1.128 1
1 773 . 33 1 1 A 67 67 SER N N 67 116.378 112.842 3.536 1
1 774 . 33 1 1 A 69 69 GLY HA2 H 69 3.916 3.636 0.280 1
1 775 . 33 1 1 A 69 69 GLY HA3 H 69 3.867 3.671 0.196 1
1 776 . 33 1 1 A 69 69 GLY C C 69 176.783 175.275 1.508 1
1 777 . 33 1 1 A 69 69 GLY CA C 69 46.977 46.579 0.398 1
1 778 . 33 1 1 A 70 70 ASP H H 70 7.674 7.968 -0.294 1
1 779 . 33 1 1 A 70 70 ASP HA H 70 4.511 3.451 1.060 1
1 782 . 33 1 1 A 70 70 ASP C C 70 178.096 178.009 0.087 1
1 783 . 33 1 1 A 70 70 ASP CA C 70 57.262 56.492 0.770 1
1 784 . 33 1 1 A 70 70 ASP CB C 70 40.594 39.814 0.780 1
1 785 . 33 1 1 A 70 70 ASP N N 70 123.930 121.562 2.368 1
1 786 . 33 1 1 A 71 71 HIS H H 71 8.729 8.175 0.554 1
1 787 . 33 1 1 A 71 71 HIS HA H 71 4.235 4.148 0.087 1
1 790 . 33 1 1 A 71 71 HIS C C 71 176.769 176.733 0.036 1
1 791 . 33 1 1 A 71 71 HIS CA C 71 60.041 58.855 1.186 1
1 792 . 33 1 1 A 71 71 HIS CB C 71 30.682 28.504 2.178 1
1 793 . 33 1 1 A 71 71 HIS N N 71 121.003 116.331 4.672 1
1 794 . 33 1 1 A 72 72 LEU H H 72 7.620 7.473 0.147 1
1 795 . 33 1 1 A 72 72 LEU HA H 72 3.769 3.947 -0.178 1
1 805 . 33 1 1 A 72 72 LEU C C 72 180.275 179.199 1.076 1
1 806 . 33 1 1 A 72 72 LEU CA C 72 58.192 57.956 0.236 1
1 807 . 33 1 1 A 72 72 LEU CB C 72 41.381 41.289 0.092 1
1 811 . 33 1 1 A 72 72 LEU N N 72 118.569 119.104 -0.535 1
1 812 . 33 1 1 A 73 73 LEU H H 73 7.542 7.389 0.153 1
1 813 . 33 1 1 A 73 73 LEU HA H 73 4.107 4.262 -0.155 1
1 823 . 33 1 1 A 73 73 LEU C C 73 179.436 179.147 0.289 1
1 824 . 33 1 1 A 73 73 LEU CA C 73 58.026 57.292 0.734 1
1 825 . 33 1 1 A 73 73 LEU CB C 73 41.638 42.149 -0.511 1
1 829 . 33 1 1 A 73 73 LEU N N 73 121.418 120.243 1.175 1
1 830 . 33 1 1 A 74 74 TRP H H 74 8.786 7.914 0.872 1
1 831 . 33 1 1 A 74 74 TRP HA H 74 3.589 5.351 -1.762 1
1 840 . 33 1 1 A 74 74 TRP C C 74 176.816 178.796 -1.980 1
1 841 . 33 1 1 A 74 74 TRP CA C 74 63.046 59.838 3.208 1
1 842 . 33 1 1 A 74 74 TRP CB C 74 28.065 28.953 -0.888 1
1 848 . 33 1 1 A 74 74 TRP N N 74 121.111 118.487 2.624 1
1 850 . 33 1 1 A 75 75 LYS H H 75 8.939 7.482 1.457 1
1 851 . 33 1 1 A 75 75 LYS HA H 75 3.055 4.232 -1.177 1
1 860 . 33 1 1 A 75 75 LYS C C 75 177.967 179.302 -1.335 1
1 861 . 33 1 1 A 75 75 LYS CA C 75 60.029 58.713 1.316 1
1 862 . 33 1 1 A 75 75 LYS CB C 75 32.533 33.078 -0.545 1
1 866 . 33 1 1 A 75 75 LYS N N 75 119.783 118.664 1.119 1
1 867 . 33 1 1 A 76 76 SER H H 76 7.832 7.935 -0.103 1
1 868 . 33 1 1 A 76 76 SER HA H 76 4.040 4.360 -0.320 1
1 871 . 33 1 1 A 76 76 SER C C 76 177.816 176.853 0.963 1
1 872 . 33 1 1 A 76 76 SER CA C 76 62.105 62.415 -0.310 1
1 873 . 33 1 1 A 76 76 SER CB C 76 62.679 63.065 -0.386 1
1 874 . 33 1 1 A 76 76 SER N N 76 113.395 117.412 -4.017 1
1 875 . 33 1 1 A 77 77 GLU H H 77 7.590 7.743 -0.153 1
1 876 . 33 1 1 A 77 77 GLU HA H 77 4.042 4.410 -0.368 1
1 881 . 33 1 1 A 77 77 GLU C C 77 177.809 178.729 -0.920 1
1 882 . 33 1 1 A 77 77 GLU CA C 77 58.270 58.104 0.166 1
1 883 . 33 1 1 A 77 77 GLU CB C 77 29.208 29.468 -0.260 1
1 885 . 33 1 1 A 77 77 GLU N N 77 121.574 122.391 -0.817 1
1 886 . 33 1 1 A 78 78 PHE H H 78 9.081 7.958 1.123 1
1 887 . 33 1 1 A 78 78 PHE HA H 78 3.778 4.243 -0.465 1
1 895 . 33 1 1 A 78 78 PHE C C 78 178.114 177.417 0.697 1
1 896 . 33 1 1 A 78 78 PHE CA C 78 60.629 61.362 -0.733 1
1 897 . 33 1 1 A 78 78 PHE CB C 78 38.295 38.474 -0.179 1
1 902 . 33 1 1 A 78 78 PHE N N 78 122.682 122.556 0.126 1
1 903 . 33 1 1 A 79 79 PHE H H 79 8.890 8.030 0.860 1
1 904 . 33 1 1 A 79 79 PHE HA H 79 3.800 4.048 -0.248 1
1 912 . 33 1 1 A 79 79 PHE C C 79 178.354 178.271 0.083 1
1 913 . 33 1 1 A 79 79 PHE CA C 79 60.704 61.831 -1.127 1
1 914 . 33 1 1 A 79 79 PHE CB C 79 37.184 38.429 -1.245 1
1 920 . 33 1 1 A 79 79 PHE N N 79 121.056 117.737 3.319 1
1 921 . 33 1 1 A 80 80 GLU H H 80 7.793 8.130 -0.337 1
1 922 . 33 1 1 A 80 80 GLU HA H 80 4.082 4.006 0.076 1
1 927 . 33 1 1 A 80 80 GLU C C 80 179.068 179.485 -0.417 1
1 928 . 33 1 1 A 80 80 GLU CA C 80 59.735 59.574 0.161 1
1 929 . 33 1 1 A 80 80 GLU CB C 80 28.722 29.172 -0.450 1
1 931 . 33 1 1 A 80 80 GLU N N 80 120.312 118.697 1.615 1
1 932 . 33 1 1 A 81 81 ASN H H 81 8.624 8.689 -0.065 1
1 933 . 33 1 1 A 81 81 ASN HA H 81 4.521 4.528 -0.007 1
1 938 . 33 1 1 A 81 81 ASN C C 81 179.262 177.967 1.295 1
1 939 . 33 1 1 A 81 81 ASN CA C 81 55.504 56.461 -0.957 1
1 940 . 33 1 1 A 81 81 ASN CB C 81 37.517 37.825 -0.308 1
1 941 . 33 1 1 A 81 81 ASN N N 81 119.338 118.583 0.755 1
1 943 . 33 1 1 A 82 82 CYS H H 82 8.554 7.921 0.633 1
1 944 . 33 1 1 A 82 82 CYS HA H 82 3.792 4.084 -0.292 1
1 947 . 33 1 1 A 82 82 CYS C C 82 176.478 177.092 -0.614 1
1 948 . 33 1 1 A 82 82 CYS CA C 82 65.232 63.869 1.363 1
1 949 . 33 1 1 A 82 82 CYS CB C 82 26.762 27.076 -0.314 1
1 950 . 33 1 1 A 82 82 CYS N N 82 120.576 117.515 3.061 1
1 951 . 33 1 1 A 83 83 ARG H H 83 8.522 8.253 0.269 1
1 952 . 33 1 1 A 83 83 ARG HA H 83 3.932 4.169 -0.237 1
1 960 . 33 1 1 A 83 83 ARG C C 83 179.138 178.787 0.351 1
1 961 . 33 1 1 A 83 83 ARG CA C 83 60.443 59.022 1.421 1
1 962 . 33 1 1 A 83 83 ARG CB C 83 29.550 29.592 -0.042 1
1 965 . 33 1 1 A 83 83 ARG N N 83 123.035 119.791 3.244 1
1 967 . 33 1 1 A 84 84 ASP H H 84 7.791 8.381 -0.590 1
1 968 . 33 1 1 A 84 84 ASP HA H 84 4.353 4.419 -0.066 1
1 971 . 33 1 1 A 84 84 ASP C C 84 178.649 178.734 -0.085 1
1 972 . 33 1 1 A 84 84 ASP CA C 84 57.767 57.563 0.204 1
1 973 . 33 1 1 A 84 84 ASP CB C 84 41.305 41.424 -0.119 1
1 974 . 33 1 1 A 84 84 ASP N N 84 120.332 119.463 0.869 1
1 975 . 33 1 1 A 85 85 THR H H 85 8.370 8.076 0.294 1
1 976 . 33 1 1 A 85 85 THR HA H 85 3.730 3.811 -0.081 1
1 981 . 33 1 1 A 85 85 THR C C 85 175.198 176.500 -1.302 1
1 982 . 33 1 1 A 85 85 THR CA C 85 66.830 66.193 0.637 1
1 983 . 33 1 1 A 85 85 THR CB C 85 68.533 68.456 0.077 1
1 985 . 33 1 1 A 85 85 THR N N 85 117.360 116.004 1.356 1
1 986 . 33 1 1 A 86 86 ALA H H 86 8.845 8.616 0.229 1
1 987 . 33 1 1 A 86 86 ALA HA H 86 3.991 4.164 -0.173 1
1 991 . 33 1 1 A 86 86 ALA C C 86 179.980 179.726 0.254 1
1 992 . 33 1 1 A 86 86 ALA CA C 86 55.769 55.651 0.118 1
1 993 . 33 1 1 A 86 86 ALA CB C 86 17.881 18.383 -0.502 1
1 994 . 33 1 1 A 86 86 ALA N N 86 123.613 123.159 0.454 1
1 995 . 33 1 1 A 87 87 LYS H H 87 7.686 8.341 -0.655 1
1 996 . 33 1 1 A 87 87 LYS HA H 87 4.099 4.012 0.087 1
1 1005 . 33 1 1 A 87 87 LYS C C 87 179.592 178.553 1.039 1
1 1006 . 33 1 1 A 87 87 LYS CA C 87 59.708 59.250 0.458 1
1 1007 . 33 1 1 A 87 87 LYS CB C 87 32.054 32.075 -0.021 1
1 1011 . 33 1 1 A 87 87 LYS N N 87 119.623 116.976 2.647 1
1 1012 . 33 1 1 A 88 88 ARG H H 88 7.683 7.582 0.101 1
1 1013 . 33 1 1 A 88 88 ARG HA H 88 4.051 4.141 -0.090 1
1 1020 . 33 1 1 A 88 88 ARG C C 88 180.053 178.801 1.252 1
1 1021 . 33 1 1 A 88 88 ARG CA C 88 59.558 58.880 0.678 1
1 1022 . 33 1 1 A 88 88 ARG CB C 88 29.684 29.779 -0.095 1
1 1025 . 33 1 1 A 88 88 ARG N N 88 120.788 119.330 1.458 1
1 1026 . 33 1 1 A 89 89 ASN H H 89 8.973 8.203 0.770 1
1 1027 . 33 1 1 A 89 89 ASN HA H 89 4.354 4.537 -0.183 1
1 1032 . 33 1 1 A 89 89 ASN C C 89 178.382 177.933 0.449 1
1 1033 . 33 1 1 A 89 89 ASN CA C 89 55.334 55.665 -0.331 1
1 1034 . 33 1 1 A 89 89 ASN CB C 89 37.864 38.530 -0.666 1
1 1035 . 33 1 1 A 89 89 ASN N N 89 121.012 117.877 3.135 1
1 1037 . 33 1 1 A 90 90 GLN H H 90 8.152 8.256 -0.104 1
1 1038 . 33 1 1 A 90 90 GLN HA H 90 4.020 4.050 -0.030 1
1 1045 . 33 1 1 A 90 90 GLN C C 90 179.075 178.766 0.309 1
1 1046 . 33 1 1 A 90 90 GLN CA C 90 59.318 58.838 0.480 1
1 1047 . 33 1 1 A 90 90 GLN CB C 90 28.049 27.943 0.106 1
1 1049 . 33 1 1 A 90 90 GLN N N 90 122.122 118.736 3.386 1
1 1051 . 33 1 1 A 91 91 GLN H H 91 7.514 8.167 -0.653 1
1 1052 . 33 1 1 A 91 91 GLN HA H 91 4.053 4.053 0.000 1
1 1059 . 33 1 1 A 91 91 GLN C C 91 177.081 177.979 -0.898 1
1 1060 . 33 1 1 A 91 91 GLN CA C 91 58.031 58.206 -0.175 1
1 1061 . 33 1 1 A 91 91 GLN CB C 91 28.365 27.463 0.902 1
1 1063 . 33 1 1 A 91 91 GLN N N 91 118.124 118.098 0.026 1
1 1065 . 33 1 1 A 92 92 ALA H H 92 7.704 7.114 0.590 1
1 1066 . 33 1 1 A 92 92 ALA HA H 92 4.246 4.258 -0.012 1
1 1070 . 33 1 1 A 92 92 ALA C C 92 178.450 177.737 0.713 1
1 1071 . 33 1 1 A 92 92 ALA CA C 92 52.671 52.677 -0.006 1
1 1072 . 33 1 1 A 92 92 ALA CB C 92 19.316 19.648 -0.332 1
1 1073 . 33 1 1 A 92 92 ALA N N 92 119.880 120.157 -0.277 1
1 1074 . 33 1 1 A 93 93 GLY H H 93 7.693 8.138 -0.445 1
1 1075 . 33 1 1 A 93 93 GLY HA2 H 93 3.941 3.961 -0.020 1
1 1076 . 33 1 1 A 93 93 GLY HA3 H 93 3.744 3.961 -0.217 1
1 1077 . 33 1 1 A 93 93 GLY C C 93 174.344 173.948 0.396 1
1 1078 . 33 1 1 A 93 93 GLY CA C 93 45.949 45.318 0.631 1
1 1079 . 33 1 1 A 93 93 GLY N N 93 105.347 106.618 -1.271 1
1 1080 . 33 1 1 A 94 94 ASN H H 94 7.076 7.788 -0.712 1
1 1081 . 33 1 1 A 94 94 ASN HA H 94 4.115 4.801 -0.686 1
1 1085 . 33 1 1 A 94 94 ASN C C 94 175.410 175.536 -0.126 1
1 1086 . 33 1 1 A 94 94 ASN CA C 94 52.651 52.102 0.549 1
1 1087 . 33 1 1 A 94 94 ASN CB C 94 38.330 39.796 -1.466 1
1 1088 . 33 1 1 A 94 94 ASN N N 94 115.747 118.502 -2.755 1
1 1090 . 33 1 1 A 95 95 GLY H H 95 8.236 8.030 0.206 1
1 1091 . 33 1 1 A 95 95 GLY HA2 H 95 3.633 3.868 -0.235 1
1 1092 . 33 1 1 A 95 95 GLY HA3 H 95 3.633 3.926 -0.293 1
1 1093 . 33 1 1 A 95 95 GLY C C 95 174.450 173.714 0.736 1
1 1094 . 33 1 1 A 95 95 GLY CA C 95 45.522 45.442 0.080 1
1 1095 . 33 1 1 A 95 95 GLY N N 95 109.166 108.981 0.185 1
1 1096 . 33 1 1 A 96 96 TRP H H 96 7.899 7.423 0.476 1
1 1097 . 33 1 1 A 96 96 TRP HA H 96 5.241 4.955 0.286 1
1 1106 . 33 1 1 A 96 96 TRP C C 96 175.661 176.104 -0.443 1
1 1107 . 33 1 1 A 96 96 TRP CA C 96 55.090 57.135 -2.045 1
1 1108 . 33 1 1 A 96 96 TRP CB C 96 27.138 31.598 -4.460 1
1 1114 . 33 1 1 A 96 96 TRP N N 96 122.840 120.758 2.082 1
1 1116 . 33 1 1 A 97 97 ASP H H 97 7.344 8.979 -1.635 1
1 1117 . 33 1 1 A 97 97 ASP HA H 97 4.829 4.336 0.493 1
1 1120 . 33 1 1 A 97 97 ASP C C 97 175.019 176.078 -1.059 1
1 1121 . 33 1 1 A 97 97 ASP CA C 97 52.149 56.314 -4.165 1
1 1122 . 33 1 1 A 97 97 ASP CB C 97 42.697 38.527 4.170 1
1 1123 . 33 1 1 A 97 97 ASP N N 97 126.861 117.187 9.674 1
1 1124 . 33 1 1 A 98 98 PHE H H 98 8.566 8.749 -0.183 1
1 1125 . 33 1 1 A 98 98 PHE HA H 98 3.727 4.196 -0.469 1
1 1133 . 33 1 1 A 98 98 PHE C C 98 177.443 177.248 0.195 1
1 1134 . 33 1 1 A 98 98 PHE CA C 98 62.471 61.125 1.346 1
1 1135 . 33 1 1 A 98 98 PHE CB C 98 39.919 39.838 0.081 1
1 1141 . 33 1 1 A 98 98 PHE N N 98 117.781 121.402 -3.621 1
1 1142 . 33 1 1 A 99 99 ASP H H 99 8.259 8.422 -0.163 1
1 1143 . 33 1 1 A 99 99 ASP HA H 99 3.960 4.097 -0.137 1
1 1146 . 33 1 1 A 99 99 ASP C C 99 178.132 178.335 -0.203 1
1 1147 . 33 1 1 A 99 99 ASP CA C 99 57.658 56.441 1.217 1
1 1148 . 33 1 1 A 99 99 ASP CB C 99 38.572 40.758 -2.186 1
1 1149 . 33 1 1 A 99 99 ASP N N 99 121.709 118.797 2.912 1
1 1150 . 33 1 1 A 100 100 MET H H 100 8.008 8.126 -0.118 1
1 1151 . 33 1 1 A 100 100 MET HA H 100 3.644 4.075 -0.431 1
1 1156 . 33 1 1 A 100 100 MET C C 100 180.008 176.381 3.627 1
1 1157 . 33 1 1 A 100 100 MET CA C 100 58.598 58.702 -0.104 1
1 1158 . 33 1 1 A 100 100 MET CB C 100 33.423 32.830 0.593 1
1 1160 . 33 1 1 A 100 100 MET N N 100 119.668 118.264 1.404 1
1 1161 . 33 1 1 A 101 101 LEU H H 101 7.961 8.014 -0.053 1
1 1162 . 33 1 1 A 101 101 LEU HA H 101 3.523 4.647 -1.124 1
1 1172 . 33 1 1 A 101 101 LEU C C 101 173.873 176.198 -2.325 1
1 1173 . 33 1 1 A 101 101 LEU CA C 101 58.743 53.280 5.463 1
1 1174 . 33 1 1 A 101 101 LEU CB C 101 42.632 44.026 -1.394 1
1 1178 . 33 1 1 A 101 101 LEU N N 101 119.752 119.770 -0.018 1
1 1179 . 33 1 1 A 102 102 THR H H 102 6.955 9.214 -2.259 1
1 1180 . 33 1 1 A 102 102 THR HA H 102 4.134 4.190 -0.056 1
1 1185 . 33 1 1 A 102 102 THR C C 102 176.513 174.414 2.099 1
1 1186 . 33 1 1 A 102 102 THR CA C 102 61.125 62.236 -1.111 1
1 1187 . 33 1 1 A 102 102 THR CB C 102 71.415 68.095 3.320 1
1 1189 . 33 1 1 A 102 102 THR N N 102 124.665 122.269 2.396 1
1 1190 . 33 1 1 A 103 103 GLY H H 103 7.816 8.729 -0.913 1
1 1191 . 33 1 1 A 103 103 GLY HA2 H 103 3.824 3.929 -0.105 1
1 1192 . 33 1 1 A 103 103 GLY HA3 H 103 3.824 4.150 -0.326 1
1 1193 . 33 1 1 A 103 103 GLY C C 103 174.126 174.787 -0.661 1
1 1194 . 33 1 1 A 103 103 GLY CA C 103 47.805 45.935 1.870 1
1 1195 . 33 1 1 A 103 103 GLY N N 103 114.191 114.414 -0.223 1
1 1196 . 33 1 1 A 104 104 SER H H 104 8.860 8.559 0.301 1
1 1197 . 33 1 1 A 104 104 SER HA H 104 4.758 4.091 0.667 1
1 1200 . 33 1 1 A 104 104 SER C C 104 174.591 174.518 0.073 1
1 1201 . 33 1 1 A 104 104 SER CA C 104 56.755 59.065 -2.310 1
1 1202 . 33 1 1 A 104 104 SER CB C 104 65.050 61.316 3.734 1
1 1203 . 33 1 1 A 104 104 SER N N 104 114.771 110.740 4.031 1
1 1204 . 33 1 1 A 105 105 GLY H H 105 8.788 7.660 1.128 1
1 1205 . 33 1 1 A 105 105 GLY HA2 H 105 3.733 3.732 0.001 1
1 1206 . 33 1 1 A 105 105 GLY HA3 H 105 3.733 3.772 -0.039 1
1 1207 . 33 1 1 A 105 105 GLY CA C 105 47.247 46.772 0.475 1
1 1208 . 33 1 1 A 105 105 GLY N N 105 110.394 107.843 2.551 1
1 1209 . 33 1 1 A 106 106 ASN HA H 106 4.454 4.862 -0.408 1
1 1212 . 33 1 1 A 106 106 ASN C C 106 175.180 176.365 -1.185 1
1 1213 . 33 1 1 A 106 106 ASN CA C 106 54.492 54.474 0.018 1
1 1214 . 33 1 1 A 106 106 ASN CB C 106 37.282 40.867 -3.585 1
1 1215 . 33 1 1 A 107 107 TYR H H 107 8.241 7.773 0.468 1
1 1216 . 33 1 1 A 107 107 TYR HA H 107 4.335 4.764 -0.429 1
1 1223 . 33 1 1 A 107 107 TYR C C 107 173.954 175.086 -1.132 1
1 1224 . 33 1 1 A 107 107 TYR CA C 107 57.727 58.428 -0.701 1
1 1225 . 33 1 1 A 107 107 TYR CB C 107 37.063 39.315 -2.252 1
1 1230 . 33 1 1 A 107 107 TYR N N 107 120.708 115.948 4.760 1
1 1231 . 33 1 1 A 108 108 SER H H 108 7.117 7.503 -0.386 1
1 1232 . 33 1 1 A 108 108 SER HA H 108 4.221 4.208 0.013 1
1 1235 . 33 1 1 A 108 108 SER C C 108 174.834 173.724 1.110 1
1 1236 . 33 1 1 A 108 108 SER CA C 108 59.859 59.712 0.147 1
1 1237 . 33 1 1 A 108 108 SER CB C 108 63.846 62.821 1.025 1
1 1238 . 33 1 1 A 108 108 SER N N 108 113.362 116.092 -2.730 1
1 1239 . 33 1 1 A 109 109 SER H H 109 8.053 8.559 -0.506 1
1 1240 . 33 1 1 A 109 109 SER HA H 109 4.560 4.353 0.207 1
1 1243 . 33 1 1 A 109 109 SER CA C 109 57.141 60.731 -3.590 1
1 1244 . 33 1 1 A 109 109 SER CB C 109 64.874 61.968 2.906 1
1 1245 . 33 1 1 A 109 109 SER N N 109 116.657 116.908 -0.251 1
1 1246 . 33 1 1 A 110 110 THR HA H 110 3.541 3.933 -0.392 1
1 1251 . 33 1 1 A 110 110 THR C C 110 175.477 176.053 -0.576 1
1 1252 . 33 1 1 A 110 110 THR CA C 110 66.443 67.250 -0.807 1
1 1253 . 33 1 1 A 110 110 THR CB C 110 68.091 68.754 -0.663 1
1 1255 . 33 1 1 A 111 111 ASP H H 111 8.224 8.474 -0.250 1
1 1256 . 33 1 1 A 111 111 ASP HA H 111 4.237 4.344 -0.107 1
1 1259 . 33 1 1 A 111 111 ASP C C 111 177.520 178.196 -0.676 1
1 1260 . 33 1 1 A 111 111 ASP CA C 111 57.559 57.613 -0.054 1
1 1261 . 33 1 1 A 111 111 ASP CB C 111 40.292 42.215 -1.923 1
1 1262 . 33 1 1 A 111 111 ASP N N 111 119.490 121.270 -1.780 1
1 1263 . 33 1 1 A 112 112 ALA H H 112 7.431 8.011 -0.580 1
1 1264 . 33 1 1 A 112 112 ALA HA H 112 4.191 4.122 0.069 1
1 1268 . 33 1 1 A 112 112 ALA C C 112 180.646 179.431 1.215 1
1 1269 . 33 1 1 A 112 112 ALA CA C 112 54.534 55.107 -0.573 1
1 1270 . 33 1 1 A 112 112 ALA CB C 112 18.992 18.755 0.237 1
1 1271 . 33 1 1 A 112 112 ALA N N 112 119.710 121.364 -1.654 1
1 1272 . 33 1 1 A 113 113 GLN H H 113 7.576 7.602 -0.026 1
1 1273 . 33 1 1 A 113 113 GLN HA H 113 3.562 4.063 -0.501 1
1 1278 . 33 1 1 A 113 113 GLN C C 113 176.756 177.939 -1.183 1
1 1279 . 33 1 1 A 113 113 GLN CA C 113 57.736 58.225 -0.489 1
1 1280 . 33 1 1 A 113 113 GLN CB C 113 29.110 28.395 0.715 1
1 1281 . 33 1 1 A 113 113 GLN N N 113 117.518 117.163 0.355 1
1 1283 . 33 1 1 A 114 114 MET H H 114 8.192 7.828 0.364 1
1 1284 . 33 1 1 A 114 114 MET HA H 114 4.231 4.012 0.219 1
1 1289 . 33 1 1 A 114 114 MET C C 114 175.648 177.860 -2.212 1
1 1290 . 33 1 1 A 114 114 MET CA C 114 57.446 58.568 -1.122 1
1 1291 . 33 1 1 A 114 114 MET CB C 114 33.570 31.999 1.571 1
1 1293 . 33 1 1 A 114 114 MET N N 114 111.509 119.767 -8.258 1
1 1294 . 33 1 1 A 115 115 GLN H H 115 6.940 7.451 -0.511 1
1 1295 . 33 1 1 A 115 115 GLN HA H 115 4.307 4.203 0.104 1
1 1302 . 33 1 1 A 115 115 GLN C C 115 176.270 175.928 0.342 1
1 1303 . 33 1 1 A 115 115 GLN CA C 115 54.680 57.596 -2.916 1
1 1304 . 33 1 1 A 115 115 GLN CB C 115 28.233 28.951 -0.718 1
1 1306 . 33 1 1 A 115 115 GLN N N 115 114.300 115.170 -0.870 1
1 1308 . 33 1 1 A 116 116 TYR H H 116 6.677 7.567 -0.890 1
1 1309 . 33 1 1 A 116 116 TYR HA H 116 4.193 3.795 0.398 1
1 1312 . 33 1 1 A 116 116 TYR C C 116 175.268 174.221 1.047 1
1 1313 . 33 1 1 A 116 116 TYR CA C 116 54.357 58.515 -4.158 1
1 1314 . 33 1 1 A 116 116 TYR CB C 116 35.498 36.150 -0.652 1
1 1315 . 33 1 1 A 116 116 TYR N N 116 117.919 119.236 -1.317 1
1 1316 . 33 1 1 A 117 117 ASP H H 117 8.081 8.184 -0.103 1
1 1317 . 33 1 1 A 117 117 ASP HA H 117 4.665 4.832 -0.167 1
1 1320 . 33 1 1 A 117 117 ASP CA C 117 52.422 50.361 2.061 1
1 1321 . 33 1 1 A 117 117 ASP CB C 117 42.416 41.353 1.063 1
1 1322 . 33 1 1 A 117 117 ASP N N 117 120.887 124.264 -3.377 1
1 1323 . 33 1 1 A 118 118 PRO C C 118 179.180 178.470 0.710 1
1 1324 . 33 1 1 A 118 118 PRO CA C 118 65.942 64.475 1.467 1
1 1325 . 33 1 1 A 118 118 PRO CB C 118 32.197 31.616 0.581 1
1 1326 . 33 1 1 A 119 119 GLY H H 119 9.742 7.944 1.798 1
1 1327 . 33 1 1 A 119 119 GLY C C 119 175.622 175.119 0.503 1
1 1328 . 33 1 1 A 119 119 GLY CA C 119 46.785 46.510 0.275 1
1 1329 . 33 1 1 A 119 119 GLY N N 119 106.412 106.091 0.321 1
1 1330 . 33 1 1 A 120 120 LEU H H 120 6.666 7.259 -0.593 1
1 1331 . 33 1 1 A 120 120 LEU HA H 120 3.365 3.398 -0.033 1
1 1341 . 33 1 1 A 120 120 LEU C C 120 179.262 178.388 0.874 1
1 1342 . 33 1 1 A 120 120 LEU CA C 120 56.605 57.385 -0.780 1
1 1343 . 33 1 1 A 120 120 LEU CB C 120 39.262 41.189 -1.927 1
1 1347 . 33 1 1 A 120 120 LEU N N 120 126.226 121.958 4.268 1
1 1348 . 33 1 1 A 121 121 PHE H H 121 7.356 8.412 -1.056 1
1 1349 . 33 1 1 A 121 121 PHE HA H 121 4.459 3.799 0.660 1
1 1352 . 33 1 1 A 121 121 PHE C C 121 179.716 177.517 2.199 1
1 1353 . 33 1 1 A 121 121 PHE CA C 121 62.838 61.950 0.888 1
1 1354 . 33 1 1 A 121 121 PHE CB C 121 37.603 39.258 -1.655 1
1 1355 . 33 1 1 A 121 121 PHE N N 121 117.437 119.318 -1.881 1
1 1356 . 33 1 1 A 122 122 ALA H H 122 7.926 7.753 0.173 1
1 1357 . 33 1 1 A 122 122 ALA HA H 122 4.523 3.772 0.751 1
1 1361 . 33 1 1 A 122 122 ALA C C 122 180.435 180.028 0.407 1
1 1362 . 33 1 1 A 122 122 ALA CA C 122 55.527 55.249 0.278 1
1 1363 . 33 1 1 A 122 122 ALA CB C 122 17.814 17.809 0.005 1
1 1364 . 33 1 1 A 122 122 ALA N N 122 121.068 121.030 0.038 1
1 1365 . 33 1 1 A 123 123 GLN H H 123 7.507 7.866 -0.359 1
1 1366 . 33 1 1 A 123 123 GLN HA H 123 4.153 3.964 0.189 1
1 1371 . 33 1 1 A 123 123 GLN C C 123 180.561 178.472 2.089 1
1 1372 . 33 1 1 A 123 123 GLN CA C 123 59.948 58.940 1.008 1
1 1373 . 33 1 1 A 123 123 GLN CB C 123 29.135 28.290 0.845 1
1 1375 . 33 1 1 A 123 123 GLN N N 123 120.324 117.118 3.206 1
1 1376 . 33 1 1 A 124 124 ILE H H 124 8.318 8.146 0.172 1
1 1377 . 33 1 1 A 124 124 ILE HA H 124 3.635 3.814 -0.179 1
1 1387 . 33 1 1 A 124 124 ILE C C 124 176.481 178.076 -1.595 1
1 1388 . 33 1 1 A 124 124 ILE CA C 124 66.432 64.933 1.499 1
1 1389 . 33 1 1 A 124 124 ILE CB C 124 39.168 37.915 1.253 1
1 1393 . 33 1 1 A 124 124 ILE N N 124 123.747 121.048 2.699 1
1 1394 . 33 1 1 A 125 125 GLN H H 125 8.474 7.581 0.893 1
1 1395 . 33 1 1 A 125 125 GLN HA H 125 4.264 3.964 0.300 1
1 1402 . 33 1 1 A 125 125 GLN C C 125 178.947 178.508 0.439 1
1 1403 . 33 1 1 A 125 125 GLN CA C 125 59.651 58.754 0.897 1
1 1404 . 33 1 1 A 125 125 GLN CB C 125 28.880 28.073 0.807 1
1 1406 . 33 1 1 A 125 125 GLN N N 125 120.368 118.481 1.887 1
1 1408 . 33 1 1 A 126 126 ALA H H 126 8.002 7.791 0.211 1
1 1409 . 33 1 1 A 126 126 ALA HA H 126 4.144 4.015 0.129 1
1 1413 . 33 1 1 A 126 126 ALA C C 126 179.316 179.952 -0.636 1
1 1414 . 33 1 1 A 126 126 ALA CA C 126 55.036 55.110 -0.074 1
1 1415 . 33 1 1 A 126 126 ALA CB C 126 18.087 18.460 -0.373 1
1 1416 . 33 1 1 A 126 126 ALA N N 126 121.661 122.933 -1.272 1
1 1417 . 33 1 1 A 127 127 ALA H H 127 7.823 8.416 -0.593 1
1 1418 . 33 1 1 A 127 127 ALA HA H 127 4.162 4.052 0.110 1
1 1422 . 33 1 1 A 127 127 ALA C C 127 180.707 179.316 1.391 1
1 1423 . 33 1 1 A 127 127 ALA CA C 127 55.080 54.913 0.167 1
1 1424 . 33 1 1 A 127 127 ALA CB C 127 19.354 18.247 1.107 1
1 1425 . 33 1 1 A 127 127 ALA N N 127 119.853 119.846 0.007 1
1 1426 . 33 1 1 A 128 128 ALA H H 128 8.936 7.689 1.247 1
1 1427 . 33 1 1 A 128 128 ALA HA H 128 3.928 3.709 0.219 1
1 1431 . 33 1 1 A 128 128 ALA C C 128 181.031 179.239 1.792 1
1 1432 . 33 1 1 A 128 128 ALA CA C 128 55.502 54.602 0.900 1
1 1433 . 33 1 1 A 128 128 ALA CB C 128 16.609 17.781 -1.172 1
1 1434 . 33 1 1 A 128 128 ALA N N 128 121.355 120.588 0.767 1
1 1435 . 33 1 1 A 129 129 THR H H 129 8.543 7.884 0.659 1
1 1436 . 33 1 1 A 129 129 THR HA H 129 4.015 3.732 0.283 1
1 1441 . 33 1 1 A 129 129 THR C C 129 177.332 176.501 0.831 1
1 1442 . 33 1 1 A 129 129 THR CA C 129 65.893 65.575 0.318 1
1 1443 . 33 1 1 A 129 129 THR CB C 129 68.566 68.204 0.362 1
1 1445 . 33 1 1 A 129 129 THR N N 129 112.709 111.262 1.447 1
1 1446 . 33 1 1 A 130 130 LYS H H 130 8.126 7.453 0.673 1
1 1447 . 33 1 1 A 130 130 LYS HA H 130 4.000 4.000 0.000 1
1 1456 . 33 1 1 A 130 130 LYS C C 130 179.082 178.646 0.436 1
1 1457 . 33 1 1 A 130 130 LYS CA C 130 60.299 58.888 1.411 1
1 1458 . 33 1 1 A 130 130 LYS CB C 130 32.767 32.153 0.614 1
1 1462 . 33 1 1 A 130 130 LYS N N 130 123.879 121.953 1.926 1
1 1463 . 33 1 1 A 131 131 ALA H H 131 7.184 7.835 -0.651 1
1 1464 . 33 1 1 A 131 131 ALA HA H 131 4.005 4.278 -0.273 1
1 1468 . 33 1 1 A 131 131 ALA C C 131 178.482 179.576 -1.094 1
1 1469 . 33 1 1 A 131 131 ALA CA C 131 55.027 55.187 -0.160 1
1 1470 . 33 1 1 A 131 131 ALA CB C 131 18.669 19.552 -0.883 1
1 1471 . 33 1 1 A 131 131 ALA N N 131 118.590 120.694 -2.104 1
1 1472 . 33 1 1 A 132 132 TRP H H 132 7.977 8.683 -0.706 1
1 1473 . 33 1 1 A 132 132 TRP HA H 132 4.001 4.279 -0.278 1
1 1480 . 33 1 1 A 132 132 TRP C C 132 177.332 175.848 1.484 1
1 1481 . 33 1 1 A 132 132 TRP CA C 132 60.431 57.415 3.016 1
1 1482 . 33 1 1 A 132 132 TRP CB C 132 27.786 27.694 0.092 1
1 1486 . 33 1 1 A 132 132 TRP N N 132 119.168 117.053 2.115 1
1 1488 . 33 1 1 A 133 133 ARG H H 133 8.006 8.034 -0.028 1
1 1489 . 33 1 1 A 133 133 ARG HA H 133 4.027 4.384 -0.357 1
1 1497 . 33 1 1 A 133 133 ARG C C 133 176.664 178.303 -1.639 1
1 1498 . 33 1 1 A 133 133 ARG CA C 133 59.355 57.108 2.247 1
1 1499 . 33 1 1 A 133 133 ARG CB C 133 30.451 32.253 -1.802 1
1 1502 . 33 1 1 A 133 133 ARG N N 133 113.062 120.567 -7.505 1
1 1504 . 33 1 1 A 134 134 LYS H H 134 7.322 7.933 -0.611 1
1 1505 . 33 1 1 A 134 134 LYS HA H 134 4.313 4.244 0.069 1
1 1514 . 33 1 1 A 134 134 LYS C C 134 176.282 176.176 0.106 1
1 1515 . 33 1 1 A 134 134 LYS CA C 134 54.922 57.423 -2.501 1
1 1516 . 33 1 1 A 134 134 LYS CB C 134 32.633 31.783 0.850 1
1 1520 . 33 1 1 A 134 134 LYS N N 134 118.170 116.936 1.234 1
1 1521 . 33 1 1 A 135 135 LEU H H 135 7.440 7.891 -0.451 1
1 1522 . 33 1 1 A 135 135 LEU HA H 135 4.174 4.547 -0.373 1
1 1532 . 33 1 1 A 135 135 LEU CA C 135 54.408 52.871 1.537 1
1 1533 . 33 1 1 A 135 135 LEU CB C 135 40.407 41.008 -0.601 1
1 1537 . 33 1 1 A 135 135 LEU N N 135 123.358 122.123 1.235 1
1 1538 . 33 1 1 A 136 136 PRO HA H 136 4.437 4.666 -0.229 1
1 1545 . 33 1 1 A 136 136 PRO C C 136 177.106 176.270 0.836 1
1 1546 . 33 1 1 A 136 136 PRO CA C 136 62.889 62.145 0.744 1
1 1547 . 33 1 1 A 136 136 PRO CB C 136 32.192 33.244 -1.052 1
1 1550 . 33 1 1 A 137 137 VAL H H 137 8.219 8.340 -0.121 1
1 1551 . 33 1 1 A 137 137 VAL HA H 137 4.077 4.216 -0.139 1
1 1559 . 33 1 1 A 137 137 VAL C C 137 176.305 175.772 0.533 1
1 1560 . 33 1 1 A 137 137 VAL CA C 137 61.958 61.334 0.624 1
1 1561 . 33 1 1 A 137 137 VAL CB C 137 32.755 30.536 2.219 1
1 1564 . 33 1 1 A 137 137 VAL N N 137 120.079 120.729 -0.650 1
1 1565 . 33 1 1 A 138 138 LYS H H 138 8.444 8.889 -0.445 1
1 1566 . 33 1 1 A 138 138 LYS HA H 138 4.316 3.879 0.437 1
1 1575 . 33 1 1 A 138 138 LYS C C 138 176.790 177.751 -0.961 1
1 1576 . 33 1 1 A 138 138 LYS CA C 138 56.792 58.841 -2.049 1
1 1577 . 33 1 1 A 138 138 LYS CB C 138 33.205 30.849 2.356 1
1 1581 . 33 1 1 A 138 138 LYS N N 138 126.449 122.645 3.804 1
1 1582 . 33 1 1 A 139 139 GLY H H 139 8.518 8.367 0.151 1
1 1583 . 33 1 1 A 139 139 GLY HA2 H 139 4.070 3.771 0.299 1
1 1584 . 33 1 1 A 139 139 GLY HA3 H 139 3.897 3.777 0.120 1
1 1585 . 33 1 1 A 139 139 GLY C C 139 172.874 174.204 -1.330 1
1 1586 . 33 1 1 A 139 139 GLY CA C 139 45.157 46.749 -1.592 1
1 1587 . 33 1 1 A 139 139 GLY N N 139 112.617 106.895 5.722 1
1 6 . 34 1 1 A 2 2 VAL H H 2 8.992 8.677 0.315 1
1 7 . 34 1 1 A 2 2 VAL HA H 2 5.370 4.784 0.586 1
1 15 . 34 1 1 A 2 2 VAL C C 2 174.325 174.140 0.185 1
1 16 . 34 1 1 A 2 2 VAL CA C 2 61.267 60.484 0.783 1
1 17 . 34 1 1 A 2 2 VAL CB C 2 33.890 36.304 -2.414 1
1 20 . 34 1 1 A 2 2 VAL N N 2 126.939 123.142 3.797 1
1 21 . 34 1 1 A 3 3 THR H H 3 8.912 8.678 0.234 1
1 22 . 34 1 1 A 3 3 THR HA H 3 4.505 5.064 -0.559 1
1 27 . 34 1 1 A 3 3 THR C C 3 172.710 172.005 0.705 1
1 28 . 34 1 1 A 3 3 THR CA C 3 59.689 59.378 0.311 1
1 29 . 34 1 1 A 3 3 THR CB C 3 72.398 71.776 0.622 1
1 31 . 34 1 1 A 3 3 THR N N 3 118.091 121.227 -3.136 1
1 32 . 34 1 1 A 4 4 GLU H H 4 8.631 8.799 -0.168 1
1 33 . 34 1 1 A 4 4 GLU HA H 4 5.788 4.931 0.857 1
1 38 . 34 1 1 A 4 4 GLU C C 4 175.758 173.787 1.971 1
1 39 . 34 1 1 A 4 4 GLU CA C 4 54.902 54.612 0.290 1
1 40 . 34 1 1 A 4 4 GLU CB C 4 35.097 33.727 1.370 1
1 42 . 34 1 1 A 4 4 GLU N N 4 120.966 123.215 -2.249 1
1 43 . 34 1 1 A 5 5 THR H H 5 9.188 8.573 0.615 1
1 44 . 34 1 1 A 5 5 THR HA H 5 4.739 5.030 -0.291 1
1 49 . 34 1 1 A 5 5 THR C C 5 172.757 172.740 0.017 1
1 50 . 34 1 1 A 5 5 THR CA C 5 60.382 59.484 0.898 1
1 51 . 34 1 1 A 5 5 THR CB C 5 71.558 72.070 -0.512 1
1 53 . 34 1 1 A 5 5 THR N N 5 119.366 114.947 4.419 1
1 54 . 34 1 1 A 6 6 VAL H H 6 8.476 8.863 -0.387 1
1 55 . 34 1 1 A 6 6 VAL HA H 6 5.026 5.468 -0.442 1
1 63 . 34 1 1 A 6 6 VAL C C 6 176.674 173.468 3.206 1
1 64 . 34 1 1 A 6 6 VAL CA C 6 61.008 59.451 1.557 1
1 65 . 34 1 1 A 6 6 VAL CB C 6 33.861 35.720 -1.859 1
1 68 . 34 1 1 A 6 6 VAL N N 6 121.384 119.383 2.001 1
1 69 . 34 1 1 A 7 7 ASP H H 7 8.848 8.982 -0.134 1
1 70 . 34 1 1 A 7 7 ASP HA H 7 4.797 5.104 -0.307 1
1 73 . 34 1 1 A 7 7 ASP CA C 7 52.834 53.085 -0.251 1
1 74 . 34 1 1 A 7 7 ASP CB C 7 42.219 43.091 -0.872 1
1 75 . 34 1 1 A 7 7 ASP N N 7 127.061 125.224 1.837 1
1 76 . 34 1 1 A 8 8 GLY C C 8 175.143 174.898 0.245 1
1 77 . 34 1 1 A 8 8 GLY CA C 8 46.553 47.020 -0.467 1
1 78 . 34 1 1 A 9 9 GLN H H 9 8.408 7.673 0.735 1
1 79 . 34 1 1 A 9 9 GLN HA H 9 4.541 4.244 0.297 1
1 86 . 34 1 1 A 9 9 GLN C C 9 176.463 176.657 -0.194 1
1 87 . 34 1 1 A 9 9 GLN CA C 9 55.167 55.339 -0.172 1
1 88 . 34 1 1 A 9 9 GLN CB C 9 29.376 27.849 1.527 1
1 90 . 34 1 1 A 9 9 GLN N N 9 118.300 116.648 1.652 1
1 92 . 34 1 1 A 10 10 GLY H H 10 8.162 8.359 -0.197 1
1 93 . 34 1 1 A 10 10 GLY HA2 H 10 4.174 3.897 0.277 1
1 94 . 34 1 1 A 10 10 GLY HA3 H 10 3.521 3.908 -0.387 1
1 95 . 34 1 1 A 10 10 GLY C C 10 174.092 174.016 0.076 1
1 96 . 34 1 1 A 10 10 GLY CA C 10 45.558 46.072 -0.514 1
1 97 . 34 1 1 A 10 10 GLY N N 10 108.747 111.044 -2.297 1
1 98 . 34 1 1 A 11 11 GLN H H 11 8.507 7.427 1.080 1
1 99 . 34 1 1 A 11 11 GLN HA H 11 4.202 4.921 -0.719 1
1 106 . 34 1 1 A 11 11 GLN C C 11 173.992 174.549 -0.557 1
1 107 . 34 1 1 A 11 11 GLN CA C 11 55.098 54.405 0.693 1
1 108 . 34 1 1 A 11 11 GLN CB C 11 29.097 31.613 -2.516 1
1 110 . 34 1 1 A 11 11 GLN N N 11 122.979 116.254 6.725 1
1 112 . 34 1 1 A 12 12 ALA H H 12 8.259 8.999 -0.740 1
1 113 . 34 1 1 A 12 12 ALA HA H 12 5.156 5.547 -0.391 1
1 117 . 34 1 1 A 12 12 ALA C C 12 177.284 176.328 0.956 1
1 118 . 34 1 1 A 12 12 ALA CA C 12 51.087 50.933 0.154 1
1 119 . 34 1 1 A 12 12 ALA CB C 12 20.500 21.877 -1.377 1
1 120 . 34 1 1 A 12 12 ALA N N 12 127.100 122.770 4.330 1
1 121 . 34 1 1 A 13 13 TRP H H 13 9.245 9.112 0.133 1
1 122 . 34 1 1 A 13 13 TRP HA H 13 4.717 5.713 -0.996 1
1 131 . 34 1 1 A 13 13 TRP C C 13 175.108 174.436 0.672 1
1 132 . 34 1 1 A 13 13 TRP CA C 13 55.966 55.363 0.603 1
1 133 . 34 1 1 A 13 13 TRP CB C 13 31.912 33.050 -1.138 1
1 139 . 34 1 1 A 13 13 TRP N N 13 123.088 119.864 3.224 1
1 141 . 34 1 1 A 14 14 ARG H H 14 8.575 8.841 -0.266 1
1 142 . 34 1 1 A 14 14 ARG HA H 14 5.335 4.617 0.718 1
1 150 . 34 1 1 A 14 14 ARG C C 14 175.191 174.339 0.852 1
1 151 . 34 1 1 A 14 14 ARG CA C 14 53.106 55.244 -2.138 1
1 152 . 34 1 1 A 14 14 ARG CB C 14 32.749 31.635 1.114 1
1 154 . 34 1 1 A 14 14 ARG N N 14 121.163 121.197 -0.034 1
1 156 . 34 1 1 A 15 15 HIS H H 15 8.595 8.496 0.099 1
1 157 . 34 1 1 A 15 15 HIS HA H 15 4.790 5.075 -0.285 1
1 161 . 34 1 1 A 15 15 HIS C C 15 173.770 172.662 1.108 1
1 162 . 34 1 1 A 15 15 HIS CA C 15 55.289 55.053 0.236 1
1 163 . 34 1 1 A 15 15 HIS CB C 15 33.208 30.917 2.291 1
1 165 . 34 1 1 A 15 15 HIS N N 15 117.643 116.364 1.279 1
1 166 . 34 1 1 A 16 16 HIS H H 16 8.993 8.741 0.252 1
1 167 . 34 1 1 A 16 16 HIS HA H 16 5.158 4.938 0.220 1
1 171 . 34 1 1 A 16 16 HIS C C 16 173.608 174.388 -0.780 1
1 172 . 34 1 1 A 16 16 HIS CA C 16 56.450 54.125 2.325 1
1 173 . 34 1 1 A 16 16 HIS CB C 16 34.171 31.374 2.797 1
1 175 . 34 1 1 A 16 16 HIS N N 16 123.520 117.406 6.114 1
1 176 . 34 1 1 A 17 17 ASN H H 17 7.829 8.696 -0.867 1
1 177 . 34 1 1 A 17 17 ASN HA H 17 4.713 5.020 -0.307 1
1 182 . 34 1 1 A 17 17 ASN C C 17 173.682 175.172 -1.490 1
1 183 . 34 1 1 A 17 17 ASN CA C 17 51.822 51.545 0.277 1
1 184 . 34 1 1 A 17 17 ASN CB C 17 43.176 41.568 1.608 1
1 185 . 34 1 1 A 17 17 ASN N N 17 122.213 118.146 4.067 1
1 187 . 34 1 1 A 18 18 GLY H H 18 8.423 8.480 -0.057 1
1 188 . 34 1 1 A 18 18 GLY HA2 H 18 3.931 3.675 0.256 1
1 189 . 34 1 1 A 18 18 GLY HA3 H 18 3.707 3.915 -0.208 1
1 190 . 34 1 1 A 18 18 GLY C C 18 173.985 173.311 0.674 1
1 191 . 34 1 1 A 18 18 GLY CA C 18 43.949 45.681 -1.732 1
1 192 . 34 1 1 A 18 18 GLY N N 18 106.991 108.553 -1.562 1
1 193 . 34 1 1 A 19 19 PHE H H 19 8.338 7.969 0.369 1
1 194 . 34 1 1 A 19 19 PHE HA H 19 4.068 4.567 -0.499 1
1 197 . 34 1 1 A 19 19 PHE C C 19 176.568 175.143 1.425 1
1 198 . 34 1 1 A 19 19 PHE CA C 19 59.338 59.386 -0.048 1
1 199 . 34 1 1 A 19 19 PHE CB C 19 40.201 39.628 0.573 1
1 200 . 34 1 1 A 19 19 PHE N N 19 116.857 122.650 -5.793 1
1 201 . 34 1 1 A 20 20 ASP H H 20 8.794 8.817 -0.023 1
1 202 . 34 1 1 A 20 20 ASP HA H 20 4.485 4.708 -0.223 1
1 205 . 34 1 1 A 20 20 ASP C C 20 177.379 177.053 0.326 1
1 206 . 34 1 1 A 20 20 ASP CA C 20 54.140 54.988 -0.848 1
1 207 . 34 1 1 A 20 20 ASP CB C 20 41.915 40.489 1.426 1
1 208 . 34 1 1 A 20 20 ASP N N 20 123.025 124.889 -1.864 1
1 209 . 34 1 1 A 21 21 PHE H H 21 8.862 9.159 -0.297 1
1 210 . 34 1 1 A 21 21 PHE HA H 21 4.087 4.113 -0.026 1
1 218 . 34 1 1 A 21 21 PHE C C 21 176.952 177.206 -0.254 1
1 219 . 34 1 1 A 21 21 PHE CA C 21 61.095 61.910 -0.815 1
1 220 . 34 1 1 A 21 21 PHE CB C 21 38.678 39.272 -0.594 1
1 226 . 34 1 1 A 21 21 PHE N N 21 127.163 125.873 1.290 1
1 227 . 34 1 1 A 22 22 ALA H H 22 8.561 8.368 0.193 1
1 228 . 34 1 1 A 22 22 ALA HA H 22 3.878 3.990 -0.112 1
1 232 . 34 1 1 A 22 22 ALA C C 22 180.710 180.002 0.708 1
1 233 . 34 1 1 A 22 22 ALA CA C 22 55.211 55.227 -0.016 1
1 234 . 34 1 1 A 22 22 ALA CB C 22 18.321 18.354 -0.033 1
1 235 . 34 1 1 A 22 22 ALA N N 22 120.293 121.306 -1.013 1
1 236 . 34 1 1 A 23 23 VAL H H 23 7.241 7.913 -0.672 1
1 237 . 34 1 1 A 23 23 VAL HA H 23 3.684 3.514 0.170 1
1 245 . 34 1 1 A 23 23 VAL C C 23 177.101 178.050 -0.949 1
1 246 . 34 1 1 A 23 23 VAL CA C 23 65.237 66.974 -1.737 1
1 247 . 34 1 1 A 23 23 VAL CB C 23 31.780 31.701 0.079 1
1 250 . 34 1 1 A 23 23 VAL N N 23 118.775 117.595 1.180 1
1 251 . 34 1 1 A 24 24 ILE H H 24 6.761 7.962 -1.201 1
1 252 . 34 1 1 A 24 24 ILE HA H 24 3.196 3.504 -0.308 1
1 262 . 34 1 1 A 24 24 ILE C C 24 177.287 178.261 -0.974 1
1 263 . 34 1 1 A 24 24 ILE CA C 24 63.404 65.616 -2.212 1
1 264 . 34 1 1 A 24 24 ILE CB C 24 36.294 37.596 -1.302 1
1 268 . 34 1 1 A 24 24 ILE N N 24 119.036 119.729 -0.693 1
1 269 . 34 1 1 A 25 25 LYS H H 25 8.032 8.140 -0.108 1
1 270 . 34 1 1 A 25 25 LYS HA H 25 3.809 3.733 0.076 1
1 279 . 34 1 1 A 25 25 LYS C C 25 179.450 178.943 0.507 1
1 280 . 34 1 1 A 25 25 LYS CA C 25 59.621 59.535 0.086 1
1 281 . 34 1 1 A 25 25 LYS CB C 25 32.259 32.254 0.005 1
1 285 . 34 1 1 A 25 25 LYS N N 25 118.368 120.253 -1.885 1
1 286 . 34 1 1 A 26 26 GLU H H 26 7.845 7.817 0.028 1
1 287 . 34 1 1 A 26 26 GLU HA H 26 4.021 4.362 -0.341 1
1 292 . 34 1 1 A 26 26 GLU C C 26 179.191 179.598 -0.407 1
1 293 . 34 1 1 A 26 26 GLU CA C 26 59.530 59.002 0.528 1
1 294 . 34 1 1 A 26 26 GLU CB C 26 29.449 29.860 -0.411 1
1 296 . 34 1 1 A 26 26 GLU N N 26 120.522 119.560 0.962 1
1 297 . 34 1 1 A 27 27 LEU H H 27 8.165 8.495 -0.330 1
1 298 . 34 1 1 A 27 27 LEU HA H 27 4.163 4.202 -0.039 1
1 308 . 34 1 1 A 27 27 LEU C C 27 177.256 178.364 -1.108 1
1 309 . 34 1 1 A 27 27 LEU CA C 27 58.049 57.575 0.474 1
1 310 . 34 1 1 A 27 27 LEU CB C 27 41.365 41.353 0.012 1
1 314 . 34 1 1 A 27 27 LEU N N 27 120.879 121.618 -0.739 1
1 315 . 34 1 1 A 28 28 LYS H H 28 8.902 8.130 0.772 1
1 316 . 34 1 1 A 28 28 LYS HA H 28 4.199 4.224 -0.025 1
1 317 . 34 1 1 A 28 28 LYS C C 28 179.707 179.474 0.233 1
1 318 . 34 1 1 A 28 28 LYS CA C 28 60.097 59.060 1.037 1
1 319 . 34 1 1 A 28 28 LYS CB C 28 33.420 31.728 1.692 1
1 320 . 34 1 1 A 28 28 LYS N N 28 120.050 119.410 0.640 1
1 321 . 34 1 1 A 29 29 THR H H 29 8.294 7.768 0.526 1
1 322 . 34 1 1 A 29 29 THR HA H 29 3.892 3.961 -0.069 1
1 327 . 34 1 1 A 29 29 THR C C 29 175.711 175.986 -0.275 1
1 328 . 34 1 1 A 29 29 THR CA C 29 66.846 66.706 0.140 1
1 329 . 34 1 1 A 29 29 THR CB C 29 68.794 68.772 0.022 1
1 331 . 34 1 1 A 29 29 THR N N 29 115.933 116.405 -0.472 1
1 332 . 34 1 1 A 30 30 ALA H H 30 8.244 8.507 -0.263 1
1 333 . 34 1 1 A 30 30 ALA HA H 30 4.241 4.241 0.000 1
1 337 . 34 1 1 A 30 30 ALA C C 30 179.128 179.520 -0.392 1
1 338 . 34 1 1 A 30 30 ALA CA C 30 55.714 55.865 -0.151 1
1 339 . 34 1 1 A 30 30 ALA CB C 30 18.955 18.420 0.535 1
1 340 . 34 1 1 A 30 30 ALA N N 30 124.617 122.944 1.673 1
1 341 . 34 1 1 A 31 31 ALA H H 31 8.968 8.727 0.241 1
1 342 . 34 1 1 A 31 31 ALA HA H 31 3.890 4.087 -0.197 1
1 346 . 34 1 1 A 31 31 ALA C C 31 180.352 179.526 0.826 1
1 347 . 34 1 1 A 31 31 ALA CA C 31 55.454 55.561 -0.107 1
1 348 . 34 1 1 A 31 31 ALA CB C 31 17.124 18.518 -1.394 1
1 349 . 34 1 1 A 31 31 ALA N N 31 119.327 119.919 -0.592 1
1 350 . 34 1 1 A 32 32 SER H H 32 7.995 7.962 0.033 1
1 351 . 34 1 1 A 32 32 SER HA H 32 4.238 4.197 0.041 1
1 354 . 34 1 1 A 32 32 SER C C 32 175.612 176.903 -1.291 1
1 355 . 34 1 1 A 32 32 SER CA C 32 61.203 61.563 -0.360 1
1 356 . 34 1 1 A 32 32 SER CB C 32 63.406 62.515 0.891 1
1 357 . 34 1 1 A 32 32 SER N N 32 111.962 113.064 -1.102 1
1 358 . 34 1 1 A 33 33 GLN H H 33 8.333 7.635 0.698 1
1 359 . 34 1 1 A 33 33 GLN HA H 33 3.992 4.229 -0.237 1
1 366 . 34 1 1 A 33 33 GLN C C 33 177.486 176.977 0.509 1
1 367 . 34 1 1 A 33 33 GLN CA C 33 58.277 57.884 0.393 1
1 368 . 34 1 1 A 33 33 GLN CB C 33 29.140 29.576 -0.436 1
1 370 . 34 1 1 A 33 33 GLN N N 33 119.527 120.624 -1.097 1
1 372 . 34 1 1 A 34 34 TYR H H 34 8.587 8.343 0.244 1
1 373 . 34 1 1 A 34 34 TYR HA H 34 4.792 4.856 -0.064 1
1 380 . 34 1 1 A 34 34 TYR C C 34 176.499 176.910 -0.411 1
1 381 . 34 1 1 A 34 34 TYR CA C 34 57.711 58.040 -0.329 1
1 382 . 34 1 1 A 34 34 TYR CB C 34 39.561 38.766 0.795 1
1 387 . 34 1 1 A 34 34 TYR N N 34 114.610 115.723 -1.113 1
1 388 . 34 1 1 A 35 35 GLY H H 35 7.346 8.427 -1.081 1
1 389 . 34 1 1 A 35 35 GLY HA2 H 35 4.785 3.934 0.851 1
1 390 . 34 1 1 A 35 35 GLY HA3 H 35 4.007 4.009 -0.002 1
1 391 . 34 1 1 A 35 35 GLY C C 35 175.796 175.591 0.205 1
1 392 . 34 1 1 A 35 35 GLY CA C 35 44.355 47.376 -3.021 1
1 393 . 34 1 1 A 35 35 GLY N N 35 108.501 109.307 -0.806 1
1 394 . 34 1 1 A 36 36 ALA H H 36 9.363 7.603 1.760 1
1 395 . 34 1 1 A 36 36 ALA HA H 36 4.217 4.448 -0.231 1
1 399 . 34 1 1 A 36 36 ALA C C 36 178.039 177.254 0.785 1
1 400 . 34 1 1 A 36 36 ALA CA C 36 56.114 52.331 3.783 1
1 401 . 34 1 1 A 36 36 ALA CB C 36 19.179 19.160 0.019 1
1 402 . 34 1 1 A 36 36 ALA N N 36 125.811 123.433 2.378 1
1 403 . 34 1 1 A 37 37 THR H H 37 8.070 8.285 -0.215 1
1 404 . 34 1 1 A 37 37 THR HA H 37 4.570 4.357 0.213 1
1 409 . 34 1 1 A 37 37 THR C C 37 173.685 173.091 0.594 1
1 410 . 34 1 1 A 37 37 THR CA C 37 59.822 62.024 -2.202 1
1 411 . 34 1 1 A 37 37 THR CB C 37 68.267 67.948 0.319 1
1 413 . 34 1 1 A 37 37 THR N N 37 129.410 115.907 13.503 1
1 414 . 34 1 1 A 38 38 ALA H H 38 6.853 7.841 -0.988 1
1 415 . 34 1 1 A 38 38 ALA HA H 38 4.601 4.921 -0.320 1
1 419 . 34 1 1 A 38 38 ALA CA C 38 50.758 48.477 2.281 1
1 420 . 34 1 1 A 38 38 ALA CB C 38 18.325 20.527 -2.202 1
1 421 . 34 1 1 A 38 38 ALA N N 38 124.674 128.375 -3.701 1
1 422 . 34 1 1 A 40 40 TYR HA H 40 4.032 4.082 -0.050 1
1 429 . 34 1 1 A 40 40 TYR C C 40 176.456 177.208 -0.752 1
1 430 . 34 1 1 A 40 40 TYR CA C 40 61.010 61.819 -0.809 1
1 431 . 34 1 1 A 40 40 TYR CB C 40 39.286 38.822 0.464 1
1 436 . 34 1 1 A 41 41 THR H H 41 6.874 8.349 -1.475 1
1 437 . 34 1 1 A 41 41 THR HA H 41 3.616 4.049 -0.433 1
1 442 . 34 1 1 A 41 41 THR C C 41 176.930 177.455 -0.525 1
1 443 . 34 1 1 A 41 41 THR CA C 41 65.557 66.931 -1.374 1
1 444 . 34 1 1 A 41 41 THR CB C 41 68.228 68.694 -0.466 1
1 446 . 34 1 1 A 41 41 THR N N 41 115.143 113.780 1.363 1
1 447 . 34 1 1 A 42 42 LEU H H 42 8.623 7.461 1.162 1
1 448 . 34 1 1 A 42 42 LEU HA H 42 3.708 4.030 -0.322 1
1 458 . 34 1 1 A 42 42 LEU C C 42 178.206 178.981 -0.775 1
1 459 . 34 1 1 A 42 42 LEU CA C 42 57.417 57.798 -0.381 1
1 460 . 34 1 1 A 42 42 LEU CB C 42 41.342 41.208 0.134 1
1 464 . 34 1 1 A 42 42 LEU N N 42 120.418 118.231 2.187 1
1 465 . 34 1 1 A 43 43 ALA H H 43 7.735 7.665 0.070 1
1 466 . 34 1 1 A 43 43 ALA HA H 43 4.020 4.034 -0.014 1
1 470 . 34 1 1 A 43 43 ALA C C 43 180.826 180.340 0.486 1
1 471 . 34 1 1 A 43 43 ALA CA C 43 54.925 54.829 0.096 1
1 472 . 34 1 1 A 43 43 ALA CB C 43 17.506 18.166 -0.660 1
1 473 . 34 1 1 A 43 43 ALA N N 43 120.203 121.795 -1.592 1
1 474 . 34 1 1 A 44 44 ILE H H 44 7.149 7.416 -0.267 1
1 475 . 34 1 1 A 44 44 ILE HA H 44 3.603 3.633 -0.030 1
1 485 . 34 1 1 A 44 44 ILE C C 44 178.594 178.206 0.388 1
1 486 . 34 1 1 A 44 44 ILE CA C 44 64.782 64.383 0.399 1
1 487 . 34 1 1 A 44 44 ILE CB C 44 37.472 37.567 -0.095 1
1 491 . 34 1 1 A 44 44 ILE N N 44 118.881 119.465 -0.584 1
1 492 . 34 1 1 A 45 45 VAL H H 45 7.968 7.858 0.110 1
1 493 . 34 1 1 A 45 45 VAL HA H 45 2.925 3.353 -0.428 1
1 501 . 34 1 1 A 45 45 VAL C C 45 177.023 177.891 -0.868 1
1 502 . 34 1 1 A 45 45 VAL CA C 45 67.081 67.057 0.024 1
1 503 . 34 1 1 A 45 45 VAL CB C 45 30.854 31.275 -0.421 1
1 506 . 34 1 1 A 45 45 VAL N N 45 120.764 119.878 0.886 1
1 507 . 34 1 1 A 46 46 GLU H H 46 8.399 8.317 0.082 1
1 508 . 34 1 1 A 46 46 GLU HA H 46 3.848 3.955 -0.107 1
1 513 . 34 1 1 A 46 46 GLU C C 46 178.656 178.536 0.120 1
1 514 . 34 1 1 A 46 46 GLU CA C 46 59.491 58.847 0.644 1
1 515 . 34 1 1 A 46 46 GLU CB C 46 28.991 28.418 0.573 1
1 517 . 34 1 1 A 46 46 GLU N N 46 116.599 119.626 -3.027 1
1 518 . 34 1 1 A 47 47 SER H H 47 7.273 7.421 -0.148 1
1 519 . 34 1 1 A 47 47 SER HA H 47 4.287 4.186 0.101 1
1 521 . 34 1 1 A 47 47 SER CA C 47 61.047 61.084 -0.037 1
1 522 . 34 1 1 A 47 47 SER CB C 47 63.016 62.925 0.091 1
1 523 . 34 1 1 A 47 47 SER N N 47 113.609 116.021 -2.412 1
1 524 . 34 1 1 A 48 48 VAL H H 48 8.006 8.196 -0.190 1
1 525 . 34 1 1 A 48 48 VAL HA H 48 3.556 3.573 -0.017 1
1 533 . 34 1 1 A 48 48 VAL C C 48 177.257 176.784 0.473 1
1 534 . 34 1 1 A 48 48 VAL CA C 48 65.025 66.434 -1.409 1
1 535 . 34 1 1 A 48 48 VAL CB C 48 31.841 31.448 0.393 1
1 538 . 34 1 1 A 48 48 VAL N N 48 122.327 121.795 0.532 1
1 539 . 34 1 1 A 49 49 ALA H H 49 8.369 7.681 0.688 1
1 540 . 34 1 1 A 49 49 ALA HA H 49 4.115 4.183 -0.068 1
1 544 . 34 1 1 A 49 49 ALA C C 49 177.307 177.497 -0.190 1
1 545 . 34 1 1 A 49 49 ALA CA C 49 53.253 52.483 0.770 1
1 546 . 34 1 1 A 49 49 ALA CB C 49 20.131 18.829 1.302 1
1 547 . 34 1 1 A 49 49 ALA N N 49 118.050 120.521 -2.471 1
1 548 . 34 1 1 A 50 50 ASP H H 50 7.052 8.004 -0.952 1
1 549 . 34 1 1 A 50 50 ASP HA H 50 4.788 4.739 0.049 1
1 552 . 34 1 1 A 50 50 ASP C C 50 175.481 176.196 -0.715 1
1 553 . 34 1 1 A 50 50 ASP CA C 50 53.681 55.292 -1.611 1
1 554 . 34 1 1 A 50 50 ASP CB C 50 39.333 41.350 -2.017 1
1 555 . 34 1 1 A 50 50 ASP N N 50 116.997 117.464 -0.467 1
1 556 . 34 1 1 A 51 51 ASN H H 51 8.535 7.829 0.706 1
1 557 . 34 1 1 A 51 51 ASN HA H 51 4.628 5.514 -0.886 1
1 562 . 34 1 1 A 51 51 ASN C C 51 174.077 175.074 -0.997 1
1 563 . 34 1 1 A 51 51 ASN CA C 51 52.315 51.308 1.007 1
1 564 . 34 1 1 A 51 51 ASN CB C 51 41.928 40.608 1.320 1
1 565 . 34 1 1 A 51 51 ASN N N 51 118.626 114.698 3.928 1
1 567 . 34 1 1 A 52 52 TRP H H 52 8.555 8.667 -0.112 1
1 574 . 34 1 1 A 52 52 TRP C C 52 173.269 176.545 -3.276 1
1 575 . 34 1 1 A 52 52 TRP CA C 52 55.031 58.028 -2.997 1
1 576 . 34 1 1 A 52 52 TRP CB C 52 26.801 30.232 -3.431 1
1 582 . 34 1 1 A 52 52 TRP N N 52 120.693 121.878 -1.185 1
1 584 . 34 1 1 A 53 53 LEU H H 53 7.847 8.812 -0.965 1
1 585 . 34 1 1 A 53 53 LEU HA H 53 4.859 4.885 -0.026 1
1 595 . 34 1 1 A 53 53 LEU C C 53 177.397 175.129 2.268 1
1 596 . 34 1 1 A 53 53 LEU CA C 53 53.619 53.448 0.171 1
1 597 . 34 1 1 A 53 53 LEU CB C 53 41.812 45.575 -3.763 1
1 601 . 34 1 1 A 53 53 LEU N N 53 124.741 120.366 4.375 1
1 602 . 34 1 1 A 54 54 THR H H 54 8.850 8.140 0.710 1
1 603 . 34 1 1 A 54 54 THR HA H 54 4.598 4.527 0.071 1
1 608 . 34 1 1 A 54 54 THR CA C 54 60.531 58.543 1.988 1
1 609 . 34 1 1 A 54 54 THR CB C 54 67.183 70.617 -3.434 1
1 611 . 34 1 1 A 54 54 THR N N 54 113.407 110.304 3.103 1
1 612 . 34 1 1 A 55 55 PRO HA H 55 4.511 4.405 0.106 1
1 619 . 34 1 1 A 55 55 PRO C C 55 179.383 178.891 0.492 1
1 620 . 34 1 1 A 55 55 PRO CA C 55 67.159 65.644 1.515 1
1 621 . 34 1 1 A 55 55 PRO CB C 55 32.095 31.826 0.269 1
1 622 . 34 1 1 A 56 56 THR H H 56 8.575 8.104 0.471 1
1 623 . 34 1 1 A 56 56 THR HA H 56 4.229 4.012 0.217 1
1 628 . 34 1 1 A 56 56 THR C C 56 176.668 175.947 0.721 1
1 629 . 34 1 1 A 56 56 THR CA C 56 66.943 65.861 1.082 1
1 630 . 34 1 1 A 56 56 THR CB C 56 68.129 68.078 0.051 1
1 632 . 34 1 1 A 56 56 THR N N 56 114.855 114.666 0.189 1
1 633 . 34 1 1 A 57 57 ASP H H 57 8.730 8.058 0.672 1
1 634 . 34 1 1 A 57 57 ASP HA H 57 4.425 3.474 0.951 1
1 637 . 34 1 1 A 57 57 ASP C C 57 178.351 178.229 0.122 1
1 638 . 34 1 1 A 57 57 ASP CA C 57 57.963 56.966 0.997 1
1 639 . 34 1 1 A 57 57 ASP CB C 57 40.134 41.448 -1.314 1
1 640 . 34 1 1 A 57 57 ASP N N 57 126.239 120.725 5.514 1
1 641 . 34 1 1 A 58 58 TRP H H 58 8.244 8.466 -0.222 1
1 642 . 34 1 1 A 58 58 TRP HA H 58 4.030 4.382 -0.352 1
1 650 . 34 1 1 A 58 58 TRP C C 58 177.432 179.134 -1.702 1
1 651 . 34 1 1 A 58 58 TRP CA C 58 62.731 60.044 2.687 1
1 652 . 34 1 1 A 58 58 TRP CB C 58 29.122 29.186 -0.064 1
1 657 . 34 1 1 A 58 58 TRP N N 58 119.241 120.706 -1.465 1
1 659 . 34 1 1 A 59 59 ASN H H 59 8.098 8.763 -0.665 1
1 660 . 34 1 1 A 59 59 ASN HA H 59 4.424 4.366 0.058 1
1 663 . 34 1 1 A 59 59 ASN C C 59 176.952 178.095 -1.143 1
1 664 . 34 1 1 A 59 59 ASN CA C 59 58.135 56.394 1.741 1
1 665 . 34 1 1 A 59 59 ASN CB C 59 40.168 38.135 2.033 1
1 666 . 34 1 1 A 59 59 ASN N N 59 115.747 118.105 -2.358 1
1 667 . 34 1 1 A 60 60 THR H H 60 8.712 7.708 1.004 1
1 668 . 34 1 1 A 60 60 THR HA H 60 3.717 3.996 -0.279 1
1 673 . 34 1 1 A 60 60 THR C C 60 176.044 176.254 -0.210 1
1 674 . 34 1 1 A 60 60 THR CA C 60 66.576 67.398 -0.822 1
1 675 . 34 1 1 A 60 60 THR CB C 60 69.251 68.197 1.054 1
1 677 . 34 1 1 A 60 60 THR N N 60 114.896 117.330 -2.434 1
1 678 . 34 1 1 A 61 61 LEU H H 61 8.485 8.069 0.416 1
1 679 . 34 1 1 A 61 61 LEU HA H 61 3.391 4.055 -0.664 1
1 689 . 34 1 1 A 61 61 LEU C C 61 177.433 178.538 -1.105 1
1 690 . 34 1 1 A 61 61 LEU CA C 61 58.354 58.330 0.024 1
1 691 . 34 1 1 A 61 61 LEU CB C 61 41.761 41.585 0.176 1
1 695 . 34 1 1 A 61 61 LEU N N 61 123.433 121.500 1.933 1
1 696 . 34 1 1 A 62 62 VAL H H 62 8.073 8.140 -0.067 1
1 697 . 34 1 1 A 62 62 VAL HA H 62 3.207 3.905 -0.698 1
1 705 . 34 1 1 A 62 62 VAL C C 62 177.585 177.703 -0.118 1
1 706 . 34 1 1 A 62 62 VAL CA C 62 67.345 65.037 2.308 1
1 707 . 34 1 1 A 62 62 VAL CB C 62 30.905 31.025 -0.120 1
1 710 . 34 1 1 A 62 62 VAL N N 62 116.018 118.509 -2.491 1
1 711 . 34 1 1 A 63 63 ARG H H 63 7.765 8.111 -0.346 1
1 712 . 34 1 1 A 63 63 ARG HA H 63 3.602 4.054 -0.452 1
1 719 . 34 1 1 A 63 63 ARG C C 63 177.818 178.286 -0.468 1
1 720 . 34 1 1 A 63 63 ARG CA C 63 58.049 57.991 0.058 1
1 721 . 34 1 1 A 63 63 ARG CB C 63 29.955 29.146 0.809 1
1 724 . 34 1 1 A 63 63 ARG N N 63 116.700 120.614 -3.914 1
1 725 . 34 1 1 A 64 64 ALA H H 64 7.574 7.432 0.142 1
1 726 . 34 1 1 A 64 64 ALA HA H 64 4.158 4.404 -0.246 1
1 730 . 34 1 1 A 64 64 ALA C C 64 179.886 179.191 0.695 1
1 731 . 34 1 1 A 64 64 ALA CA C 64 54.007 54.078 -0.071 1
1 732 . 34 1 1 A 64 64 ALA CB C 64 19.147 19.899 -0.752 1
1 733 . 34 1 1 A 64 64 ALA N N 64 117.555 122.141 -4.586 1
1 734 . 34 1 1 A 65 65 VAL H H 65 7.554 7.990 -0.436 1
1 735 . 34 1 1 A 65 65 VAL HA H 65 4.253 3.877 0.376 1
1 743 . 34 1 1 A 65 65 VAL C C 65 174.180 176.302 -2.122 1
1 744 . 34 1 1 A 65 65 VAL CA C 65 62.683 65.448 -2.765 1
1 745 . 34 1 1 A 65 65 VAL CB C 65 33.458 31.282 2.176 1
1 748 . 34 1 1 A 65 65 VAL N N 65 110.013 115.940 -5.927 1
1 749 . 34 1 1 A 66 66 LEU H H 66 7.792 7.244 0.548 1
1 750 . 34 1 1 A 66 66 LEU HA H 66 4.790 4.787 0.003 1
1 760 . 34 1 1 A 66 66 LEU C C 66 177.537 175.286 2.251 1
1 761 . 34 1 1 A 66 66 LEU CA C 66 52.823 52.688 0.135 1
1 762 . 34 1 1 A 66 66 LEU CB C 66 44.071 45.309 -1.238 1
1 766 . 34 1 1 A 66 66 LEU N N 66 118.967 121.363 -2.396 1
1 767 . 34 1 1 A 67 67 SER H H 67 9.208 8.466 0.742 1
1 768 . 34 1 1 A 67 67 SER HA H 67 4.414 4.933 -0.519 1
1 771 . 34 1 1 A 67 67 SER CA C 67 57.943 57.360 0.583 1
1 772 . 34 1 1 A 67 67 SER CB C 67 64.743 65.975 -1.232 1
1 773 . 34 1 1 A 67 67 SER N N 67 116.378 115.169 1.209 1
1 774 . 34 1 1 A 69 69 GLY HA2 H 69 3.916 3.705 0.211 1
1 775 . 34 1 1 A 69 69 GLY HA3 H 69 3.867 3.758 0.109 1
1 776 . 34 1 1 A 69 69 GLY C C 69 176.783 175.296 1.487 1
1 777 . 34 1 1 A 69 69 GLY CA C 69 46.977 46.981 -0.004 1
1 778 . 34 1 1 A 70 70 ASP H H 70 7.674 8.114 -0.440 1
1 779 . 34 1 1 A 70 70 ASP HA H 70 4.511 3.462 1.049 1
1 782 . 34 1 1 A 70 70 ASP C C 70 178.096 178.523 -0.427 1
1 783 . 34 1 1 A 70 70 ASP CA C 70 57.262 56.331 0.931 1
1 784 . 34 1 1 A 70 70 ASP CB C 70 40.594 39.677 0.917 1
1 785 . 34 1 1 A 70 70 ASP N N 70 123.930 122.138 1.792 1
1 786 . 34 1 1 A 71 71 HIS H H 71 8.729 7.850 0.879 1
1 787 . 34 1 1 A 71 71 HIS HA H 71 4.235 4.192 0.043 1
1 790 . 34 1 1 A 71 71 HIS C C 71 176.769 176.623 0.146 1
1 791 . 34 1 1 A 71 71 HIS CA C 71 60.041 60.000 0.041 1
1 792 . 34 1 1 A 71 71 HIS CB C 71 30.682 30.114 0.568 1
1 793 . 34 1 1 A 71 71 HIS N N 71 121.003 119.505 1.498 1
1 794 . 34 1 1 A 72 72 LEU H H 72 7.620 7.929 -0.309 1
1 795 . 34 1 1 A 72 72 LEU HA H 72 3.769 3.839 -0.070 1
1 805 . 34 1 1 A 72 72 LEU C C 72 180.275 179.413 0.862 1
1 806 . 34 1 1 A 72 72 LEU CA C 72 58.192 57.999 0.193 1
1 807 . 34 1 1 A 72 72 LEU CB C 72 41.381 41.181 0.200 1
1 811 . 34 1 1 A 72 72 LEU N N 72 118.569 118.602 -0.033 1
1 812 . 34 1 1 A 73 73 LEU H H 73 7.542 7.803 -0.261 1
1 813 . 34 1 1 A 73 73 LEU HA H 73 4.107 4.224 -0.117 1
1 823 . 34 1 1 A 73 73 LEU C C 73 179.436 179.134 0.302 1
1 824 . 34 1 1 A 73 73 LEU CA C 73 58.026 57.220 0.806 1
1 825 . 34 1 1 A 73 73 LEU CB C 73 41.638 42.126 -0.488 1
1 829 . 34 1 1 A 73 73 LEU N N 73 121.418 121.046 0.372 1
1 830 . 34 1 1 A 74 74 TRP H H 74 8.786 8.275 0.511 1
1 831 . 34 1 1 A 74 74 TRP HA H 74 3.589 5.432 -1.843 1
1 840 . 34 1 1 A 74 74 TRP C C 74 176.816 178.735 -1.919 1
1 841 . 34 1 1 A 74 74 TRP CA C 74 63.046 59.882 3.164 1
1 842 . 34 1 1 A 74 74 TRP CB C 74 28.065 29.071 -1.006 1
1 848 . 34 1 1 A 74 74 TRP N N 74 121.111 118.139 2.972 1
1 850 . 34 1 1 A 75 75 LYS H H 75 8.939 7.785 1.154 1
1 851 . 34 1 1 A 75 75 LYS HA H 75 3.055 4.147 -1.092 1
1 860 . 34 1 1 A 75 75 LYS C C 75 177.967 179.365 -1.398 1
1 861 . 34 1 1 A 75 75 LYS CA C 75 60.029 58.667 1.362 1
1 862 . 34 1 1 A 75 75 LYS CB C 75 32.533 32.981 -0.448 1
1 866 . 34 1 1 A 75 75 LYS N N 75 119.783 118.636 1.147 1
1 867 . 34 1 1 A 76 76 SER H H 76 7.832 8.158 -0.326 1
1 868 . 34 1 1 A 76 76 SER HA H 76 4.040 4.345 -0.305 1
1 871 . 34 1 1 A 76 76 SER C C 76 177.816 177.049 0.767 1
1 872 . 34 1 1 A 76 76 SER CA C 76 62.105 61.864 0.241 1
1 873 . 34 1 1 A 76 76 SER CB C 76 62.679 62.895 -0.216 1
1 874 . 34 1 1 A 76 76 SER N N 76 113.395 116.897 -3.502 1
1 875 . 34 1 1 A 77 77 GLU H H 77 7.590 7.543 0.047 1
1 876 . 34 1 1 A 77 77 GLU HA H 77 4.042 4.148 -0.106 1
1 881 . 34 1 1 A 77 77 GLU C C 77 177.809 178.646 -0.837 1
1 882 . 34 1 1 A 77 77 GLU CA C 77 58.270 58.945 -0.675 1
1 883 . 34 1 1 A 77 77 GLU CB C 77 29.208 29.496 -0.288 1
1 885 . 34 1 1 A 77 77 GLU N N 77 121.574 122.800 -1.226 1
1 886 . 34 1 1 A 78 78 PHE H H 78 9.081 7.902 1.179 1
1 887 . 34 1 1 A 78 78 PHE HA H 78 3.778 4.237 -0.459 1
1 895 . 34 1 1 A 78 78 PHE C C 78 178.114 177.475 0.639 1
1 896 . 34 1 1 A 78 78 PHE CA C 78 60.629 61.266 -0.637 1
1 897 . 34 1 1 A 78 78 PHE CB C 78 38.295 38.772 -0.477 1
1 902 . 34 1 1 A 78 78 PHE N N 78 122.682 121.517 1.165 1
1 903 . 34 1 1 A 79 79 PHE H H 79 8.890 8.231 0.659 1
1 904 . 34 1 1 A 79 79 PHE HA H 79 3.800 4.044 -0.244 1
1 912 . 34 1 1 A 79 79 PHE C C 79 178.354 178.072 0.282 1
1 913 . 34 1 1 A 79 79 PHE CA C 79 60.704 62.140 -1.436 1
1 914 . 34 1 1 A 79 79 PHE CB C 79 37.184 38.494 -1.310 1
1 920 . 34 1 1 A 79 79 PHE N N 79 121.056 117.948 3.108 1
1 921 . 34 1 1 A 80 80 GLU H H 80 7.793 8.213 -0.420 1
1 922 . 34 1 1 A 80 80 GLU HA H 80 4.082 3.945 0.137 1
1 927 . 34 1 1 A 80 80 GLU C C 80 179.068 178.958 0.110 1
1 928 . 34 1 1 A 80 80 GLU CA C 80 59.735 59.473 0.262 1
1 929 . 34 1 1 A 80 80 GLU CB C 80 28.722 29.078 -0.356 1
1 931 . 34 1 1 A 80 80 GLU N N 80 120.312 118.124 2.188 1
1 932 . 34 1 1 A 81 81 ASN H H 81 8.624 8.927 -0.303 1
1 933 . 34 1 1 A 81 81 ASN HA H 81 4.521 4.396 0.125 1
1 938 . 34 1 1 A 81 81 ASN C C 81 179.262 177.447 1.815 1
1 939 . 34 1 1 A 81 81 ASN CA C 81 55.504 56.001 -0.497 1
1 940 . 34 1 1 A 81 81 ASN CB C 81 37.517 37.346 0.171 1
1 941 . 34 1 1 A 81 81 ASN N N 81 119.338 117.148 2.190 1
1 943 . 34 1 1 A 82 82 CYS H H 82 8.554 8.418 0.136 1
1 944 . 34 1 1 A 82 82 CYS HA H 82 3.792 3.932 -0.140 1
1 947 . 34 1 1 A 82 82 CYS C C 82 176.478 176.637 -0.159 1
1 948 . 34 1 1 A 82 82 CYS CA C 82 65.232 61.889 3.343 1
1 949 . 34 1 1 A 82 82 CYS CB C 82 26.762 26.728 0.034 1
1 950 . 34 1 1 A 82 82 CYS N N 82 120.576 117.997 2.579 1
1 951 . 34 1 1 A 83 83 ARG H H 83 8.522 7.750 0.772 1
1 952 . 34 1 1 A 83 83 ARG HA H 83 3.932 4.109 -0.177 1
1 960 . 34 1 1 A 83 83 ARG C C 83 179.138 178.699 0.439 1
1 961 . 34 1 1 A 83 83 ARG CA C 83 60.443 58.894 1.549 1
1 962 . 34 1 1 A 83 83 ARG CB C 83 29.550 29.590 -0.040 1
1 965 . 34 1 1 A 83 83 ARG N N 83 123.035 120.590 2.445 1
1 967 . 34 1 1 A 84 84 ASP H H 84 7.791 8.124 -0.333 1
1 968 . 34 1 1 A 84 84 ASP HA H 84 4.353 4.396 -0.043 1
1 971 . 34 1 1 A 84 84 ASP C C 84 178.649 178.426 0.223 1
1 972 . 34 1 1 A 84 84 ASP CA C 84 57.767 57.565 0.202 1
1 973 . 34 1 1 A 84 84 ASP CB C 84 41.305 41.634 -0.329 1
1 974 . 34 1 1 A 84 84 ASP N N 84 120.332 119.641 0.691 1
1 975 . 34 1 1 A 85 85 THR H H 85 8.370 8.179 0.191 1
1 976 . 34 1 1 A 85 85 THR HA H 85 3.730 3.957 -0.227 1
1 981 . 34 1 1 A 85 85 THR C C 85 175.198 176.774 -1.576 1
1 982 . 34 1 1 A 85 85 THR CA C 85 66.830 65.222 1.608 1
1 983 . 34 1 1 A 85 85 THR CB C 85 68.533 68.828 -0.295 1
1 985 . 34 1 1 A 85 85 THR N N 85 117.360 113.584 3.776 1
1 986 . 34 1 1 A 86 86 ALA H H 86 8.845 8.081 0.764 1
1 987 . 34 1 1 A 86 86 ALA HA H 86 3.991 4.019 -0.028 1
1 991 . 34 1 1 A 86 86 ALA C C 86 179.980 179.567 0.413 1
1 992 . 34 1 1 A 86 86 ALA CA C 86 55.769 55.580 0.189 1
1 993 . 34 1 1 A 86 86 ALA CB C 86 17.881 18.264 -0.383 1
1 994 . 34 1 1 A 86 86 ALA N N 86 123.613 123.195 0.418 1
1 995 . 34 1 1 A 87 87 LYS H H 87 7.686 8.092 -0.406 1
1 996 . 34 1 1 A 87 87 LYS HA H 87 4.099 4.008 0.091 1
1 1005 . 34 1 1 A 87 87 LYS C C 87 179.592 179.059 0.533 1
1 1006 . 34 1 1 A 87 87 LYS CA C 87 59.708 59.764 -0.056 1
1 1007 . 34 1 1 A 87 87 LYS CB C 87 32.054 32.301 -0.247 1
1 1011 . 34 1 1 A 87 87 LYS N N 87 119.623 117.408 2.215 1
1 1012 . 34 1 1 A 88 88 ARG H H 88 7.683 7.676 0.007 1
1 1013 . 34 1 1 A 88 88 ARG HA H 88 4.051 4.086 -0.035 1
1 1020 . 34 1 1 A 88 88 ARG C C 88 180.053 179.120 0.933 1
1 1021 . 34 1 1 A 88 88 ARG CA C 88 59.558 59.257 0.301 1
1 1022 . 34 1 1 A 88 88 ARG CB C 88 29.684 30.236 -0.552 1
1 1025 . 34 1 1 A 88 88 ARG N N 88 120.788 119.727 1.061 1
1 1026 . 34 1 1 A 89 89 ASN H H 89 8.973 8.482 0.491 1
1 1027 . 34 1 1 A 89 89 ASN HA H 89 4.354 4.629 -0.275 1
1 1032 . 34 1 1 A 89 89 ASN C C 89 178.382 178.682 -0.300 1
1 1033 . 34 1 1 A 89 89 ASN CA C 89 55.334 55.788 -0.454 1
1 1034 . 34 1 1 A 89 89 ASN CB C 89 37.864 37.855 0.009 1
1 1035 . 34 1 1 A 89 89 ASN N N 89 121.012 118.064 2.948 1
1 1037 . 34 1 1 A 90 90 GLN H H 90 8.152 8.043 0.109 1
1 1038 . 34 1 1 A 90 90 GLN HA H 90 4.020 4.106 -0.086 1
1 1045 . 34 1 1 A 90 90 GLN C C 90 179.075 178.515 0.560 1
1 1046 . 34 1 1 A 90 90 GLN CA C 90 59.318 58.819 0.499 1
1 1047 . 34 1 1 A 90 90 GLN CB C 90 28.049 28.185 -0.136 1
1 1049 . 34 1 1 A 90 90 GLN N N 90 122.122 120.934 1.188 1
1 1051 . 34 1 1 A 91 91 GLN H H 91 7.514 7.973 -0.459 1
1 1052 . 34 1 1 A 91 91 GLN HA H 91 4.053 4.078 -0.025 1
1 1059 . 34 1 1 A 91 91 GLN C C 91 177.081 178.075 -0.994 1
1 1060 . 34 1 1 A 91 91 GLN CA C 91 58.031 58.537 -0.506 1
1 1061 . 34 1 1 A 91 91 GLN CB C 91 28.365 28.056 0.309 1
1 1063 . 34 1 1 A 91 91 GLN N N 91 118.124 118.207 -0.083 1
1 1065 . 34 1 1 A 92 92 ALA H H 92 7.704 7.671 0.033 1
1 1066 . 34 1 1 A 92 92 ALA HA H 92 4.246 4.234 0.012 1
1 1070 . 34 1 1 A 92 92 ALA C C 92 178.450 177.944 0.506 1
1 1071 . 34 1 1 A 92 92 ALA CA C 92 52.671 52.873 -0.202 1
1 1072 . 34 1 1 A 92 92 ALA CB C 92 19.316 19.634 -0.318 1
1 1073 . 34 1 1 A 92 92 ALA N N 92 119.880 120.122 -0.242 1
1 1074 . 34 1 1 A 93 93 GLY H H 93 7.693 8.416 -0.723 1
1 1075 . 34 1 1 A 93 93 GLY HA2 H 93 3.941 3.969 -0.028 1
1 1076 . 34 1 1 A 93 93 GLY HA3 H 93 3.744 3.969 -0.225 1
1 1077 . 34 1 1 A 93 93 GLY C C 93 174.344 174.251 0.093 1
1 1078 . 34 1 1 A 93 93 GLY CA C 93 45.949 46.319 -0.370 1
1 1079 . 34 1 1 A 93 93 GLY N N 93 105.347 106.745 -1.398 1
1 1080 . 34 1 1 A 94 94 ASN H H 94 7.076 8.320 -1.244 1
1 1081 . 34 1 1 A 94 94 ASN HA H 94 4.115 5.009 -0.894 1
1 1085 . 34 1 1 A 94 94 ASN C C 94 175.410 175.612 -0.202 1
1 1086 . 34 1 1 A 94 94 ASN CA C 94 52.651 51.494 1.157 1
1 1087 . 34 1 1 A 94 94 ASN CB C 94 38.330 41.547 -3.217 1
1 1088 . 34 1 1 A 94 94 ASN N N 94 115.747 117.875 -2.128 1
1 1090 . 34 1 1 A 95 95 GLY H H 95 8.236 8.694 -0.458 1
1 1091 . 34 1 1 A 95 95 GLY HA2 H 95 3.633 3.583 0.050 1
1 1092 . 34 1 1 A 95 95 GLY HA3 H 95 3.633 3.748 -0.115 1
1 1093 . 34 1 1 A 95 95 GLY C C 95 174.450 173.410 1.040 1
1 1094 . 34 1 1 A 95 95 GLY CA C 95 45.522 46.730 -1.208 1
1 1095 . 34 1 1 A 95 95 GLY N N 95 109.166 109.741 -0.575 1
1 1096 . 34 1 1 A 96 96 TRP H H 96 7.899 8.238 -0.339 1
1 1097 . 34 1 1 A 96 96 TRP HA H 96 5.241 5.158 0.083 1
1 1106 . 34 1 1 A 96 96 TRP C C 96 175.661 176.149 -0.488 1
1 1107 . 34 1 1 A 96 96 TRP CA C 96 55.090 55.988 -0.898 1
1 1108 . 34 1 1 A 96 96 TRP CB C 96 27.138 32.476 -5.338 1
1 1114 . 34 1 1 A 96 96 TRP N N 96 122.840 120.062 2.778 1
1 1116 . 34 1 1 A 97 97 ASP H H 97 7.344 9.140 -1.796 1
1 1117 . 34 1 1 A 97 97 ASP HA H 97 4.829 4.330 0.499 1
1 1120 . 34 1 1 A 97 97 ASP C C 97 175.019 176.613 -1.594 1
1 1121 . 34 1 1 A 97 97 ASP CA C 97 52.149 56.607 -4.458 1
1 1122 . 34 1 1 A 97 97 ASP CB C 97 42.697 39.391 3.306 1
1 1123 . 34 1 1 A 97 97 ASP N N 97 126.861 117.040 9.821 1
1 1124 . 34 1 1 A 98 98 PHE H H 98 8.566 8.524 0.042 1
1 1125 . 34 1 1 A 98 98 PHE HA H 98 3.727 4.076 -0.349 1
1 1133 . 34 1 1 A 98 98 PHE C C 98 177.443 176.979 0.464 1
1 1134 . 34 1 1 A 98 98 PHE CA C 98 62.471 62.066 0.405 1
1 1135 . 34 1 1 A 98 98 PHE CB C 98 39.919 39.357 0.562 1
1 1141 . 34 1 1 A 98 98 PHE N N 98 117.781 120.498 -2.717 1
1 1142 . 34 1 1 A 99 99 ASP H H 99 8.259 8.187 0.072 1
1 1143 . 34 1 1 A 99 99 ASP HA H 99 3.960 4.483 -0.523 1
1 1146 . 34 1 1 A 99 99 ASP C C 99 178.132 178.436 -0.304 1
1 1147 . 34 1 1 A 99 99 ASP CA C 99 57.658 56.336 1.322 1
1 1148 . 34 1 1 A 99 99 ASP CB C 99 38.572 40.591 -2.019 1
1 1149 . 34 1 1 A 99 99 ASP N N 99 121.709 119.745 1.964 1
1 1150 . 34 1 1 A 100 100 MET H H 100 8.008 8.293 -0.285 1
1 1151 . 34 1 1 A 100 100 MET HA H 100 3.644 4.231 -0.587 1
1 1156 . 34 1 1 A 100 100 MET C C 100 180.008 176.362 3.646 1
1 1157 . 34 1 1 A 100 100 MET CA C 100 58.598 58.806 -0.208 1
1 1158 . 34 1 1 A 100 100 MET CB C 100 33.423 32.808 0.615 1
1 1160 . 34 1 1 A 100 100 MET N N 100 119.668 119.434 0.234 1
1 1161 . 34 1 1 A 101 101 LEU H H 101 7.961 8.225 -0.264 1
1 1162 . 34 1 1 A 101 101 LEU HA H 101 3.523 4.967 -1.444 1
1 1172 . 34 1 1 A 101 101 LEU C C 101 173.873 175.787 -1.914 1
1 1173 . 34 1 1 A 101 101 LEU CA C 101 58.743 53.697 5.046 1
1 1174 . 34 1 1 A 101 101 LEU CB C 101 42.632 44.346 -1.714 1
1 1178 . 34 1 1 A 101 101 LEU N N 101 119.752 119.404 0.348 1
1 1179 . 34 1 1 A 102 102 THR H H 102 6.955 8.714 -1.759 1
1 1180 . 34 1 1 A 102 102 THR HA H 102 4.134 4.769 -0.635 1
1 1185 . 34 1 1 A 102 102 THR C C 102 176.513 175.615 0.898 1
1 1186 . 34 1 1 A 102 102 THR CA C 102 61.125 62.229 -1.104 1
1 1187 . 34 1 1 A 102 102 THR CB C 102 71.415 69.636 1.779 1
1 1189 . 34 1 1 A 102 102 THR N N 102 124.665 120.227 4.438 1
1 1190 . 34 1 1 A 103 103 GLY H H 103 7.816 9.094 -1.278 1
1 1191 . 34 1 1 A 103 103 GLY HA2 H 103 3.824 3.926 -0.102 1
1 1192 . 34 1 1 A 103 103 GLY HA3 H 103 3.824 3.931 -0.107 1
1 1193 . 34 1 1 A 103 103 GLY C C 103 174.126 174.029 0.097 1
1 1194 . 34 1 1 A 103 103 GLY CA C 103 47.805 47.920 -0.115 1
1 1195 . 34 1 1 A 103 103 GLY N N 103 114.191 112.787 1.404 1
1 1196 . 34 1 1 A 104 104 SER H H 104 8.860 7.932 0.928 1
1 1197 . 34 1 1 A 104 104 SER HA H 104 4.758 4.891 -0.133 1
1 1200 . 34 1 1 A 104 104 SER C C 104 174.591 172.803 1.788 1
1 1201 . 34 1 1 A 104 104 SER CA C 104 56.755 56.215 0.540 1
1 1202 . 34 1 1 A 104 104 SER CB C 104 65.050 65.924 -0.874 1
1 1203 . 34 1 1 A 104 104 SER N N 104 114.771 114.138 0.633 1
1 1204 . 34 1 1 A 105 105 GLY H H 105 8.788 8.365 0.423 1
1 1205 . 34 1 1 A 105 105 GLY HA2 H 105 3.733 4.024 -0.291 1
1 1206 . 34 1 1 A 105 105 GLY HA3 H 105 3.733 4.108 -0.375 1
1 1207 . 34 1 1 A 105 105 GLY CA C 105 47.247 45.639 1.608 1
1 1208 . 34 1 1 A 105 105 GLY N N 105 110.394 110.123 0.271 1
1 1209 . 34 1 1 A 106 106 ASN HA H 106 4.454 4.727 -0.273 1
1 1212 . 34 1 1 A 106 106 ASN C C 106 175.180 175.446 -0.266 1
1 1213 . 34 1 1 A 106 106 ASN CA C 106 54.492 53.602 0.890 1
1 1214 . 34 1 1 A 106 106 ASN CB C 106 37.282 39.379 -2.097 1
1 1215 . 34 1 1 A 107 107 TYR H H 107 8.241 7.345 0.896 1
1 1216 . 34 1 1 A 107 107 TYR HA H 107 4.335 4.884 -0.549 1
1 1223 . 34 1 1 A 107 107 TYR C C 107 173.954 176.466 -2.512 1
1 1224 . 34 1 1 A 107 107 TYR CA C 107 57.727 56.964 0.763 1
1 1225 . 34 1 1 A 107 107 TYR CB C 107 37.063 38.767 -1.704 1
1 1230 . 34 1 1 A 107 107 TYR N N 107 120.708 114.443 6.265 1
1 1231 . 34 1 1 A 108 108 SER H H 108 7.117 8.021 -0.904 1
1 1232 . 34 1 1 A 108 108 SER HA H 108 4.221 4.247 -0.026 1
1 1235 . 34 1 1 A 108 108 SER C C 108 174.834 174.739 0.095 1
1 1236 . 34 1 1 A 108 108 SER CA C 108 59.859 61.555 -1.696 1
1 1237 . 34 1 1 A 108 108 SER CB C 108 63.846 63.572 0.274 1
1 1238 . 34 1 1 A 108 108 SER N N 108 113.362 117.778 -4.416 1
1 1239 . 34 1 1 A 109 109 SER H H 109 8.053 8.093 -0.040 1
1 1240 . 34 1 1 A 109 109 SER HA H 109 4.560 4.408 0.152 1
1 1243 . 34 1 1 A 109 109 SER CA C 109 57.141 59.471 -2.330 1
1 1244 . 34 1 1 A 109 109 SER CB C 109 64.874 63.073 1.801 1
1 1245 . 34 1 1 A 109 109 SER N N 109 116.657 115.643 1.014 1
1 1246 . 34 1 1 A 110 110 THR HA H 110 3.541 4.153 -0.612 1
1 1251 . 34 1 1 A 110 110 THR C C 110 175.477 176.845 -1.368 1
1 1252 . 34 1 1 A 110 110 THR CA C 110 66.443 64.268 2.175 1
1 1253 . 34 1 1 A 110 110 THR CB C 110 68.091 69.062 -0.971 1
1 1255 . 34 1 1 A 111 111 ASP H H 111 8.224 7.610 0.614 1
1 1256 . 34 1 1 A 111 111 ASP HA H 111 4.237 4.389 -0.152 1
1 1259 . 34 1 1 A 111 111 ASP C C 111 177.520 178.412 -0.892 1
1 1260 . 34 1 1 A 111 111 ASP CA C 111 57.559 57.269 0.290 1
1 1261 . 34 1 1 A 111 111 ASP CB C 111 40.292 40.289 0.003 1
1 1262 . 34 1 1 A 111 111 ASP N N 111 119.490 122.041 -2.551 1
1 1263 . 34 1 1 A 112 112 ALA H H 112 7.431 8.442 -1.011 1
1 1264 . 34 1 1 A 112 112 ALA HA H 112 4.191 4.153 0.038 1
1 1268 . 34 1 1 A 112 112 ALA C C 112 180.646 179.327 1.319 1
1 1269 . 34 1 1 A 112 112 ALA CA C 112 54.534 55.229 -0.695 1
1 1270 . 34 1 1 A 112 112 ALA CB C 112 18.992 18.615 0.377 1
1 1271 . 34 1 1 A 112 112 ALA N N 112 119.710 122.758 -3.048 1
1 1272 . 34 1 1 A 113 113 GLN H H 113 7.576 8.132 -0.556 1
1 1273 . 34 1 1 A 113 113 GLN HA H 113 3.562 3.973 -0.411 1
1 1278 . 34 1 1 A 113 113 GLN C C 113 176.756 177.948 -1.192 1
1 1279 . 34 1 1 A 113 113 GLN CA C 113 57.736 58.662 -0.926 1
1 1280 . 34 1 1 A 113 113 GLN CB C 113 29.110 28.289 0.821 1
1 1281 . 34 1 1 A 113 113 GLN N N 113 117.518 118.570 -1.052 1
1 1283 . 34 1 1 A 114 114 MET H H 114 8.192 8.072 0.120 1
1 1284 . 34 1 1 A 114 114 MET HA H 114 4.231 4.294 -0.063 1
1 1289 . 34 1 1 A 114 114 MET C C 114 175.648 178.154 -2.506 1
1 1290 . 34 1 1 A 114 114 MET CA C 114 57.446 58.033 -0.587 1
1 1291 . 34 1 1 A 114 114 MET CB C 114 33.570 32.737 0.833 1
1 1293 . 34 1 1 A 114 114 MET N N 114 111.509 119.186 -7.677 1
1 1294 . 34 1 1 A 115 115 GLN H H 115 6.940 7.456 -0.516 1
1 1295 . 34 1 1 A 115 115 GLN HA H 115 4.307 4.401 -0.094 1
1 1302 . 34 1 1 A 115 115 GLN C C 115 176.270 176.065 0.205 1
1 1303 . 34 1 1 A 115 115 GLN CA C 115 54.680 56.249 -1.569 1
1 1304 . 34 1 1 A 115 115 GLN CB C 115 28.233 29.492 -1.259 1
1 1306 . 34 1 1 A 115 115 GLN N N 115 114.300 116.748 -2.448 1
1 1308 . 34 1 1 A 116 116 TYR H H 116 6.677 7.562 -0.885 1
1 1309 . 34 1 1 A 116 116 TYR HA H 116 4.193 4.374 -0.181 1
1 1312 . 34 1 1 A 116 116 TYR C C 116 175.268 174.715 0.553 1
1 1313 . 34 1 1 A 116 116 TYR CA C 116 54.357 59.582 -5.225 1
1 1314 . 34 1 1 A 116 116 TYR CB C 116 35.498 37.951 -2.453 1
1 1315 . 34 1 1 A 116 116 TYR N N 116 117.919 118.550 -0.631 1
1 1316 . 34 1 1 A 117 117 ASP H H 117 8.081 8.191 -0.110 1
1 1317 . 34 1 1 A 117 117 ASP HA H 117 4.665 4.423 0.242 1
1 1320 . 34 1 1 A 117 117 ASP CA C 117 52.422 54.610 -2.188 1
1 1321 . 34 1 1 A 117 117 ASP CB C 117 42.416 39.586 2.830 1
1 1322 . 34 1 1 A 117 117 ASP N N 117 120.887 120.960 -0.073 1
1 1323 . 34 1 1 A 118 118 PRO C C 118 179.180 177.837 1.343 1
1 1324 . 34 1 1 A 118 118 PRO CA C 118 65.942 64.564 1.378 1
1 1325 . 34 1 1 A 118 118 PRO CB C 118 32.197 31.886 0.311 1
1 1326 . 34 1 1 A 119 119 GLY H H 119 9.742 8.033 1.709 1
1 1327 . 34 1 1 A 119 119 GLY C C 119 175.622 174.880 0.742 1
1 1328 . 34 1 1 A 119 119 GLY CA C 119 46.785 45.622 1.163 1
1 1329 . 34 1 1 A 119 119 GLY N N 119 106.412 105.952 0.460 1
1 1330 . 34 1 1 A 120 120 LEU H H 120 6.666 7.118 -0.452 1
1 1331 . 34 1 1 A 120 120 LEU HA H 120 3.365 3.852 -0.487 1
1 1341 . 34 1 1 A 120 120 LEU C C 120 179.262 177.966 1.296 1
1 1342 . 34 1 1 A 120 120 LEU CA C 120 56.605 56.671 -0.066 1
1 1343 . 34 1 1 A 120 120 LEU CB C 120 39.262 41.867 -2.605 1
1 1347 . 34 1 1 A 120 120 LEU N N 120 126.226 122.418 3.808 1
1 1348 . 34 1 1 A 121 121 PHE H H 121 7.356 8.451 -1.095 1
1 1349 . 34 1 1 A 121 121 PHE HA H 121 4.459 3.846 0.613 1
1 1352 . 34 1 1 A 121 121 PHE C C 121 179.716 177.687 2.029 1
1 1353 . 34 1 1 A 121 121 PHE CA C 121 62.838 61.960 0.878 1
1 1354 . 34 1 1 A 121 121 PHE CB C 121 37.603 39.077 -1.474 1
1 1355 . 34 1 1 A 121 121 PHE N N 121 117.437 119.057 -1.620 1
1 1356 . 34 1 1 A 122 122 ALA H H 122 7.926 7.801 0.125 1
1 1357 . 34 1 1 A 122 122 ALA HA H 122 4.523 3.867 0.656 1
1 1361 . 34 1 1 A 122 122 ALA C C 122 180.435 178.917 1.518 1
1 1362 . 34 1 1 A 122 122 ALA CA C 122 55.527 55.246 0.281 1
1 1363 . 34 1 1 A 122 122 ALA CB C 122 17.814 17.826 -0.012 1
1 1364 . 34 1 1 A 122 122 ALA N N 122 121.068 121.241 -0.173 1
1 1365 . 34 1 1 A 123 123 GLN H H 123 7.507 7.764 -0.257 1
1 1366 . 34 1 1 A 123 123 GLN HA H 123 4.153 3.862 0.291 1
1 1371 . 34 1 1 A 123 123 GLN C C 123 180.561 178.057 2.504 1
1 1372 . 34 1 1 A 123 123 GLN CA C 123 59.948 59.187 0.761 1
1 1373 . 34 1 1 A 123 123 GLN CB C 123 29.135 28.444 0.691 1
1 1375 . 34 1 1 A 123 123 GLN N N 123 120.324 117.213 3.111 1
1 1376 . 34 1 1 A 124 124 ILE H H 124 8.318 8.191 0.127 1
1 1377 . 34 1 1 A 124 124 ILE HA H 124 3.635 3.871 -0.236 1
1 1387 . 34 1 1 A 124 124 ILE C C 124 176.481 178.087 -1.606 1
1 1388 . 34 1 1 A 124 124 ILE CA C 124 66.432 64.290 2.142 1
1 1389 . 34 1 1 A 124 124 ILE CB C 124 39.168 37.859 1.309 1
1 1393 . 34 1 1 A 124 124 ILE N N 124 123.747 118.966 4.781 1
1 1394 . 34 1 1 A 125 125 GLN H H 125 8.474 7.963 0.511 1
1 1395 . 34 1 1 A 125 125 GLN HA H 125 4.264 3.849 0.415 1
1 1402 . 34 1 1 A 125 125 GLN C C 125 178.947 177.857 1.090 1
1 1403 . 34 1 1 A 125 125 GLN CA C 125 59.651 58.446 1.205 1
1 1404 . 34 1 1 A 125 125 GLN CB C 125 28.880 28.392 0.488 1
1 1406 . 34 1 1 A 125 125 GLN N N 125 120.368 121.112 -0.744 1
1 1408 . 34 1 1 A 126 126 ALA H H 126 8.002 7.995 0.007 1
1 1409 . 34 1 1 A 126 126 ALA HA H 126 4.144 4.052 0.092 1
1 1413 . 34 1 1 A 126 126 ALA C C 126 179.316 179.850 -0.534 1
1 1414 . 34 1 1 A 126 126 ALA CA C 126 55.036 54.894 0.142 1
1 1415 . 34 1 1 A 126 126 ALA CB C 126 18.087 17.892 0.195 1
1 1416 . 34 1 1 A 126 126 ALA N N 126 121.661 121.512 0.149 1
1 1417 . 34 1 1 A 127 127 ALA H H 127 7.823 7.850 -0.027 1
1 1418 . 34 1 1 A 127 127 ALA HA H 127 4.162 3.989 0.173 1
1 1422 . 34 1 1 A 127 127 ALA C C 127 180.707 179.389 1.318 1
1 1423 . 34 1 1 A 127 127 ALA CA C 127 55.080 54.914 0.166 1
1 1424 . 34 1 1 A 127 127 ALA CB C 127 19.354 18.502 0.852 1
1 1425 . 34 1 1 A 127 127 ALA N N 127 119.853 119.698 0.155 1
1 1426 . 34 1 1 A 128 128 ALA H H 128 8.936 7.888 1.048 1
1 1427 . 34 1 1 A 128 128 ALA HA H 128 3.928 3.655 0.273 1
1 1431 . 34 1 1 A 128 128 ALA C C 128 181.031 179.360 1.671 1
1 1432 . 34 1 1 A 128 128 ALA CA C 128 55.502 54.654 0.848 1
1 1433 . 34 1 1 A 128 128 ALA CB C 128 16.609 17.889 -1.280 1
1 1434 . 34 1 1 A 128 128 ALA N N 128 121.355 120.112 1.243 1
1 1435 . 34 1 1 A 129 129 THR H H 129 8.543 7.617 0.926 1
1 1436 . 34 1 1 A 129 129 THR HA H 129 4.015 3.645 0.370 1
1 1441 . 34 1 1 A 129 129 THR C C 129 177.332 176.307 1.025 1
1 1442 . 34 1 1 A 129 129 THR CA C 129 65.893 65.068 0.825 1
1 1443 . 34 1 1 A 129 129 THR CB C 129 68.566 68.580 -0.014 1
1 1445 . 34 1 1 A 129 129 THR N N 129 112.709 112.255 0.454 1
1 1446 . 34 1 1 A 130 130 LYS H H 130 8.126 7.378 0.748 1
1 1447 . 34 1 1 A 130 130 LYS HA H 130 4.000 4.007 -0.007 1
1 1456 . 34 1 1 A 130 130 LYS C C 130 179.082 178.617 0.465 1
1 1457 . 34 1 1 A 130 130 LYS CA C 130 60.299 58.767 1.532 1
1 1458 . 34 1 1 A 130 130 LYS CB C 130 32.767 32.171 0.596 1
1 1462 . 34 1 1 A 130 130 LYS N N 130 123.879 120.479 3.400 1
1 1463 . 34 1 1 A 131 131 ALA H H 131 7.184 7.729 -0.545 1
1 1464 . 34 1 1 A 131 131 ALA HA H 131 4.005 4.202 -0.197 1
1 1468 . 34 1 1 A 131 131 ALA C C 131 178.482 179.577 -1.095 1
1 1469 . 34 1 1 A 131 131 ALA CA C 131 55.027 55.205 -0.178 1
1 1470 . 34 1 1 A 131 131 ALA CB C 131 18.669 19.361 -0.692 1
1 1471 . 34 1 1 A 131 131 ALA N N 131 118.590 121.216 -2.626 1
1 1472 . 34 1 1 A 132 132 TRP H H 132 7.977 8.569 -0.592 1
1 1473 . 34 1 1 A 132 132 TRP HA H 132 4.001 4.286 -0.285 1
1 1480 . 34 1 1 A 132 132 TRP C C 132 177.332 175.768 1.564 1
1 1481 . 34 1 1 A 132 132 TRP CA C 132 60.431 57.405 3.026 1
1 1482 . 34 1 1 A 132 132 TRP CB C 132 27.786 27.788 -0.002 1
1 1486 . 34 1 1 A 132 132 TRP N N 132 119.168 117.004 2.164 1
1 1488 . 34 1 1 A 133 133 ARG H H 133 8.006 8.066 -0.060 1
1 1489 . 34 1 1 A 133 133 ARG HA H 133 4.027 4.355 -0.328 1
1 1497 . 34 1 1 A 133 133 ARG C C 133 176.664 177.869 -1.205 1
1 1498 . 34 1 1 A 133 133 ARG CA C 133 59.355 57.153 2.202 1
1 1499 . 34 1 1 A 133 133 ARG CB C 133 30.451 32.145 -1.694 1
1 1502 . 34 1 1 A 133 133 ARG N N 133 113.062 120.590 -7.528 1
1 1504 . 34 1 1 A 134 134 LYS H H 134 7.322 7.729 -0.407 1
1 1505 . 34 1 1 A 134 134 LYS HA H 134 4.313 4.389 -0.076 1
1 1514 . 34 1 1 A 134 134 LYS C C 134 176.282 175.925 0.357 1
1 1515 . 34 1 1 A 134 134 LYS CA C 134 54.922 56.548 -1.626 1
1 1516 . 34 1 1 A 134 134 LYS CB C 134 32.633 31.638 0.995 1
1 1520 . 34 1 1 A 134 134 LYS N N 134 118.170 118.574 -0.404 1
1 1521 . 34 1 1 A 135 135 LEU H H 135 7.440 8.119 -0.679 1
1 1522 . 34 1 1 A 135 135 LEU HA H 135 4.174 4.546 -0.372 1
1 1532 . 34 1 1 A 135 135 LEU CA C 135 54.408 52.407 2.001 1
1 1533 . 34 1 1 A 135 135 LEU CB C 135 40.407 41.504 -1.097 1
1 1537 . 34 1 1 A 135 135 LEU N N 135 123.358 121.985 1.373 1
1 1538 . 34 1 1 A 136 136 PRO HA H 136 4.437 4.532 -0.095 1
1 1545 . 34 1 1 A 136 136 PRO C C 136 177.106 175.901 1.205 1
1 1546 . 34 1 1 A 136 136 PRO CA C 136 62.889 64.395 -1.506 1
1 1547 . 34 1 1 A 136 136 PRO CB C 136 32.192 32.205 -0.013 1
1 1550 . 34 1 1 A 137 137 VAL H H 137 8.219 7.277 0.942 1
1 1551 . 34 1 1 A 137 137 VAL HA H 137 4.077 4.868 -0.791 1
1 1559 . 34 1 1 A 137 137 VAL C C 137 176.305 174.544 1.761 1
1 1560 . 34 1 1 A 137 137 VAL CA C 137 61.958 59.163 2.795 1
1 1561 . 34 1 1 A 137 137 VAL CB C 137 32.755 34.963 -2.208 1
1 1564 . 34 1 1 A 137 137 VAL N N 137 120.079 112.639 7.440 1
1 1565 . 34 1 1 A 138 138 LYS H H 138 8.444 8.669 -0.225 1
1 1566 . 34 1 1 A 138 138 LYS HA H 138 4.316 4.700 -0.384 1
1 1575 . 34 1 1 A 138 138 LYS C C 138 176.790 176.517 0.273 1
1 1576 . 34 1 1 A 138 138 LYS CA C 138 56.792 55.454 1.338 1
1 1577 . 34 1 1 A 138 138 LYS CB C 138 33.205 32.879 0.326 1
1 1581 . 34 1 1 A 138 138 LYS N N 138 126.449 125.405 1.044 1
1 1582 . 34 1 1 A 139 139 GLY H H 139 8.518 8.720 -0.202 1
1 1583 . 34 1 1 A 139 139 GLY HA2 H 139 4.070 3.854 0.216 1
1 1584 . 34 1 1 A 139 139 GLY HA3 H 139 3.897 3.860 0.037 1
1 1585 . 34 1 1 A 139 139 GLY C C 139 172.874 173.686 -0.812 1
1 1586 . 34 1 1 A 139 139 GLY CA C 139 45.157 46.539 -1.382 1
1 1587 . 34 1 1 A 139 139 GLY N N 139 112.617 113.449 -0.832 1
1 6 . 35 1 1 A 2 2 VAL H H 2 8.992 7.888 1.104 1
1 7 . 35 1 1 A 2 2 VAL HA H 2 5.370 4.807 0.563 1
1 15 . 35 1 1 A 2 2 VAL C C 2 174.325 174.121 0.204 1
1 16 . 35 1 1 A 2 2 VAL CA C 2 61.267 60.801 0.466 1
1 17 . 35 1 1 A 2 2 VAL CB C 2 33.890 34.916 -1.026 1
1 20 . 35 1 1 A 2 2 VAL N N 2 126.939 118.100 8.839 1
1 21 . 35 1 1 A 3 3 THR H H 3 8.912 9.191 -0.279 1
1 22 . 35 1 1 A 3 3 THR HA H 3 4.505 5.288 -0.783 1
1 27 . 35 1 1 A 3 3 THR C C 3 172.710 173.171 -0.461 1
1 28 . 35 1 1 A 3 3 THR CA C 3 59.689 60.145 -0.456 1
1 29 . 35 1 1 A 3 3 THR CB C 3 72.398 71.763 0.635 1
1 31 . 35 1 1 A 3 3 THR N N 3 118.091 123.320 -5.229 1
1 32 . 35 1 1 A 4 4 GLU H H 4 8.631 9.157 -0.526 1
1 33 . 35 1 1 A 4 4 GLU HA H 4 5.788 5.129 0.659 1
1 38 . 35 1 1 A 4 4 GLU C C 4 175.758 174.162 1.596 1
1 39 . 35 1 1 A 4 4 GLU CA C 4 54.902 54.375 0.527 1
1 40 . 35 1 1 A 4 4 GLU CB C 4 35.097 33.205 1.892 1
1 42 . 35 1 1 A 4 4 GLU N N 4 120.966 124.639 -3.673 1
1 43 . 35 1 1 A 5 5 THR H H 5 9.188 8.512 0.676 1
1 44 . 35 1 1 A 5 5 THR HA H 5 4.739 4.760 -0.021 1
1 49 . 35 1 1 A 5 5 THR C C 5 172.757 171.804 0.953 1
1 50 . 35 1 1 A 5 5 THR CA C 5 60.382 60.528 -0.146 1
1 51 . 35 1 1 A 5 5 THR CB C 5 71.558 70.316 1.242 1
1 53 . 35 1 1 A 5 5 THR N N 5 119.366 115.118 4.248 1
1 54 . 35 1 1 A 6 6 VAL H H 6 8.476 8.435 0.041 1
1 55 . 35 1 1 A 6 6 VAL HA H 6 5.026 5.461 -0.435 1
1 63 . 35 1 1 A 6 6 VAL C C 6 176.674 175.063 1.611 1
1 64 . 35 1 1 A 6 6 VAL CA C 6 61.008 61.066 -0.058 1
1 65 . 35 1 1 A 6 6 VAL CB C 6 33.861 34.388 -0.527 1
1 68 . 35 1 1 A 6 6 VAL N N 6 121.384 123.302 -1.918 1
1 69 . 35 1 1 A 7 7 ASP H H 7 8.848 8.911 -0.063 1
1 70 . 35 1 1 A 7 7 ASP HA H 7 4.797 4.792 0.005 1
1 73 . 35 1 1 A 7 7 ASP CA C 7 52.834 55.036 -2.202 1
1 74 . 35 1 1 A 7 7 ASP CB C 7 42.219 42.366 -0.147 1
1 75 . 35 1 1 A 7 7 ASP N N 7 127.061 127.330 -0.269 1
1 76 . 35 1 1 A 8 8 GLY C C 8 175.143 174.799 0.344 1
1 77 . 35 1 1 A 8 8 GLY CA C 8 46.553 47.097 -0.544 1
1 78 . 35 1 1 A 9 9 GLN H H 9 8.408 7.820 0.588 1
1 79 . 35 1 1 A 9 9 GLN HA H 9 4.541 4.221 0.320 1
1 86 . 35 1 1 A 9 9 GLN C C 9 176.463 177.043 -0.580 1
1 87 . 35 1 1 A 9 9 GLN CA C 9 55.167 55.267 -0.100 1
1 88 . 35 1 1 A 9 9 GLN CB C 9 29.376 27.743 1.633 1
1 90 . 35 1 1 A 9 9 GLN N N 9 118.300 116.643 1.657 1
1 92 . 35 1 1 A 10 10 GLY H H 10 8.162 8.693 -0.531 1
1 93 . 35 1 1 A 10 10 GLY HA2 H 10 4.174 3.896 0.278 1
1 94 . 35 1 1 A 10 10 GLY HA3 H 10 3.521 3.904 -0.383 1
1 95 . 35 1 1 A 10 10 GLY C C 10 174.092 173.531 0.561 1
1 96 . 35 1 1 A 10 10 GLY CA C 10 45.558 46.423 -0.865 1
1 97 . 35 1 1 A 10 10 GLY N N 10 108.747 110.689 -1.942 1
1 98 . 35 1 1 A 11 11 GLN H H 11 8.507 7.408 1.099 1
1 99 . 35 1 1 A 11 11 GLN HA H 11 4.202 4.884 -0.682 1
1 106 . 35 1 1 A 11 11 GLN C C 11 173.992 173.836 0.156 1
1 107 . 35 1 1 A 11 11 GLN CA C 11 55.098 53.581 1.517 1
1 108 . 35 1 1 A 11 11 GLN CB C 11 29.097 31.696 -2.599 1
1 110 . 35 1 1 A 11 11 GLN N N 11 122.979 114.656 8.323 1
1 112 . 35 1 1 A 12 12 ALA H H 12 8.259 8.571 -0.312 1
1 113 . 35 1 1 A 12 12 ALA HA H 12 5.156 6.186 -1.030 1
1 117 . 35 1 1 A 12 12 ALA C C 12 177.284 176.250 1.034 1
1 118 . 35 1 1 A 12 12 ALA CA C 12 51.087 50.282 0.805 1
1 119 . 35 1 1 A 12 12 ALA CB C 12 20.500 21.032 -0.532 1
1 120 . 35 1 1 A 12 12 ALA N N 12 127.100 122.282 4.818 1
1 121 . 35 1 1 A 13 13 TRP H H 13 9.245 8.815 0.430 1
1 122 . 35 1 1 A 13 13 TRP HA H 13 4.717 5.352 -0.635 1
1 131 . 35 1 1 A 13 13 TRP C C 13 175.108 174.319 0.789 1
1 132 . 35 1 1 A 13 13 TRP CA C 13 55.966 55.525 0.441 1
1 133 . 35 1 1 A 13 13 TRP CB C 13 31.912 32.325 -0.413 1
1 139 . 35 1 1 A 13 13 TRP N N 13 123.088 119.622 3.466 1
1 141 . 35 1 1 A 14 14 ARG H H 14 8.575 8.712 -0.137 1
1 142 . 35 1 1 A 14 14 ARG HA H 14 5.335 4.395 0.940 1
1 150 . 35 1 1 A 14 14 ARG C C 14 175.191 174.290 0.901 1
1 151 . 35 1 1 A 14 14 ARG CA C 14 53.106 55.140 -2.034 1
1 152 . 35 1 1 A 14 14 ARG CB C 14 32.749 31.589 1.160 1
1 154 . 35 1 1 A 14 14 ARG N N 14 121.163 119.739 1.424 1
1 156 . 35 1 1 A 15 15 HIS H H 15 8.595 8.037 0.558 1
1 157 . 35 1 1 A 15 15 HIS HA H 15 4.790 4.955 -0.165 1
1 161 . 35 1 1 A 15 15 HIS C C 15 173.770 174.082 -0.312 1
1 162 . 35 1 1 A 15 15 HIS CA C 15 55.289 54.365 0.924 1
1 163 . 35 1 1 A 15 15 HIS CB C 15 33.208 33.491 -0.283 1
1 165 . 35 1 1 A 15 15 HIS N N 15 117.643 119.329 -1.686 1
1 166 . 35 1 1 A 16 16 HIS H H 16 8.993 8.535 0.458 1
1 167 . 35 1 1 A 16 16 HIS HA H 16 5.158 5.042 0.116 1
1 171 . 35 1 1 A 16 16 HIS C C 16 173.608 174.468 -0.860 1
1 172 . 35 1 1 A 16 16 HIS CA C 16 56.450 55.067 1.383 1
1 173 . 35 1 1 A 16 16 HIS CB C 16 34.171 31.818 2.353 1
1 175 . 35 1 1 A 16 16 HIS N N 16 123.520 118.364 5.156 1
1 176 . 35 1 1 A 17 17 ASN H H 17 7.829 9.339 -1.510 1
1 177 . 35 1 1 A 17 17 ASN HA H 17 4.713 5.199 -0.486 1
1 182 . 35 1 1 A 17 17 ASN C C 17 173.682 176.153 -2.471 1
1 183 . 35 1 1 A 17 17 ASN CA C 17 51.822 52.350 -0.528 1
1 184 . 35 1 1 A 17 17 ASN CB C 17 43.176 40.746 2.430 1
1 185 . 35 1 1 A 17 17 ASN N N 17 122.213 121.434 0.779 1
1 187 . 35 1 1 A 18 18 GLY H H 18 8.423 8.857 -0.434 1
1 188 . 35 1 1 A 18 18 GLY HA2 H 18 3.931 3.624 0.307 1
1 189 . 35 1 1 A 18 18 GLY HA3 H 18 3.707 3.865 -0.158 1
1 190 . 35 1 1 A 18 18 GLY C C 18 173.985 173.578 0.407 1
1 191 . 35 1 1 A 18 18 GLY CA C 18 43.949 46.483 -2.534 1
1 192 . 35 1 1 A 18 18 GLY N N 18 106.991 108.778 -1.787 1
1 193 . 35 1 1 A 19 19 PHE H H 19 8.338 7.923 0.415 1
1 194 . 35 1 1 A 19 19 PHE HA H 19 4.068 4.341 -0.273 1
1 197 . 35 1 1 A 19 19 PHE C C 19 176.568 174.594 1.974 1
1 198 . 35 1 1 A 19 19 PHE CA C 19 59.338 58.455 0.883 1
1 199 . 35 1 1 A 19 19 PHE CB C 19 40.201 37.930 2.271 1
1 200 . 35 1 1 A 19 19 PHE N N 19 116.857 112.986 3.871 1
1 201 . 35 1 1 A 20 20 ASP H H 20 8.794 8.913 -0.119 1
1 202 . 35 1 1 A 20 20 ASP HA H 20 4.485 4.790 -0.305 1
1 205 . 35 1 1 A 20 20 ASP C C 20 177.379 176.849 0.530 1
1 206 . 35 1 1 A 20 20 ASP CA C 20 54.140 54.717 -0.577 1
1 207 . 35 1 1 A 20 20 ASP CB C 20 41.915 40.616 1.299 1
1 208 . 35 1 1 A 20 20 ASP N N 20 123.025 124.576 -1.551 1
1 209 . 35 1 1 A 21 21 PHE H H 21 8.862 9.130 -0.268 1
1 210 . 35 1 1 A 21 21 PHE HA H 21 4.087 4.099 -0.012 1
1 218 . 35 1 1 A 21 21 PHE C C 21 176.952 177.136 -0.184 1
1 219 . 35 1 1 A 21 21 PHE CA C 21 61.095 61.781 -0.686 1
1 220 . 35 1 1 A 21 21 PHE CB C 21 38.678 39.302 -0.624 1
1 226 . 35 1 1 A 21 21 PHE N N 21 127.163 125.746 1.417 1
1 227 . 35 1 1 A 22 22 ALA H H 22 8.561 8.388 0.173 1
1 228 . 35 1 1 A 22 22 ALA HA H 22 3.878 4.016 -0.138 1
1 232 . 35 1 1 A 22 22 ALA C C 22 180.710 180.065 0.645 1
1 233 . 35 1 1 A 22 22 ALA CA C 22 55.211 55.255 -0.044 1
1 234 . 35 1 1 A 22 22 ALA CB C 22 18.321 18.448 -0.127 1
1 235 . 35 1 1 A 22 22 ALA N N 22 120.293 121.299 -1.006 1
1 236 . 35 1 1 A 23 23 VAL H H 23 7.241 7.552 -0.311 1
1 237 . 35 1 1 A 23 23 VAL HA H 23 3.684 3.476 0.208 1
1 245 . 35 1 1 A 23 23 VAL C C 23 177.101 178.045 -0.944 1
1 246 . 35 1 1 A 23 23 VAL CA C 23 65.237 66.978 -1.741 1
1 247 . 35 1 1 A 23 23 VAL CB C 23 31.780 31.619 0.161 1
1 250 . 35 1 1 A 23 23 VAL N N 23 118.775 117.632 1.143 1
1 251 . 35 1 1 A 24 24 ILE H H 24 6.761 8.165 -1.404 1
1 252 . 35 1 1 A 24 24 ILE HA H 24 3.196 3.449 -0.253 1
1 262 . 35 1 1 A 24 24 ILE C C 24 177.287 177.964 -0.677 1
1 263 . 35 1 1 A 24 24 ILE CA C 24 63.404 65.254 -1.850 1
1 264 . 35 1 1 A 24 24 ILE CB C 24 36.294 37.711 -1.417 1
1 268 . 35 1 1 A 24 24 ILE N N 24 119.036 119.809 -0.773 1
1 269 . 35 1 1 A 25 25 LYS H H 25 8.032 8.054 -0.022 1
1 270 . 35 1 1 A 25 25 LYS HA H 25 3.809 3.673 0.136 1
1 279 . 35 1 1 A 25 25 LYS C C 25 179.450 178.842 0.608 1
1 280 . 35 1 1 A 25 25 LYS CA C 25 59.621 59.545 0.076 1
1 281 . 35 1 1 A 25 25 LYS CB C 25 32.259 32.200 0.059 1
1 285 . 35 1 1 A 25 25 LYS N N 25 118.368 120.274 -1.906 1
1 286 . 35 1 1 A 26 26 GLU H H 26 7.845 8.214 -0.369 1
1 287 . 35 1 1 A 26 26 GLU HA H 26 4.021 4.117 -0.096 1
1 292 . 35 1 1 A 26 26 GLU C C 26 179.191 178.698 0.493 1
1 293 . 35 1 1 A 26 26 GLU CA C 26 59.530 58.997 0.533 1
1 294 . 35 1 1 A 26 26 GLU CB C 26 29.449 29.435 0.014 1
1 296 . 35 1 1 A 26 26 GLU N N 26 120.522 118.908 1.614 1
1 297 . 35 1 1 A 27 27 LEU H H 27 8.165 8.136 0.029 1
1 298 . 35 1 1 A 27 27 LEU HA H 27 4.163 4.067 0.096 1
1 308 . 35 1 1 A 27 27 LEU C C 27 177.256 178.332 -1.076 1
1 309 . 35 1 1 A 27 27 LEU CA C 27 58.049 57.734 0.315 1
1 310 . 35 1 1 A 27 27 LEU CB C 27 41.365 41.933 -0.568 1
1 314 . 35 1 1 A 27 27 LEU N N 27 120.879 121.143 -0.264 1
1 315 . 35 1 1 A 28 28 LYS H H 28 8.902 8.327 0.575 1
1 316 . 35 1 1 A 28 28 LYS HA H 28 4.199 4.053 0.146 1
1 317 . 35 1 1 A 28 28 LYS C C 28 179.707 179.214 0.493 1
1 318 . 35 1 1 A 28 28 LYS CA C 28 60.097 59.524 0.573 1
1 319 . 35 1 1 A 28 28 LYS CB C 28 33.420 32.113 1.307 1
1 320 . 35 1 1 A 28 28 LYS N N 28 120.050 119.761 0.289 1
1 321 . 35 1 1 A 29 29 THR H H 29 8.294 7.720 0.574 1
1 322 . 35 1 1 A 29 29 THR HA H 29 3.892 3.932 -0.040 1
1 327 . 35 1 1 A 29 29 THR C C 29 175.711 176.507 -0.796 1
1 328 . 35 1 1 A 29 29 THR CA C 29 66.846 66.420 0.426 1
1 329 . 35 1 1 A 29 29 THR CB C 29 68.794 68.746 0.048 1
1 331 . 35 1 1 A 29 29 THR N N 29 115.933 116.357 -0.424 1
1 332 . 35 1 1 A 30 30 ALA H H 30 8.244 8.142 0.102 1
1 333 . 35 1 1 A 30 30 ALA HA H 30 4.241 4.256 -0.015 1
1 337 . 35 1 1 A 30 30 ALA C C 30 179.128 180.231 -1.103 1
1 338 . 35 1 1 A 30 30 ALA CA C 30 55.714 55.185 0.529 1
1 339 . 35 1 1 A 30 30 ALA CB C 30 18.955 18.325 0.630 1
1 340 . 35 1 1 A 30 30 ALA N N 30 124.617 123.783 0.834 1
1 341 . 35 1 1 A 31 31 ALA H H 31 8.968 8.460 0.508 1
1 342 . 35 1 1 A 31 31 ALA HA H 31 3.890 4.144 -0.254 1
1 346 . 35 1 1 A 31 31 ALA C C 31 180.352 179.799 0.553 1
1 347 . 35 1 1 A 31 31 ALA CA C 31 55.454 54.995 0.459 1
1 348 . 35 1 1 A 31 31 ALA CB C 31 17.124 18.266 -1.142 1
1 349 . 35 1 1 A 31 31 ALA N N 31 119.327 121.151 -1.824 1
1 350 . 35 1 1 A 32 32 SER H H 32 7.995 7.793 0.202 1
1 351 . 35 1 1 A 32 32 SER HA H 32 4.238 4.251 -0.013 1
1 354 . 35 1 1 A 32 32 SER C C 32 175.612 176.318 -0.706 1
1 355 . 35 1 1 A 32 32 SER CA C 32 61.203 61.715 -0.512 1
1 356 . 35 1 1 A 32 32 SER CB C 32 63.406 63.754 -0.348 1
1 357 . 35 1 1 A 32 32 SER N N 32 111.962 114.738 -2.776 1
1 358 . 35 1 1 A 33 33 GLN H H 33 8.333 8.178 0.155 1
1 359 . 35 1 1 A 33 33 GLN HA H 33 3.992 4.109 -0.117 1
1 366 . 35 1 1 A 33 33 GLN C C 33 177.486 178.157 -0.671 1
1 367 . 35 1 1 A 33 33 GLN CA C 33 58.277 58.491 -0.214 1
1 368 . 35 1 1 A 33 33 GLN CB C 33 29.140 28.995 0.145 1
1 370 . 35 1 1 A 33 33 GLN N N 33 119.527 120.886 -1.359 1
1 372 . 35 1 1 A 34 34 TYR H H 34 8.587 8.173 0.414 1
1 373 . 35 1 1 A 34 34 TYR HA H 34 4.792 4.438 0.354 1
1 380 . 35 1 1 A 34 34 TYR C C 34 176.499 176.672 -0.173 1
1 381 . 35 1 1 A 34 34 TYR CA C 34 57.711 59.726 -2.015 1
1 382 . 35 1 1 A 34 34 TYR CB C 34 39.561 38.964 0.597 1
1 387 . 35 1 1 A 34 34 TYR N N 34 114.610 115.623 -1.013 1
1 388 . 35 1 1 A 35 35 GLY H H 35 7.346 7.943 -0.597 1
1 389 . 35 1 1 A 35 35 GLY HA2 H 35 4.785 4.081 0.704 1
1 390 . 35 1 1 A 35 35 GLY HA3 H 35 4.007 4.087 -0.080 1
1 391 . 35 1 1 A 35 35 GLY C C 35 175.796 173.286 2.510 1
1 392 . 35 1 1 A 35 35 GLY CA C 35 44.355 44.752 -0.397 1
1 393 . 35 1 1 A 35 35 GLY N N 35 108.501 106.267 2.234 1
1 394 . 35 1 1 A 36 36 ALA H H 36 9.363 8.384 0.979 1
1 395 . 35 1 1 A 36 36 ALA HA H 36 4.217 4.643 -0.426 1
1 399 . 35 1 1 A 36 36 ALA C C 36 178.039 177.662 0.377 1
1 400 . 35 1 1 A 36 36 ALA CA C 36 56.114 52.079 4.035 1
1 401 . 35 1 1 A 36 36 ALA CB C 36 19.179 19.635 -0.456 1
1 402 . 35 1 1 A 36 36 ALA N N 36 125.811 123.363 2.448 1
1 403 . 35 1 1 A 37 37 THR H H 37 8.070 8.671 -0.601 1
1 404 . 35 1 1 A 37 37 THR HA H 37 4.570 4.463 0.107 1
1 409 . 35 1 1 A 37 37 THR C C 37 173.685 174.451 -0.766 1
1 410 . 35 1 1 A 37 37 THR CA C 37 59.822 62.544 -2.722 1
1 411 . 35 1 1 A 37 37 THR CB C 37 68.267 71.703 -3.436 1
1 413 . 35 1 1 A 37 37 THR N N 37 129.410 118.146 11.264 1
1 414 . 35 1 1 A 38 38 ALA H H 38 6.853 7.652 -0.799 1
1 415 . 35 1 1 A 38 38 ALA HA H 38 4.601 4.586 0.015 1
1 419 . 35 1 1 A 38 38 ALA CA C 38 50.758 50.624 0.134 1
1 420 . 35 1 1 A 38 38 ALA CB C 38 18.325 19.516 -1.191 1
1 421 . 35 1 1 A 38 38 ALA N N 38 124.674 125.083 -0.409 1
1 422 . 35 1 1 A 40 40 TYR HA H 40 4.032 4.049 -0.017 1
1 429 . 35 1 1 A 40 40 TYR C C 40 176.456 177.240 -0.784 1
1 430 . 35 1 1 A 40 40 TYR CA C 40 61.010 61.744 -0.734 1
1 431 . 35 1 1 A 40 40 TYR CB C 40 39.286 38.775 0.511 1
1 436 . 35 1 1 A 41 41 THR H H 41 6.874 8.310 -1.436 1
1 437 . 35 1 1 A 41 41 THR HA H 41 3.616 3.750 -0.134 1
1 442 . 35 1 1 A 41 41 THR C C 41 176.930 176.513 0.417 1
1 443 . 35 1 1 A 41 41 THR CA C 41 65.557 65.534 0.023 1
1 444 . 35 1 1 A 41 41 THR CB C 41 68.228 69.103 -0.875 1
1 446 . 35 1 1 A 41 41 THR N N 41 115.143 113.924 1.219 1
1 447 . 35 1 1 A 42 42 LEU H H 42 8.623 7.355 1.268 1
1 448 . 35 1 1 A 42 42 LEU HA H 42 3.708 4.010 -0.302 1
1 458 . 35 1 1 A 42 42 LEU C C 42 178.206 178.991 -0.785 1
1 459 . 35 1 1 A 42 42 LEU CA C 42 57.417 57.734 -0.317 1
1 460 . 35 1 1 A 42 42 LEU CB C 42 41.342 41.175 0.167 1
1 464 . 35 1 1 A 42 42 LEU N N 42 120.418 118.536 1.882 1
1 465 . 35 1 1 A 43 43 ALA H H 43 7.735 7.648 0.087 1
1 466 . 35 1 1 A 43 43 ALA HA H 43 4.020 3.972 0.048 1
1 470 . 35 1 1 A 43 43 ALA C C 43 180.826 180.027 0.799 1
1 471 . 35 1 1 A 43 43 ALA CA C 43 54.925 54.863 0.062 1
1 472 . 35 1 1 A 43 43 ALA CB C 43 17.506 18.152 -0.646 1
1 473 . 35 1 1 A 43 43 ALA N N 43 120.203 121.846 -1.643 1
1 474 . 35 1 1 A 44 44 ILE H H 44 7.149 7.280 -0.131 1
1 475 . 35 1 1 A 44 44 ILE HA H 44 3.603 4.098 -0.495 1
1 485 . 35 1 1 A 44 44 ILE C C 44 178.594 178.260 0.334 1
1 486 . 35 1 1 A 44 44 ILE CA C 44 64.782 63.827 0.955 1
1 487 . 35 1 1 A 44 44 ILE CB C 44 37.472 37.127 0.345 1
1 491 . 35 1 1 A 44 44 ILE N N 44 118.881 119.140 -0.259 1
1 492 . 35 1 1 A 45 45 VAL H H 45 7.968 7.820 0.148 1
1 493 . 35 1 1 A 45 45 VAL HA H 45 2.925 3.276 -0.351 1
1 501 . 35 1 1 A 45 45 VAL C C 45 177.023 177.720 -0.697 1
1 502 . 35 1 1 A 45 45 VAL CA C 45 67.081 66.916 0.165 1
1 503 . 35 1 1 A 45 45 VAL CB C 45 30.854 31.268 -0.414 1
1 506 . 35 1 1 A 45 45 VAL N N 45 120.764 119.954 0.810 1
1 507 . 35 1 1 A 46 46 GLU H H 46 8.399 8.293 0.106 1
1 508 . 35 1 1 A 46 46 GLU HA H 46 3.848 3.885 -0.037 1
1 513 . 35 1 1 A 46 46 GLU C C 46 178.656 178.151 0.505 1
1 514 . 35 1 1 A 46 46 GLU CA C 46 59.491 58.915 0.576 1
1 515 . 35 1 1 A 46 46 GLU CB C 46 28.991 28.725 0.266 1
1 517 . 35 1 1 A 46 46 GLU N N 46 116.599 119.750 -3.151 1
1 518 . 35 1 1 A 47 47 SER H H 47 7.273 7.966 -0.693 1
1 519 . 35 1 1 A 47 47 SER HA H 47 4.287 4.144 0.143 1
1 521 . 35 1 1 A 47 47 SER CA C 47 61.047 61.179 -0.132 1
1 522 . 35 1 1 A 47 47 SER CB C 47 63.016 62.575 0.441 1
1 523 . 35 1 1 A 47 47 SER N N 47 113.609 115.523 -1.914 1
1 524 . 35 1 1 A 48 48 VAL H H 48 8.006 8.065 -0.059 1
1 525 . 35 1 1 A 48 48 VAL HA H 48 3.556 3.512 0.044 1
1 533 . 35 1 1 A 48 48 VAL C C 48 177.257 177.365 -0.108 1
1 534 . 35 1 1 A 48 48 VAL CA C 48 65.025 66.531 -1.506 1
1 535 . 35 1 1 A 48 48 VAL CB C 48 31.841 31.448 0.393 1
1 538 . 35 1 1 A 48 48 VAL N N 48 122.327 123.003 -0.676 1
1 539 . 35 1 1 A 49 49 ALA H H 49 8.369 7.589 0.780 1
1 540 . 35 1 1 A 49 49 ALA HA H 49 4.115 4.142 -0.027 1
1 544 . 35 1 1 A 49 49 ALA C C 49 177.307 177.272 0.035 1
1 545 . 35 1 1 A 49 49 ALA CA C 49 53.253 53.063 0.190 1
1 546 . 35 1 1 A 49 49 ALA CB C 49 20.131 18.228 1.903 1
1 547 . 35 1 1 A 49 49 ALA N N 49 118.050 120.966 -2.916 1
1 548 . 35 1 1 A 50 50 ASP H H 50 7.052 7.781 -0.729 1
1 549 . 35 1 1 A 50 50 ASP HA H 50 4.788 4.617 0.171 1
1 552 . 35 1 1 A 50 50 ASP C C 50 175.481 175.541 -0.060 1
1 553 . 35 1 1 A 50 50 ASP CA C 50 53.681 53.179 0.502 1
1 554 . 35 1 1 A 50 50 ASP CB C 50 39.333 41.035 -1.702 1
1 555 . 35 1 1 A 50 50 ASP N N 50 116.997 116.604 0.393 1
1 556 . 35 1 1 A 51 51 ASN H H 51 8.535 7.446 1.089 1
1 557 . 35 1 1 A 51 51 ASN HA H 51 4.628 4.690 -0.062 1
1 562 . 35 1 1 A 51 51 ASN C C 51 174.077 174.179 -0.102 1
1 563 . 35 1 1 A 51 51 ASN CA C 51 52.315 51.853 0.462 1
1 564 . 35 1 1 A 51 51 ASN CB C 51 41.928 41.392 0.536 1
1 565 . 35 1 1 A 51 51 ASN N N 51 118.626 117.182 1.444 1
1 567 . 35 1 1 A 52 52 TRP H H 52 8.555 8.732 -0.177 1
1 574 . 35 1 1 A 52 52 TRP C C 52 173.269 176.432 -3.163 1
1 575 . 35 1 1 A 52 52 TRP CA C 52 55.031 55.928 -0.897 1
1 576 . 35 1 1 A 52 52 TRP CB C 52 26.801 30.827 -4.026 1
1 582 . 35 1 1 A 52 52 TRP N N 52 120.693 120.531 0.162 1
1 584 . 35 1 1 A 53 53 LEU H H 53 7.847 8.908 -1.061 1
1 585 . 35 1 1 A 53 53 LEU HA H 53 4.859 5.102 -0.243 1
1 595 . 35 1 1 A 53 53 LEU C C 53 177.397 175.452 1.945 1
1 596 . 35 1 1 A 53 53 LEU CA C 53 53.619 53.449 0.170 1
1 597 . 35 1 1 A 53 53 LEU CB C 53 41.812 45.759 -3.947 1
1 601 . 35 1 1 A 53 53 LEU N N 53 124.741 120.482 4.259 1
1 602 . 35 1 1 A 54 54 THR H H 54 8.850 8.294 0.556 1
1 603 . 35 1 1 A 54 54 THR HA H 54 4.598 4.826 -0.228 1
1 608 . 35 1 1 A 54 54 THR CA C 54 60.531 59.012 1.519 1
1 609 . 35 1 1 A 54 54 THR CB C 54 67.183 69.724 -2.541 1
1 611 . 35 1 1 A 54 54 THR N N 54 113.407 110.935 2.472 1
1 612 . 35 1 1 A 55 55 PRO HA H 55 4.511 4.268 0.243 1
1 619 . 35 1 1 A 55 55 PRO C C 55 179.383 177.677 1.706 1
1 620 . 35 1 1 A 55 55 PRO CA C 55 67.159 65.353 1.806 1
1 621 . 35 1 1 A 55 55 PRO CB C 55 32.095 31.642 0.453 1
1 622 . 35 1 1 A 56 56 THR H H 56 8.575 7.671 0.904 1
1 623 . 35 1 1 A 56 56 THR HA H 56 4.229 4.169 0.060 1
1 628 . 35 1 1 A 56 56 THR C C 56 176.668 176.241 0.427 1
1 629 . 35 1 1 A 56 56 THR CA C 56 66.943 64.791 2.152 1
1 630 . 35 1 1 A 56 56 THR CB C 56 68.129 68.795 -0.666 1
1 632 . 35 1 1 A 56 56 THR N N 56 114.855 111.441 3.414 1
1 633 . 35 1 1 A 57 57 ASP H H 57 8.730 7.728 1.002 1
1 634 . 35 1 1 A 57 57 ASP HA H 57 4.425 4.291 0.134 1
1 637 . 35 1 1 A 57 57 ASP C C 57 178.351 178.781 -0.430 1
1 638 . 35 1 1 A 57 57 ASP CA C 57 57.963 56.693 1.270 1
1 639 . 35 1 1 A 57 57 ASP CB C 57 40.134 40.346 -0.212 1
1 640 . 35 1 1 A 57 57 ASP N N 57 126.239 120.772 5.467 1
1 641 . 35 1 1 A 58 58 TRP H H 58 8.244 8.308 -0.064 1
1 642 . 35 1 1 A 58 58 TRP HA H 58 4.030 4.545 -0.515 1
1 650 . 35 1 1 A 58 58 TRP C C 58 177.432 179.368 -1.936 1
1 651 . 35 1 1 A 58 58 TRP CA C 58 62.731 60.076 2.655 1
1 652 . 35 1 1 A 58 58 TRP CB C 58 29.122 29.317 -0.195 1
1 657 . 35 1 1 A 58 58 TRP N N 58 119.241 121.127 -1.886 1
1 659 . 35 1 1 A 59 59 ASN H H 59 8.098 8.267 -0.169 1
1 660 . 35 1 1 A 59 59 ASN HA H 59 4.424 4.317 0.107 1
1 663 . 35 1 1 A 59 59 ASN C C 59 176.952 177.926 -0.974 1
1 664 . 35 1 1 A 59 59 ASN CA C 59 58.135 56.335 1.800 1
1 665 . 35 1 1 A 59 59 ASN CB C 59 40.168 37.930 2.238 1
1 666 . 35 1 1 A 59 59 ASN N N 59 115.747 117.577 -1.830 1
1 667 . 35 1 1 A 60 60 THR H H 60 8.712 7.761 0.951 1
1 668 . 35 1 1 A 60 60 THR HA H 60 3.717 4.011 -0.294 1
1 673 . 35 1 1 A 60 60 THR C C 60 176.044 176.677 -0.633 1
1 674 . 35 1 1 A 60 60 THR CA C 60 66.576 66.852 -0.276 1
1 675 . 35 1 1 A 60 60 THR CB C 60 69.251 67.978 1.273 1
1 677 . 35 1 1 A 60 60 THR N N 60 114.896 118.427 -3.531 1
1 678 . 35 1 1 A 61 61 LEU H H 61 8.485 8.350 0.135 1
1 679 . 35 1 1 A 61 61 LEU HA H 61 3.391 4.012 -0.621 1
1 689 . 35 1 1 A 61 61 LEU C C 61 177.433 178.564 -1.131 1
1 690 . 35 1 1 A 61 61 LEU CA C 61 58.354 58.485 -0.131 1
1 691 . 35 1 1 A 61 61 LEU CB C 61 41.761 42.236 -0.475 1
1 695 . 35 1 1 A 61 61 LEU N N 61 123.433 122.240 1.193 1
1 696 . 35 1 1 A 62 62 VAL H H 62 8.073 8.214 -0.141 1
1 697 . 35 1 1 A 62 62 VAL HA H 62 3.207 3.792 -0.585 1
1 705 . 35 1 1 A 62 62 VAL C C 62 177.585 177.518 0.067 1
1 706 . 35 1 1 A 62 62 VAL CA C 62 67.345 65.125 2.220 1
1 707 . 35 1 1 A 62 62 VAL CB C 62 30.905 30.563 0.342 1
1 710 . 35 1 1 A 62 62 VAL N N 62 116.018 118.366 -2.348 1
1 711 . 35 1 1 A 63 63 ARG H H 63 7.765 7.780 -0.015 1
1 712 . 35 1 1 A 63 63 ARG HA H 63 3.602 3.919 -0.317 1
1 719 . 35 1 1 A 63 63 ARG C C 63 177.818 178.517 -0.699 1
1 720 . 35 1 1 A 63 63 ARG CA C 63 58.049 59.748 -1.699 1
1 721 . 35 1 1 A 63 63 ARG CB C 63 29.955 30.006 -0.051 1
1 724 . 35 1 1 A 63 63 ARG N N 63 116.700 121.841 -5.141 1
1 725 . 35 1 1 A 64 64 ALA H H 64 7.574 7.804 -0.230 1
1 726 . 35 1 1 A 64 64 ALA HA H 64 4.158 4.046 0.112 1
1 730 . 35 1 1 A 64 64 ALA C C 64 179.886 179.976 -0.090 1
1 731 . 35 1 1 A 64 64 ALA CA C 64 54.007 55.336 -1.329 1
1 732 . 35 1 1 A 64 64 ALA CB C 64 19.147 18.498 0.649 1
1 733 . 35 1 1 A 64 64 ALA N N 64 117.555 121.792 -4.237 1
1 734 . 35 1 1 A 65 65 VAL H H 65 7.554 7.921 -0.367 1
1 735 . 35 1 1 A 65 65 VAL HA H 65 4.253 3.743 0.510 1
1 743 . 35 1 1 A 65 65 VAL C C 65 174.180 175.806 -1.626 1
1 744 . 35 1 1 A 65 65 VAL CA C 65 62.683 65.006 -2.323 1
1 745 . 35 1 1 A 65 65 VAL CB C 65 33.458 31.132 2.326 1
1 748 . 35 1 1 A 65 65 VAL N N 65 110.013 115.782 -5.769 1
1 749 . 35 1 1 A 66 66 LEU H H 66 7.792 7.811 -0.019 1
1 750 . 35 1 1 A 66 66 LEU HA H 66 4.790 4.663 0.127 1
1 760 . 35 1 1 A 66 66 LEU C C 66 177.537 174.757 2.780 1
1 761 . 35 1 1 A 66 66 LEU CA C 66 52.823 52.967 -0.144 1
1 762 . 35 1 1 A 66 66 LEU CB C 66 44.071 44.798 -0.727 1
1 766 . 35 1 1 A 66 66 LEU N N 66 118.967 122.118 -3.151 1
1 767 . 35 1 1 A 67 67 SER H H 67 9.208 8.348 0.860 1
1 768 . 35 1 1 A 67 67 SER HA H 67 4.414 4.991 -0.577 1
1 771 . 35 1 1 A 67 67 SER CA C 67 57.943 57.481 0.462 1
1 772 . 35 1 1 A 67 67 SER CB C 67 64.743 66.900 -2.157 1
1 773 . 35 1 1 A 67 67 SER N N 67 116.378 115.606 0.772 1
1 774 . 35 1 1 A 69 69 GLY HA2 H 69 3.916 3.731 0.185 1
1 775 . 35 1 1 A 69 69 GLY HA3 H 69 3.867 3.758 0.109 1
1 776 . 35 1 1 A 69 69 GLY C C 69 176.783 175.524 1.259 1
1 777 . 35 1 1 A 69 69 GLY CA C 69 46.977 46.662 0.315 1
1 778 . 35 1 1 A 70 70 ASP H H 70 7.674 8.179 -0.505 1
1 779 . 35 1 1 A 70 70 ASP HA H 70 4.511 3.560 0.951 1
1 782 . 35 1 1 A 70 70 ASP C C 70 178.096 178.386 -0.290 1
1 783 . 35 1 1 A 70 70 ASP CA C 70 57.262 56.361 0.901 1
1 784 . 35 1 1 A 70 70 ASP CB C 70 40.594 39.661 0.933 1
1 785 . 35 1 1 A 70 70 ASP N N 70 123.930 121.832 2.098 1
1 786 . 35 1 1 A 71 71 HIS H H 71 8.729 8.027 0.702 1
1 787 . 35 1 1 A 71 71 HIS HA H 71 4.235 4.139 0.096 1
1 790 . 35 1 1 A 71 71 HIS C C 71 176.769 177.915 -1.146 1
1 791 . 35 1 1 A 71 71 HIS CA C 71 60.041 58.943 1.098 1
1 792 . 35 1 1 A 71 71 HIS CB C 71 30.682 30.076 0.606 1
1 793 . 35 1 1 A 71 71 HIS N N 71 121.003 116.996 4.007 1
1 794 . 35 1 1 A 72 72 LEU H H 72 7.620 7.980 -0.360 1
1 795 . 35 1 1 A 72 72 LEU HA H 72 3.769 4.017 -0.248 1
1 805 . 35 1 1 A 72 72 LEU C C 72 180.275 179.310 0.965 1
1 806 . 35 1 1 A 72 72 LEU CA C 72 58.192 58.028 0.164 1
1 807 . 35 1 1 A 72 72 LEU CB C 72 41.381 41.275 0.106 1
1 811 . 35 1 1 A 72 72 LEU N N 72 118.569 117.004 1.565 1
1 812 . 35 1 1 A 73 73 LEU H H 73 7.542 8.324 -0.782 1
1 813 . 35 1 1 A 73 73 LEU HA H 73 4.107 4.051 0.056 1
1 823 . 35 1 1 A 73 73 LEU C C 73 179.436 179.148 0.288 1
1 824 . 35 1 1 A 73 73 LEU CA C 73 58.026 57.680 0.346 1
1 825 . 35 1 1 A 73 73 LEU CB C 73 41.638 41.985 -0.347 1
1 829 . 35 1 1 A 73 73 LEU N N 73 121.418 121.251 0.167 1
1 830 . 35 1 1 A 74 74 TRP H H 74 8.786 7.944 0.842 1
1 831 . 35 1 1 A 74 74 TRP HA H 74 3.589 5.241 -1.652 1
1 840 . 35 1 1 A 74 74 TRP C C 74 176.816 178.626 -1.810 1
1 841 . 35 1 1 A 74 74 TRP CA C 74 63.046 59.828 3.218 1
1 842 . 35 1 1 A 74 74 TRP CB C 74 28.065 29.161 -1.096 1
1 848 . 35 1 1 A 74 74 TRP N N 74 121.111 118.373 2.738 1
1 850 . 35 1 1 A 75 75 LYS H H 75 8.939 7.679 1.260 1
1 851 . 35 1 1 A 75 75 LYS HA H 75 3.055 4.057 -1.002 1
1 860 . 35 1 1 A 75 75 LYS C C 75 177.967 179.350 -1.383 1
1 861 . 35 1 1 A 75 75 LYS CA C 75 60.029 58.519 1.510 1
1 862 . 35 1 1 A 75 75 LYS CB C 75 32.533 32.797 -0.264 1
1 866 . 35 1 1 A 75 75 LYS N N 75 119.783 118.604 1.179 1
1 867 . 35 1 1 A 76 76 SER H H 76 7.832 8.180 -0.348 1
1 868 . 35 1 1 A 76 76 SER HA H 76 4.040 4.516 -0.476 1
1 871 . 35 1 1 A 76 76 SER C C 76 177.816 175.599 2.217 1
1 872 . 35 1 1 A 76 76 SER CA C 76 62.105 61.756 0.349 1
1 873 . 35 1 1 A 76 76 SER CB C 76 62.679 62.979 -0.300 1
1 874 . 35 1 1 A 76 76 SER N N 76 113.395 117.237 -3.842 1
1 875 . 35 1 1 A 77 77 GLU H H 77 7.590 7.672 -0.082 1
1 876 . 35 1 1 A 77 77 GLU HA H 77 4.042 4.149 -0.107 1
1 881 . 35 1 1 A 77 77 GLU C C 77 177.809 178.941 -1.132 1
1 882 . 35 1 1 A 77 77 GLU CA C 77 58.270 59.052 -0.782 1
1 883 . 35 1 1 A 77 77 GLU CB C 77 29.208 29.153 0.055 1
1 885 . 35 1 1 A 77 77 GLU N N 77 121.574 122.019 -0.445 1
1 886 . 35 1 1 A 78 78 PHE H H 78 9.081 7.844 1.237 1
1 887 . 35 1 1 A 78 78 PHE HA H 78 3.778 4.180 -0.402 1
1 895 . 35 1 1 A 78 78 PHE C C 78 178.114 177.324 0.790 1
1 896 . 35 1 1 A 78 78 PHE CA C 78 60.629 61.213 -0.584 1
1 897 . 35 1 1 A 78 78 PHE CB C 78 38.295 38.254 0.041 1
1 902 . 35 1 1 A 78 78 PHE N N 78 122.682 121.006 1.676 1
1 903 . 35 1 1 A 79 79 PHE H H 79 8.890 7.965 0.925 1
1 904 . 35 1 1 A 79 79 PHE HA H 79 3.800 4.023 -0.223 1
1 912 . 35 1 1 A 79 79 PHE C C 79 178.354 178.250 0.104 1
1 913 . 35 1 1 A 79 79 PHE CA C 79 60.704 62.066 -1.362 1
1 914 . 35 1 1 A 79 79 PHE CB C 79 37.184 38.640 -1.456 1
1 920 . 35 1 1 A 79 79 PHE N N 79 121.056 117.965 3.091 1
1 921 . 35 1 1 A 80 80 GLU H H 80 7.793 8.029 -0.236 1
1 922 . 35 1 1 A 80 80 GLU HA H 80 4.082 3.989 0.093 1
1 927 . 35 1 1 A 80 80 GLU C C 80 179.068 179.008 0.060 1
1 928 . 35 1 1 A 80 80 GLU CA C 80 59.735 59.772 -0.037 1
1 929 . 35 1 1 A 80 80 GLU CB C 80 28.722 29.101 -0.379 1
1 931 . 35 1 1 A 80 80 GLU N N 80 120.312 119.776 0.536 1
1 932 . 35 1 1 A 81 81 ASN H H 81 8.624 8.959 -0.335 1
1 933 . 35 1 1 A 81 81 ASN HA H 81 4.521 4.433 0.088 1
1 938 . 35 1 1 A 81 81 ASN C C 81 179.262 177.484 1.778 1
1 939 . 35 1 1 A 81 81 ASN CA C 81 55.504 55.924 -0.420 1
1 940 . 35 1 1 A 81 81 ASN CB C 81 37.517 37.381 0.136 1
1 941 . 35 1 1 A 81 81 ASN N N 81 119.338 117.216 2.122 1
1 943 . 35 1 1 A 82 82 CYS H H 82 8.554 7.973 0.581 1
1 944 . 35 1 1 A 82 82 CYS HA H 82 3.792 3.927 -0.135 1
1 947 . 35 1 1 A 82 82 CYS C C 82 176.478 177.255 -0.777 1
1 948 . 35 1 1 A 82 82 CYS CA C 82 65.232 63.379 1.853 1
1 949 . 35 1 1 A 82 82 CYS CB C 82 26.762 26.722 0.040 1
1 950 . 35 1 1 A 82 82 CYS N N 82 120.576 117.709 2.867 1
1 951 . 35 1 1 A 83 83 ARG H H 83 8.522 8.052 0.470 1
1 952 . 35 1 1 A 83 83 ARG HA H 83 3.932 4.196 -0.264 1
1 960 . 35 1 1 A 83 83 ARG C C 83 179.138 178.732 0.406 1
1 961 . 35 1 1 A 83 83 ARG CA C 83 60.443 58.944 1.499 1
1 962 . 35 1 1 A 83 83 ARG CB C 83 29.550 29.613 -0.063 1
1 965 . 35 1 1 A 83 83 ARG N N 83 123.035 119.816 3.219 1
1 967 . 35 1 1 A 84 84 ASP H H 84 7.791 8.069 -0.278 1
1 968 . 35 1 1 A 84 84 ASP HA H 84 4.353 4.412 -0.059 1
1 971 . 35 1 1 A 84 84 ASP C C 84 178.649 178.685 -0.036 1
1 972 . 35 1 1 A 84 84 ASP CA C 84 57.767 57.614 0.153 1
1 973 . 35 1 1 A 84 84 ASP CB C 84 41.305 41.604 -0.299 1
1 974 . 35 1 1 A 84 84 ASP N N 84 120.332 119.287 1.045 1
1 975 . 35 1 1 A 85 85 THR H H 85 8.370 8.311 0.059 1
1 976 . 35 1 1 A 85 85 THR HA H 85 3.730 3.955 -0.225 1
1 981 . 35 1 1 A 85 85 THR C C 85 175.198 176.306 -1.108 1
1 982 . 35 1 1 A 85 85 THR CA C 85 66.830 65.947 0.883 1
1 983 . 35 1 1 A 85 85 THR CB C 85 68.533 68.324 0.209 1
1 985 . 35 1 1 A 85 85 THR N N 85 117.360 115.515 1.845 1
1 986 . 35 1 1 A 86 86 ALA H H 86 8.845 8.444 0.401 1
1 987 . 35 1 1 A 86 86 ALA HA H 86 3.991 4.132 -0.141 1
1 991 . 35 1 1 A 86 86 ALA C C 86 179.980 180.055 -0.075 1
1 992 . 35 1 1 A 86 86 ALA CA C 86 55.769 55.665 0.104 1
1 993 . 35 1 1 A 86 86 ALA CB C 86 17.881 18.422 -0.541 1
1 994 . 35 1 1 A 86 86 ALA N N 86 123.613 122.877 0.736 1
1 995 . 35 1 1 A 87 87 LYS H H 87 7.686 8.256 -0.570 1
1 996 . 35 1 1 A 87 87 LYS HA H 87 4.099 4.028 0.071 1
1 1005 . 35 1 1 A 87 87 LYS C C 87 179.592 179.489 0.103 1
1 1006 . 35 1 1 A 87 87 LYS CA C 87 59.708 59.792 -0.084 1
1 1007 . 35 1 1 A 87 87 LYS CB C 87 32.054 32.391 -0.337 1
1 1011 . 35 1 1 A 87 87 LYS N N 87 119.623 117.379 2.244 1
1 1012 . 35 1 1 A 88 88 ARG H H 88 7.683 7.603 0.080 1
1 1013 . 35 1 1 A 88 88 ARG HA H 88 4.051 4.153 -0.102 1
1 1020 . 35 1 1 A 88 88 ARG C C 88 180.053 178.158 1.895 1
1 1021 . 35 1 1 A 88 88 ARG CA C 88 59.558 58.911 0.647 1
1 1022 . 35 1 1 A 88 88 ARG CB C 88 29.684 29.692 -0.008 1
1 1025 . 35 1 1 A 88 88 ARG N N 88 120.788 118.874 1.914 1
1 1026 . 35 1 1 A 89 89 ASN H H 89 8.973 7.984 0.989 1
1 1027 . 35 1 1 A 89 89 ASN HA H 89 4.354 4.638 -0.284 1
1 1032 . 35 1 1 A 89 89 ASN C C 89 178.382 178.213 0.169 1
1 1033 . 35 1 1 A 89 89 ASN CA C 89 55.334 55.248 0.086 1
1 1034 . 35 1 1 A 89 89 ASN CB C 89 37.864 38.627 -0.763 1
1 1035 . 35 1 1 A 89 89 ASN N N 89 121.012 117.259 3.753 1
1 1037 . 35 1 1 A 90 90 GLN H H 90 8.152 8.613 -0.461 1
1 1038 . 35 1 1 A 90 90 GLN HA H 90 4.020 4.093 -0.073 1
1 1045 . 35 1 1 A 90 90 GLN C C 90 179.075 178.845 0.230 1
1 1046 . 35 1 1 A 90 90 GLN CA C 90 59.318 58.918 0.400 1
1 1047 . 35 1 1 A 90 90 GLN CB C 90 28.049 28.212 -0.163 1
1 1049 . 35 1 1 A 90 90 GLN N N 90 122.122 120.833 1.289 1
1 1051 . 35 1 1 A 91 91 GLN H H 91 7.514 8.291 -0.777 1
1 1052 . 35 1 1 A 91 91 GLN HA H 91 4.053 4.181 -0.128 1
1 1059 . 35 1 1 A 91 91 GLN C C 91 177.081 177.329 -0.248 1
1 1060 . 35 1 1 A 91 91 GLN CA C 91 58.031 57.425 0.606 1
1 1061 . 35 1 1 A 91 91 GLN CB C 91 28.365 27.041 1.324 1
1 1063 . 35 1 1 A 91 91 GLN N N 91 118.124 117.900 0.224 1
1 1065 . 35 1 1 A 92 92 ALA H H 92 7.704 7.759 -0.055 1
1 1066 . 35 1 1 A 92 92 ALA HA H 92 4.246 4.332 -0.086 1
1 1070 . 35 1 1 A 92 92 ALA C C 92 178.450 178.104 0.346 1
1 1071 . 35 1 1 A 92 92 ALA CA C 92 52.671 52.453 0.218 1
1 1072 . 35 1 1 A 92 92 ALA CB C 92 19.316 20.011 -0.695 1
1 1073 . 35 1 1 A 92 92 ALA N N 92 119.880 120.791 -0.911 1
1 1074 . 35 1 1 A 93 93 GLY H H 93 7.693 7.733 -0.040 1
1 1075 . 35 1 1 A 93 93 GLY HA2 H 93 3.941 3.912 0.029 1
1 1076 . 35 1 1 A 93 93 GLY HA3 H 93 3.744 3.920 -0.176 1
1 1077 . 35 1 1 A 93 93 GLY C C 93 174.344 175.073 -0.729 1
1 1078 . 35 1 1 A 93 93 GLY CA C 93 45.949 46.373 -0.424 1
1 1079 . 35 1 1 A 93 93 GLY N N 93 105.347 106.299 -0.952 1
1 1080 . 35 1 1 A 94 94 ASN H H 94 7.076 8.189 -1.113 1
1 1081 . 35 1 1 A 94 94 ASN HA H 94 4.115 4.425 -0.310 1
1 1085 . 35 1 1 A 94 94 ASN C C 94 175.410 175.742 -0.332 1
1 1086 . 35 1 1 A 94 94 ASN CA C 94 52.651 52.540 0.111 1
1 1087 . 35 1 1 A 94 94 ASN CB C 94 38.330 39.317 -0.987 1
1 1088 . 35 1 1 A 94 94 ASN N N 94 115.747 116.388 -0.641 1
1 1090 . 35 1 1 A 95 95 GLY H H 95 8.236 8.627 -0.391 1
1 1091 . 35 1 1 A 95 95 GLY HA2 H 95 3.633 3.822 -0.189 1
1 1092 . 35 1 1 A 95 95 GLY HA3 H 95 3.633 3.968 -0.335 1
1 1093 . 35 1 1 A 95 95 GLY C C 95 174.450 173.644 0.806 1
1 1094 . 35 1 1 A 95 95 GLY CA C 95 45.522 46.138 -0.616 1
1 1095 . 35 1 1 A 95 95 GLY N N 95 109.166 107.929 1.237 1
1 1096 . 35 1 1 A 96 96 TRP H H 96 7.899 7.948 -0.049 1
1 1097 . 35 1 1 A 96 96 TRP HA H 96 5.241 5.198 0.043 1
1 1106 . 35 1 1 A 96 96 TRP C C 96 175.661 176.277 -0.616 1
1 1107 . 35 1 1 A 96 96 TRP CA C 96 55.090 56.104 -1.014 1
1 1108 . 35 1 1 A 96 96 TRP CB C 96 27.138 32.418 -5.280 1
1 1114 . 35 1 1 A 96 96 TRP N N 96 122.840 119.951 2.889 1
1 1116 . 35 1 1 A 97 97 ASP H H 97 7.344 9.098 -1.754 1
1 1117 . 35 1 1 A 97 97 ASP HA H 97 4.829 4.298 0.531 1
1 1120 . 35 1 1 A 97 97 ASP C C 97 175.019 176.815 -1.796 1
1 1121 . 35 1 1 A 97 97 ASP CA C 97 52.149 56.864 -4.715 1
1 1122 . 35 1 1 A 97 97 ASP CB C 97 42.697 39.218 3.479 1
1 1123 . 35 1 1 A 97 97 ASP N N 97 126.861 117.056 9.805 1
1 1124 . 35 1 1 A 98 98 PHE H H 98 8.566 8.564 0.002 1
1 1125 . 35 1 1 A 98 98 PHE HA H 98 3.727 4.182 -0.455 1
1 1133 . 35 1 1 A 98 98 PHE C C 98 177.443 177.427 0.016 1
1 1134 . 35 1 1 A 98 98 PHE CA C 98 62.471 61.153 1.318 1
1 1135 . 35 1 1 A 98 98 PHE CB C 98 39.919 39.484 0.435 1
1 1141 . 35 1 1 A 98 98 PHE N N 98 117.781 120.920 -3.139 1
1 1142 . 35 1 1 A 99 99 ASP H H 99 8.259 8.105 0.154 1
1 1143 . 35 1 1 A 99 99 ASP HA H 99 3.960 4.305 -0.345 1
1 1146 . 35 1 1 A 99 99 ASP C C 99 178.132 177.953 0.179 1
1 1147 . 35 1 1 A 99 99 ASP CA C 99 57.658 56.539 1.119 1
1 1148 . 35 1 1 A 99 99 ASP CB C 99 38.572 40.621 -2.049 1
1 1149 . 35 1 1 A 99 99 ASP N N 99 121.709 119.407 2.302 1
1 1150 . 35 1 1 A 100 100 MET H H 100 8.008 7.942 0.066 1
1 1151 . 35 1 1 A 100 100 MET HA H 100 3.644 4.494 -0.850 1
1 1156 . 35 1 1 A 100 100 MET C C 100 180.008 176.702 3.306 1
1 1157 . 35 1 1 A 100 100 MET CA C 100 58.598 57.637 0.961 1
1 1158 . 35 1 1 A 100 100 MET CB C 100 33.423 33.685 -0.262 1
1 1160 . 35 1 1 A 100 100 MET N N 100 119.668 116.622 3.046 1
1 1161 . 35 1 1 A 101 101 LEU H H 101 7.961 8.237 -0.276 1
1 1162 . 35 1 1 A 101 101 LEU HA H 101 3.523 4.654 -1.131 1
1 1172 . 35 1 1 A 101 101 LEU C C 101 173.873 175.397 -1.524 1
1 1173 . 35 1 1 A 101 101 LEU CA C 101 58.743 53.845 4.898 1
1 1174 . 35 1 1 A 101 101 LEU CB C 101 42.632 41.837 0.795 1
1 1178 . 35 1 1 A 101 101 LEU N N 101 119.752 119.977 -0.225 1
1 1179 . 35 1 1 A 102 102 THR H H 102 6.955 8.570 -1.615 1
1 1180 . 35 1 1 A 102 102 THR HA H 102 4.134 4.832 -0.698 1
1 1185 . 35 1 1 A 102 102 THR C C 102 176.513 173.045 3.468 1
1 1186 . 35 1 1 A 102 102 THR CA C 102 61.125 60.579 0.546 1
1 1187 . 35 1 1 A 102 102 THR CB C 102 71.415 70.402 1.013 1
1 1189 . 35 1 1 A 102 102 THR N N 102 124.665 118.640 6.025 1
1 1190 . 35 1 1 A 103 103 GLY H H 103 7.816 8.925 -1.109 1
1 1191 . 35 1 1 A 103 103 GLY HA2 H 103 3.824 4.081 -0.257 1
1 1192 . 35 1 1 A 103 103 GLY HA3 H 103 3.824 4.156 -0.332 1
1 1193 . 35 1 1 A 103 103 GLY C C 103 174.126 173.028 1.098 1
1 1194 . 35 1 1 A 103 103 GLY CA C 103 47.805 46.904 0.901 1
1 1195 . 35 1 1 A 103 103 GLY N N 103 114.191 111.481 2.710 1
1 1196 . 35 1 1 A 104 104 SER H H 104 8.860 7.896 0.964 1
1 1197 . 35 1 1 A 104 104 SER HA H 104 4.758 4.984 -0.226 1
1 1200 . 35 1 1 A 104 104 SER C C 104 174.591 173.050 1.541 1
1 1201 . 35 1 1 A 104 104 SER CA C 104 56.755 57.244 -0.489 1
1 1202 . 35 1 1 A 104 104 SER CB C 104 65.050 67.340 -2.290 1
1 1203 . 35 1 1 A 104 104 SER N N 104 114.771 114.762 0.009 1
1 1204 . 35 1 1 A 105 105 GLY H H 105 8.788 8.537 0.251 1
1 1205 . 35 1 1 A 105 105 GLY HA2 H 105 3.733 4.027 -0.294 1
1 1206 . 35 1 1 A 105 105 GLY HA3 H 105 3.733 4.057 -0.324 1
1 1207 . 35 1 1 A 105 105 GLY CA C 105 47.247 44.557 2.690 1
1 1208 . 35 1 1 A 105 105 GLY N N 105 110.394 110.084 0.310 1
1 1209 . 35 1 1 A 106 106 ASN HA H 106 4.454 5.019 -0.565 1
1 1212 . 35 1 1 A 106 106 ASN C C 106 175.180 175.470 -0.290 1
1 1213 . 35 1 1 A 106 106 ASN CA C 106 54.492 53.103 1.389 1
1 1214 . 35 1 1 A 106 106 ASN CB C 106 37.282 39.888 -2.606 1
1 1215 . 35 1 1 A 107 107 TYR H H 107 8.241 7.486 0.755 1
1 1216 . 35 1 1 A 107 107 TYR HA H 107 4.335 4.899 -0.564 1
1 1223 . 35 1 1 A 107 107 TYR C C 107 173.954 176.411 -2.457 1
1 1224 . 35 1 1 A 107 107 TYR CA C 107 57.727 57.007 0.720 1
1 1225 . 35 1 1 A 107 107 TYR CB C 107 37.063 39.388 -2.325 1
1 1230 . 35 1 1 A 107 107 TYR N N 107 120.708 114.942 5.766 1
1 1231 . 35 1 1 A 108 108 SER H H 108 7.117 7.818 -0.701 1
1 1232 . 35 1 1 A 108 108 SER HA H 108 4.221 4.575 -0.354 1
1 1235 . 35 1 1 A 108 108 SER C C 108 174.834 174.168 0.666 1
1 1236 . 35 1 1 A 108 108 SER CA C 108 59.859 59.936 -0.077 1
1 1237 . 35 1 1 A 108 108 SER CB C 108 63.846 64.083 -0.237 1
1 1238 . 35 1 1 A 108 108 SER N N 108 113.362 114.867 -1.505 1
1 1239 . 35 1 1 A 109 109 SER H H 109 8.053 7.883 0.170 1
1 1240 . 35 1 1 A 109 109 SER HA H 109 4.560 4.226 0.334 1
1 1243 . 35 1 1 A 109 109 SER CA C 109 57.141 60.843 -3.702 1
1 1244 . 35 1 1 A 109 109 SER CB C 109 64.874 61.866 3.008 1
1 1245 . 35 1 1 A 109 109 SER N N 109 116.657 114.094 2.563 1
1 1246 . 35 1 1 A 110 110 THR HA H 110 3.541 3.941 -0.400 1
1 1251 . 35 1 1 A 110 110 THR C C 110 175.477 176.186 -0.709 1
1 1252 . 35 1 1 A 110 110 THR CA C 110 66.443 66.064 0.379 1
1 1253 . 35 1 1 A 110 110 THR CB C 110 68.091 68.563 -0.472 1
1 1255 . 35 1 1 A 111 111 ASP H H 111 8.224 8.315 -0.091 1
1 1256 . 35 1 1 A 111 111 ASP HA H 111 4.237 4.255 -0.018 1
1 1259 . 35 1 1 A 111 111 ASP C C 111 177.520 178.097 -0.577 1
1 1260 . 35 1 1 A 111 111 ASP CA C 111 57.559 57.603 -0.044 1
1 1261 . 35 1 1 A 111 111 ASP CB C 111 40.292 41.707 -1.415 1
1 1262 . 35 1 1 A 111 111 ASP N N 111 119.490 121.160 -1.670 1
1 1263 . 35 1 1 A 112 112 ALA H H 112 7.431 8.132 -0.701 1
1 1264 . 35 1 1 A 112 112 ALA HA H 112 4.191 4.158 0.033 1
1 1268 . 35 1 1 A 112 112 ALA C C 112 180.646 179.952 0.694 1
1 1269 . 35 1 1 A 112 112 ALA CA C 112 54.534 54.070 0.464 1
1 1270 . 35 1 1 A 112 112 ALA CB C 112 18.992 18.405 0.587 1
1 1271 . 35 1 1 A 112 112 ALA N N 112 119.710 121.565 -1.855 1
1 1272 . 35 1 1 A 113 113 GLN H H 113 7.576 7.796 -0.220 1
1 1273 . 35 1 1 A 113 113 GLN HA H 113 3.562 4.267 -0.705 1
1 1278 . 35 1 1 A 113 113 GLN C C 113 176.756 177.938 -1.182 1
1 1279 . 35 1 1 A 113 113 GLN CA C 113 57.736 58.355 -0.619 1
1 1280 . 35 1 1 A 113 113 GLN CB C 113 29.110 28.814 0.296 1
1 1281 . 35 1 1 A 113 113 GLN N N 113 117.518 118.338 -0.820 1
1 1283 . 35 1 1 A 114 114 MET H H 114 8.192 8.479 -0.287 1
1 1284 . 35 1 1 A 114 114 MET HA H 114 4.231 4.421 -0.190 1
1 1289 . 35 1 1 A 114 114 MET C C 114 175.648 177.043 -1.395 1
1 1290 . 35 1 1 A 114 114 MET CA C 114 57.446 57.761 -0.315 1
1 1291 . 35 1 1 A 114 114 MET CB C 114 33.570 32.838 0.732 1
1 1293 . 35 1 1 A 114 114 MET N N 114 111.509 119.441 -7.932 1
1 1294 . 35 1 1 A 115 115 GLN H H 115 6.940 7.529 -0.589 1
1 1295 . 35 1 1 A 115 115 GLN HA H 115 4.307 4.315 -0.008 1
1 1302 . 35 1 1 A 115 115 GLN C C 115 176.270 174.652 1.618 1
1 1303 . 35 1 1 A 115 115 GLN CA C 115 54.680 54.924 -0.244 1
1 1304 . 35 1 1 A 115 115 GLN CB C 115 28.233 29.019 -0.786 1
1 1306 . 35 1 1 A 115 115 GLN N N 115 114.300 116.565 -2.265 1
1 1308 . 35 1 1 A 116 116 TYR H H 116 6.677 7.393 -0.716 1
1 1309 . 35 1 1 A 116 116 TYR HA H 116 4.193 4.879 -0.686 1
1 1312 . 35 1 1 A 116 116 TYR C C 116 175.268 174.982 0.286 1
1 1313 . 35 1 1 A 116 116 TYR CA C 116 54.357 57.782 -3.425 1
1 1314 . 35 1 1 A 116 116 TYR CB C 116 35.498 39.339 -3.841 1
1 1315 . 35 1 1 A 116 116 TYR N N 116 117.919 119.059 -1.140 1
1 1316 . 35 1 1 A 117 117 ASP H H 117 8.081 9.032 -0.951 1
1 1317 . 35 1 1 A 117 117 ASP HA H 117 4.665 4.915 -0.250 1
1 1320 . 35 1 1 A 117 117 ASP CA C 117 52.422 52.617 -0.195 1
1 1321 . 35 1 1 A 117 117 ASP CB C 117 42.416 40.480 1.936 1
1 1322 . 35 1 1 A 117 117 ASP N N 117 120.887 121.316 -0.429 1
1 1323 . 35 1 1 A 118 118 PRO C C 118 179.180 179.058 0.122 1
1 1324 . 35 1 1 A 118 118 PRO CA C 118 65.942 64.908 1.034 1
1 1325 . 35 1 1 A 118 118 PRO CB C 118 32.197 31.848 0.349 1
1 1326 . 35 1 1 A 119 119 GLY H H 119 9.742 8.285 1.457 1
1 1327 . 35 1 1 A 119 119 GLY C C 119 175.622 175.224 0.398 1
1 1328 . 35 1 1 A 119 119 GLY CA C 119 46.785 46.674 0.111 1
1 1329 . 35 1 1 A 119 119 GLY N N 119 106.412 106.340 0.072 1
1 1330 . 35 1 1 A 120 120 LEU H H 120 6.666 7.630 -0.964 1
1 1331 . 35 1 1 A 120 120 LEU HA H 120 3.365 3.432 -0.067 1
1 1341 . 35 1 1 A 120 120 LEU C C 120 179.262 178.576 0.686 1
1 1342 . 35 1 1 A 120 120 LEU CA C 120 56.605 57.545 -0.940 1
1 1343 . 35 1 1 A 120 120 LEU CB C 120 39.262 41.207 -1.945 1
1 1347 . 35 1 1 A 120 120 LEU N N 120 126.226 122.134 4.092 1
1 1348 . 35 1 1 A 121 121 PHE H H 121 7.356 8.646 -1.290 1
1 1349 . 35 1 1 A 121 121 PHE HA H 121 4.459 3.796 0.663 1
1 1352 . 35 1 1 A 121 121 PHE C C 121 179.716 177.801 1.915 1
1 1353 . 35 1 1 A 121 121 PHE CA C 121 62.838 62.002 0.836 1
1 1354 . 35 1 1 A 121 121 PHE CB C 121 37.603 38.924 -1.321 1
1 1355 . 35 1 1 A 121 121 PHE N N 121 117.437 119.335 -1.898 1
1 1356 . 35 1 1 A 122 122 ALA H H 122 7.926 8.019 -0.093 1
1 1357 . 35 1 1 A 122 122 ALA HA H 122 4.523 3.978 0.545 1
1 1361 . 35 1 1 A 122 122 ALA C C 122 180.435 179.539 0.896 1
1 1362 . 35 1 1 A 122 122 ALA CA C 122 55.527 54.922 0.605 1
1 1363 . 35 1 1 A 122 122 ALA CB C 122 17.814 18.262 -0.448 1
1 1364 . 35 1 1 A 122 122 ALA N N 122 121.068 121.436 -0.368 1
1 1365 . 35 1 1 A 123 123 GLN H H 123 7.507 7.750 -0.243 1
1 1366 . 35 1 1 A 123 123 GLN HA H 123 4.153 3.931 0.222 1
1 1371 . 35 1 1 A 123 123 GLN C C 123 180.561 178.951 1.610 1
1 1372 . 35 1 1 A 123 123 GLN CA C 123 59.948 59.056 0.892 1
1 1373 . 35 1 1 A 123 123 GLN CB C 123 29.135 28.168 0.967 1
1 1375 . 35 1 1 A 123 123 GLN N N 123 120.324 118.117 2.207 1
1 1376 . 35 1 1 A 124 124 ILE H H 124 8.318 7.951 0.367 1
1 1377 . 35 1 1 A 124 124 ILE HA H 124 3.635 3.816 -0.181 1
1 1387 . 35 1 1 A 124 124 ILE C C 124 176.481 177.771 -1.290 1
1 1388 . 35 1 1 A 124 124 ILE CA C 124 66.432 64.311 2.121 1
1 1389 . 35 1 1 A 124 124 ILE CB C 124 39.168 37.556 1.612 1
1 1393 . 35 1 1 A 124 124 ILE N N 124 123.747 117.984 5.763 1
1 1394 . 35 1 1 A 125 125 GLN H H 125 8.474 7.632 0.842 1
1 1395 . 35 1 1 A 125 125 GLN HA H 125 4.264 3.795 0.469 1
1 1402 . 35 1 1 A 125 125 GLN C C 125 178.947 178.503 0.444 1
1 1403 . 35 1 1 A 125 125 GLN CA C 125 59.651 58.583 1.068 1
1 1404 . 35 1 1 A 125 125 GLN CB C 125 28.880 28.099 0.781 1
1 1406 . 35 1 1 A 125 125 GLN N N 125 120.368 120.819 -0.451 1
1 1408 . 35 1 1 A 126 126 ALA H H 126 8.002 7.739 0.263 1
1 1409 . 35 1 1 A 126 126 ALA HA H 126 4.144 3.995 0.149 1
1 1413 . 35 1 1 A 126 126 ALA C C 126 179.316 179.794 -0.478 1
1 1414 . 35 1 1 A 126 126 ALA CA C 126 55.036 54.883 0.153 1
1 1415 . 35 1 1 A 126 126 ALA CB C 126 18.087 18.043 0.044 1
1 1416 . 35 1 1 A 126 126 ALA N N 126 121.661 122.224 -0.563 1
1 1417 . 35 1 1 A 127 127 ALA H H 127 7.823 8.070 -0.247 1
1 1418 . 35 1 1 A 127 127 ALA HA H 127 4.162 4.004 0.158 1
1 1422 . 35 1 1 A 127 127 ALA C C 127 180.707 179.476 1.231 1
1 1423 . 35 1 1 A 127 127 ALA CA C 127 55.080 54.804 0.276 1
1 1424 . 35 1 1 A 127 127 ALA CB C 127 19.354 18.681 0.673 1
1 1425 . 35 1 1 A 127 127 ALA N N 127 119.853 119.888 -0.035 1
1 1426 . 35 1 1 A 128 128 ALA H H 128 8.936 7.860 1.076 1
1 1427 . 35 1 1 A 128 128 ALA HA H 128 3.928 3.621 0.307 1
1 1431 . 35 1 1 A 128 128 ALA C C 128 181.031 179.456 1.575 1
1 1432 . 35 1 1 A 128 128 ALA CA C 128 55.502 54.583 0.919 1
1 1433 . 35 1 1 A 128 128 ALA CB C 128 16.609 17.835 -1.226 1
1 1434 . 35 1 1 A 128 128 ALA N N 128 121.355 120.189 1.166 1
1 1435 . 35 1 1 A 129 129 THR H H 129 8.543 7.750 0.793 1
1 1436 . 35 1 1 A 129 129 THR HA H 129 4.015 3.626 0.389 1
1 1441 . 35 1 1 A 129 129 THR C C 129 177.332 176.312 1.020 1
1 1442 . 35 1 1 A 129 129 THR CA C 129 65.893 65.153 0.740 1
1 1443 . 35 1 1 A 129 129 THR CB C 129 68.566 68.539 0.027 1
1 1445 . 35 1 1 A 129 129 THR N N 129 112.709 112.198 0.511 1
1 1446 . 35 1 1 A 130 130 LYS H H 130 8.126 7.418 0.708 1
1 1447 . 35 1 1 A 130 130 LYS HA H 130 4.000 3.986 0.014 1
1 1456 . 35 1 1 A 130 130 LYS C C 130 179.082 178.562 0.520 1
1 1457 . 35 1 1 A 130 130 LYS CA C 130 60.299 58.849 1.450 1
1 1458 . 35 1 1 A 130 130 LYS CB C 130 32.767 32.184 0.583 1
1 1462 . 35 1 1 A 130 130 LYS N N 130 123.879 120.451 3.428 1
1 1463 . 35 1 1 A 131 131 ALA H H 131 7.184 7.735 -0.551 1
1 1464 . 35 1 1 A 131 131 ALA HA H 131 4.005 4.230 -0.225 1
1 1468 . 35 1 1 A 131 131 ALA C C 131 178.482 179.522 -1.040 1
1 1469 . 35 1 1 A 131 131 ALA CA C 131 55.027 55.182 -0.155 1
1 1470 . 35 1 1 A 131 131 ALA CB C 131 18.669 19.505 -0.836 1
1 1471 . 35 1 1 A 131 131 ALA N N 131 118.590 120.633 -2.043 1
1 1472 . 35 1 1 A 132 132 TRP H H 132 7.977 8.638 -0.661 1
1 1473 . 35 1 1 A 132 132 TRP HA H 132 4.001 3.956 0.045 1
1 1480 . 35 1 1 A 132 132 TRP C C 132 177.332 175.636 1.696 1
1 1481 . 35 1 1 A 132 132 TRP CA C 132 60.431 57.234 3.197 1
1 1482 . 35 1 1 A 132 132 TRP CB C 132 27.786 27.462 0.324 1
1 1486 . 35 1 1 A 132 132 TRP N N 132 119.168 116.903 2.265 1
1 1488 . 35 1 1 A 133 133 ARG H H 133 8.006 8.005 0.001 1
1 1489 . 35 1 1 A 133 133 ARG HA H 133 4.027 4.446 -0.419 1
1 1497 . 35 1 1 A 133 133 ARG C C 133 176.664 178.540 -1.876 1
1 1498 . 35 1 1 A 133 133 ARG CA C 133 59.355 57.124 2.231 1
1 1499 . 35 1 1 A 133 133 ARG CB C 133 30.451 32.307 -1.856 1
1 1502 . 35 1 1 A 133 133 ARG N N 133 113.062 120.633 -7.571 1
1 1504 . 35 1 1 A 134 134 LYS H H 134 7.322 7.955 -0.633 1
1 1505 . 35 1 1 A 134 134 LYS HA H 134 4.313 4.182 0.131 1
1 1514 . 35 1 1 A 134 134 LYS C C 134 176.282 177.063 -0.781 1
1 1515 . 35 1 1 A 134 134 LYS CA C 134 54.922 57.751 -2.829 1
1 1516 . 35 1 1 A 134 134 LYS CB C 134 32.633 32.101 0.532 1
1 1520 . 35 1 1 A 134 134 LYS N N 134 118.170 118.728 -0.558 1
1 1521 . 35 1 1 A 135 135 LEU H H 135 7.440 8.014 -0.574 1
1 1522 . 35 1 1 A 135 135 LEU HA H 135 4.174 4.556 -0.382 1
1 1532 . 35 1 1 A 135 135 LEU CA C 135 54.408 52.866 1.542 1
1 1533 . 35 1 1 A 135 135 LEU CB C 135 40.407 41.294 -0.887 1
1 1537 . 35 1 1 A 135 135 LEU N N 135 123.358 121.805 1.553 1
1 1538 . 35 1 1 A 136 136 PRO HA H 136 4.437 4.608 -0.171 1
1 1545 . 35 1 1 A 136 136 PRO C C 136 177.106 176.251 0.855 1
1 1546 . 35 1 1 A 136 136 PRO CA C 136 62.889 62.187 0.702 1
1 1547 . 35 1 1 A 136 136 PRO CB C 136 32.192 32.427 -0.235 1
1 1550 . 35 1 1 A 137 137 VAL H H 137 8.219 8.386 -0.167 1
1 1551 . 35 1 1 A 137 137 VAL HA H 137 4.077 4.236 -0.159 1
1 1559 . 35 1 1 A 137 137 VAL C C 137 176.305 175.493 0.812 1
1 1560 . 35 1 1 A 137 137 VAL CA C 137 61.958 62.250 -0.292 1
1 1561 . 35 1 1 A 137 137 VAL CB C 137 32.755 32.655 0.100 1
1 1564 . 35 1 1 A 137 137 VAL N N 137 120.079 121.325 -1.246 1
1 1565 . 35 1 1 A 138 138 LYS H H 138 8.444 8.525 -0.081 1
1 1566 . 35 1 1 A 138 138 LYS HA H 138 4.316 4.365 -0.049 1
1 1575 . 35 1 1 A 138 138 LYS C C 138 176.790 177.063 -0.273 1
1 1576 . 35 1 1 A 138 138 LYS CA C 138 56.792 57.753 -0.961 1
1 1577 . 35 1 1 A 138 138 LYS CB C 138 33.205 33.966 -0.761 1
1 1581 . 35 1 1 A 138 138 LYS N N 138 126.449 127.363 -0.914 1
1 1582 . 35 1 1 A 139 139 GLY H H 139 8.518 7.575 0.943 1
1 1583 . 35 1 1 A 139 139 GLY HA2 H 139 4.070 4.021 0.049 1
1 1584 . 35 1 1 A 139 139 GLY HA3 H 139 3.897 4.036 -0.139 1
1 1585 . 35 1 1 A 139 139 GLY C C 139 172.874 172.131 0.743 1
1 1586 . 35 1 1 A 139 139 GLY CA C 139 45.157 45.604 -0.447 1
1 1587 . 35 1 1 A 139 139 GLY N N 139 112.617 106.666 5.951 1
1 6 . 36 1 1 A 2 2 VAL H H 2 8.992 8.555 0.437 1
1 7 . 36 1 1 A 2 2 VAL HA H 2 5.370 4.655 0.715 1
1 15 . 36 1 1 A 2 2 VAL C C 2 174.325 174.488 -0.163 1
1 16 . 36 1 1 A 2 2 VAL CA C 2 61.267 61.574 -0.307 1
1 17 . 36 1 1 A 2 2 VAL CB C 2 33.890 33.441 0.449 1
1 20 . 36 1 1 A 2 2 VAL N N 2 126.939 120.187 6.752 1
1 21 . 36 1 1 A 3 3 THR H H 3 8.912 8.948 -0.036 1
1 22 . 36 1 1 A 3 3 THR HA H 3 4.505 5.072 -0.567 1
1 27 . 36 1 1 A 3 3 THR C C 3 172.710 172.943 -0.233 1
1 28 . 36 1 1 A 3 3 THR CA C 3 59.689 59.457 0.232 1
1 29 . 36 1 1 A 3 3 THR CB C 3 72.398 71.528 0.870 1
1 31 . 36 1 1 A 3 3 THR N N 3 118.091 120.820 -2.729 1
1 32 . 36 1 1 A 4 4 GLU H H 4 8.631 8.988 -0.357 1
1 33 . 36 1 1 A 4 4 GLU HA H 4 5.788 5.000 0.788 1
1 38 . 36 1 1 A 4 4 GLU C C 4 175.758 174.429 1.329 1
1 39 . 36 1 1 A 4 4 GLU CA C 4 54.902 54.577 0.325 1
1 40 . 36 1 1 A 4 4 GLU CB C 4 35.097 33.619 1.478 1
1 42 . 36 1 1 A 4 4 GLU N N 4 120.966 125.876 -4.910 1
1 43 . 36 1 1 A 5 5 THR H H 5 9.188 9.162 0.026 1
1 44 . 36 1 1 A 5 5 THR HA H 5 4.739 5.104 -0.365 1
1 49 . 36 1 1 A 5 5 THR C C 5 172.757 172.493 0.264 1
1 50 . 36 1 1 A 5 5 THR CA C 5 60.382 59.584 0.798 1
1 51 . 36 1 1 A 5 5 THR CB C 5 71.558 72.244 -0.686 1
1 53 . 36 1 1 A 5 5 THR N N 5 119.366 114.951 4.415 1
1 54 . 36 1 1 A 6 6 VAL H H 6 8.476 8.856 -0.380 1
1 55 . 36 1 1 A 6 6 VAL HA H 6 5.026 5.465 -0.439 1
1 63 . 36 1 1 A 6 6 VAL C C 6 176.674 174.960 1.714 1
1 64 . 36 1 1 A 6 6 VAL CA C 6 61.008 61.037 -0.029 1
1 65 . 36 1 1 A 6 6 VAL CB C 6 33.861 34.309 -0.448 1
1 68 . 36 1 1 A 6 6 VAL N N 6 121.384 125.100 -3.716 1
1 69 . 36 1 1 A 7 7 ASP H H 7 8.848 8.803 0.045 1
1 70 . 36 1 1 A 7 7 ASP HA H 7 4.797 4.970 -0.173 1
1 73 . 36 1 1 A 7 7 ASP CA C 7 52.834 54.509 -1.675 1
1 74 . 36 1 1 A 7 7 ASP CB C 7 42.219 42.197 0.022 1
1 75 . 36 1 1 A 7 7 ASP N N 7 127.061 127.454 -0.393 1
1 76 . 36 1 1 A 8 8 GLY C C 8 175.143 174.644 0.499 1
1 77 . 36 1 1 A 8 8 GLY CA C 8 46.553 46.175 0.378 1
1 78 . 36 1 1 A 9 9 GLN H H 9 8.408 8.114 0.294 1
1 79 . 36 1 1 A 9 9 GLN HA H 9 4.541 4.421 0.120 1
1 86 . 36 1 1 A 9 9 GLN C C 9 176.463 176.564 -0.101 1
1 87 . 36 1 1 A 9 9 GLN CA C 9 55.167 54.790 0.377 1
1 88 . 36 1 1 A 9 9 GLN CB C 9 29.376 28.916 0.460 1
1 90 . 36 1 1 A 9 9 GLN N N 9 118.300 118.766 -0.466 1
1 92 . 36 1 1 A 10 10 GLY H H 10 8.162 8.478 -0.316 1
1 93 . 36 1 1 A 10 10 GLY HA2 H 10 4.174 3.963 0.211 1
1 94 . 36 1 1 A 10 10 GLY HA3 H 10 3.521 3.986 -0.465 1
1 95 . 36 1 1 A 10 10 GLY C C 10 174.092 174.342 -0.250 1
1 96 . 36 1 1 A 10 10 GLY CA C 10 45.558 46.429 -0.871 1
1 97 . 36 1 1 A 10 10 GLY N N 10 108.747 110.549 -1.802 1
1 98 . 36 1 1 A 11 11 GLN H H 11 8.507 7.968 0.539 1
1 99 . 36 1 1 A 11 11 GLN HA H 11 4.202 4.752 -0.550 1
1 106 . 36 1 1 A 11 11 GLN C C 11 173.992 174.649 -0.657 1
1 107 . 36 1 1 A 11 11 GLN CA C 11 55.098 54.964 0.134 1
1 108 . 36 1 1 A 11 11 GLN CB C 11 29.097 30.506 -1.409 1
1 110 . 36 1 1 A 11 11 GLN N N 11 122.979 117.099 5.880 1
1 112 . 36 1 1 A 12 12 ALA H H 12 8.259 8.721 -0.462 1
1 113 . 36 1 1 A 12 12 ALA HA H 12 5.156 5.544 -0.388 1
1 117 . 36 1 1 A 12 12 ALA C C 12 177.284 176.536 0.748 1
1 118 . 36 1 1 A 12 12 ALA CA C 12 51.087 50.826 0.261 1
1 119 . 36 1 1 A 12 12 ALA CB C 12 20.500 20.001 0.499 1
1 120 . 36 1 1 A 12 12 ALA N N 12 127.100 123.490 3.610 1
1 121 . 36 1 1 A 13 13 TRP H H 13 9.245 9.138 0.107 1
1 122 . 36 1 1 A 13 13 TRP HA H 13 4.717 5.744 -1.027 1
1 131 . 36 1 1 A 13 13 TRP C C 13 175.108 174.362 0.746 1
1 132 . 36 1 1 A 13 13 TRP CA C 13 55.966 55.349 0.617 1
1 133 . 36 1 1 A 13 13 TRP CB C 13 31.912 33.094 -1.182 1
1 139 . 36 1 1 A 13 13 TRP N N 13 123.088 120.757 2.331 1
1 141 . 36 1 1 A 14 14 ARG H H 14 8.575 8.860 -0.285 1
1 142 . 36 1 1 A 14 14 ARG HA H 14 5.335 4.431 0.904 1
1 150 . 36 1 1 A 14 14 ARG C C 14 175.191 174.374 0.817 1
1 151 . 36 1 1 A 14 14 ARG CA C 14 53.106 55.176 -2.070 1
1 152 . 36 1 1 A 14 14 ARG CB C 14 32.749 31.622 1.127 1
1 154 . 36 1 1 A 14 14 ARG N N 14 121.163 119.976 1.187 1
1 156 . 36 1 1 A 15 15 HIS H H 15 8.595 8.164 0.431 1
1 157 . 36 1 1 A 15 15 HIS HA H 15 4.790 5.271 -0.481 1
1 161 . 36 1 1 A 15 15 HIS C C 15 173.770 174.296 -0.526 1
1 162 . 36 1 1 A 15 15 HIS CA C 15 55.289 53.865 1.424 1
1 163 . 36 1 1 A 15 15 HIS CB C 15 33.208 33.178 0.030 1
1 165 . 36 1 1 A 15 15 HIS N N 15 117.643 119.598 -1.955 1
1 166 . 36 1 1 A 16 16 HIS H H 16 8.993 8.767 0.226 1
1 167 . 36 1 1 A 16 16 HIS HA H 16 5.158 5.225 -0.067 1
1 171 . 36 1 1 A 16 16 HIS C C 16 173.608 173.946 -0.338 1
1 172 . 36 1 1 A 16 16 HIS CA C 16 56.450 54.167 2.283 1
1 173 . 36 1 1 A 16 16 HIS CB C 16 34.171 31.195 2.976 1
1 175 . 36 1 1 A 16 16 HIS N N 16 123.520 119.367 4.153 1
1 176 . 36 1 1 A 17 17 ASN H H 17 7.829 9.247 -1.418 1
1 177 . 36 1 1 A 17 17 ASN HA H 17 4.713 4.811 -0.098 1
1 182 . 36 1 1 A 17 17 ASN C C 17 173.682 175.035 -1.353 1
1 183 . 36 1 1 A 17 17 ASN CA C 17 51.822 52.491 -0.669 1
1 184 . 36 1 1 A 17 17 ASN CB C 17 43.176 40.940 2.236 1
1 185 . 36 1 1 A 17 17 ASN N N 17 122.213 120.833 1.380 1
1 187 . 36 1 1 A 18 18 GLY H H 18 8.423 8.766 -0.343 1
1 188 . 36 1 1 A 18 18 GLY HA2 H 18 3.931 3.728 0.203 1
1 189 . 36 1 1 A 18 18 GLY HA3 H 18 3.707 3.838 -0.131 1
1 190 . 36 1 1 A 18 18 GLY C C 18 173.985 172.919 1.066 1
1 191 . 36 1 1 A 18 18 GLY CA C 18 43.949 47.135 -3.186 1
1 192 . 36 1 1 A 18 18 GLY N N 18 106.991 115.245 -8.254 1
1 193 . 36 1 1 A 19 19 PHE H H 19 8.338 8.536 -0.198 1
1 194 . 36 1 1 A 19 19 PHE HA H 19 4.068 5.325 -1.257 1
1 197 . 36 1 1 A 19 19 PHE C C 19 176.568 173.968 2.600 1
1 198 . 36 1 1 A 19 19 PHE CA C 19 59.338 56.548 2.790 1
1 199 . 36 1 1 A 19 19 PHE CB C 19 40.201 43.780 -3.579 1
1 200 . 36 1 1 A 19 19 PHE N N 19 116.857 120.770 -3.913 1
1 201 . 36 1 1 A 20 20 ASP H H 20 8.794 8.822 -0.028 1
1 202 . 36 1 1 A 20 20 ASP HA H 20 4.485 4.781 -0.296 1
1 205 . 36 1 1 A 20 20 ASP C C 20 177.379 177.207 0.172 1
1 206 . 36 1 1 A 20 20 ASP CA C 20 54.140 53.932 0.208 1
1 207 . 36 1 1 A 20 20 ASP CB C 20 41.915 41.863 0.052 1
1 208 . 36 1 1 A 20 20 ASP N N 20 123.025 121.970 1.055 1
1 209 . 36 1 1 A 21 21 PHE H H 21 8.862 9.118 -0.256 1
1 210 . 36 1 1 A 21 21 PHE HA H 21 4.087 4.109 -0.022 1
1 218 . 36 1 1 A 21 21 PHE C C 21 176.952 177.222 -0.270 1
1 219 . 36 1 1 A 21 21 PHE CA C 21 61.095 62.188 -1.093 1
1 220 . 36 1 1 A 21 21 PHE CB C 21 38.678 39.170 -0.492 1
1 226 . 36 1 1 A 21 21 PHE N N 21 127.163 127.538 -0.375 1
1 227 . 36 1 1 A 22 22 ALA H H 22 8.561 8.393 0.168 1
1 228 . 36 1 1 A 22 22 ALA HA H 22 3.878 3.977 -0.099 1
1 232 . 36 1 1 A 22 22 ALA C C 22 180.710 179.906 0.804 1
1 233 . 36 1 1 A 22 22 ALA CA C 22 55.211 55.115 0.096 1
1 234 . 36 1 1 A 22 22 ALA CB C 22 18.321 18.098 0.223 1
1 235 . 36 1 1 A 22 22 ALA N N 22 120.293 121.345 -1.052 1
1 236 . 36 1 1 A 23 23 VAL H H 23 7.241 8.211 -0.970 1
1 237 . 36 1 1 A 23 23 VAL HA H 23 3.684 3.730 -0.046 1
1 245 . 36 1 1 A 23 23 VAL C C 23 177.101 177.852 -0.751 1
1 246 . 36 1 1 A 23 23 VAL CA C 23 65.237 65.471 -0.234 1
1 247 . 36 1 1 A 23 23 VAL CB C 23 31.780 31.320 0.460 1
1 250 . 36 1 1 A 23 23 VAL N N 23 118.775 116.287 2.488 1
1 251 . 36 1 1 A 24 24 ILE H H 24 6.761 7.750 -0.989 1
1 252 . 36 1 1 A 24 24 ILE HA H 24 3.196 3.315 -0.119 1
1 262 . 36 1 1 A 24 24 ILE C C 24 177.287 177.855 -0.568 1
1 263 . 36 1 1 A 24 24 ILE CA C 24 63.404 65.499 -2.095 1
1 264 . 36 1 1 A 24 24 ILE CB C 24 36.294 37.353 -1.059 1
1 268 . 36 1 1 A 24 24 ILE N N 24 119.036 121.786 -2.750 1
1 269 . 36 1 1 A 25 25 LYS H H 25 8.032 8.096 -0.064 1
1 270 . 36 1 1 A 25 25 LYS HA H 25 3.809 3.612 0.197 1
1 279 . 36 1 1 A 25 25 LYS C C 25 179.450 178.930 0.520 1
1 280 . 36 1 1 A 25 25 LYS CA C 25 59.621 59.481 0.140 1
1 281 . 36 1 1 A 25 25 LYS CB C 25 32.259 32.267 -0.008 1
1 285 . 36 1 1 A 25 25 LYS N N 25 118.368 120.468 -2.100 1
1 286 . 36 1 1 A 26 26 GLU H H 26 7.845 8.290 -0.445 1
1 287 . 36 1 1 A 26 26 GLU HA H 26 4.021 4.110 -0.089 1
1 292 . 36 1 1 A 26 26 GLU C C 26 179.191 179.366 -0.175 1
1 293 . 36 1 1 A 26 26 GLU CA C 26 59.530 59.316 0.214 1
1 294 . 36 1 1 A 26 26 GLU CB C 26 29.449 29.132 0.317 1
1 296 . 36 1 1 A 26 26 GLU N N 26 120.522 118.998 1.524 1
1 297 . 36 1 1 A 27 27 LEU H H 27 8.165 8.154 0.011 1
1 298 . 36 1 1 A 27 27 LEU HA H 27 4.163 4.082 0.081 1
1 308 . 36 1 1 A 27 27 LEU C C 27 177.256 178.339 -1.083 1
1 309 . 36 1 1 A 27 27 LEU CA C 27 58.049 57.796 0.253 1
1 310 . 36 1 1 A 27 27 LEU CB C 27 41.365 41.873 -0.508 1
1 314 . 36 1 1 A 27 27 LEU N N 27 120.879 122.280 -1.401 1
1 315 . 36 1 1 A 28 28 LYS H H 28 8.902 8.507 0.395 1
1 316 . 36 1 1 A 28 28 LYS HA H 28 4.199 4.222 -0.023 1
1 317 . 36 1 1 A 28 28 LYS C C 28 179.707 179.115 0.592 1
1 318 . 36 1 1 A 28 28 LYS CA C 28 60.097 59.416 0.681 1
1 319 . 36 1 1 A 28 28 LYS CB C 28 33.420 32.087 1.333 1
1 320 . 36 1 1 A 28 28 LYS N N 28 120.050 119.468 0.582 1
1 321 . 36 1 1 A 29 29 THR H H 29 8.294 8.069 0.225 1
1 322 . 36 1 1 A 29 29 THR HA H 29 3.892 3.968 -0.076 1
1 327 . 36 1 1 A 29 29 THR C C 29 175.711 176.420 -0.709 1
1 328 . 36 1 1 A 29 29 THR CA C 29 66.846 66.436 0.410 1
1 329 . 36 1 1 A 29 29 THR CB C 29 68.794 68.795 -0.001 1
1 331 . 36 1 1 A 29 29 THR N N 29 115.933 116.642 -0.709 1
1 332 . 36 1 1 A 30 30 ALA H H 30 8.244 8.986 -0.742 1
1 333 . 36 1 1 A 30 30 ALA HA H 30 4.241 4.276 -0.035 1
1 337 . 36 1 1 A 30 30 ALA C C 30 179.128 179.046 0.082 1
1 338 . 36 1 1 A 30 30 ALA CA C 30 55.714 55.776 -0.062 1
1 339 . 36 1 1 A 30 30 ALA CB C 30 18.955 18.200 0.755 1
1 340 . 36 1 1 A 30 30 ALA N N 30 124.617 123.259 1.358 1
1 341 . 36 1 1 A 31 31 ALA H H 31 8.968 8.721 0.247 1
1 342 . 36 1 1 A 31 31 ALA HA H 31 3.890 4.012 -0.122 1
1 346 . 36 1 1 A 31 31 ALA C C 31 180.352 179.675 0.677 1
1 347 . 36 1 1 A 31 31 ALA CA C 31 55.454 55.502 -0.048 1
1 348 . 36 1 1 A 31 31 ALA CB C 31 17.124 18.307 -1.183 1
1 349 . 36 1 1 A 31 31 ALA N N 31 119.327 120.272 -0.945 1
1 350 . 36 1 1 A 32 32 SER H H 32 7.995 7.752 0.243 1
1 351 . 36 1 1 A 32 32 SER HA H 32 4.238 4.314 -0.076 1
1 354 . 36 1 1 A 32 32 SER C C 32 175.612 175.703 -0.091 1
1 355 . 36 1 1 A 32 32 SER CA C 32 61.203 61.127 0.076 1
1 356 . 36 1 1 A 32 32 SER CB C 32 63.406 63.216 0.190 1
1 357 . 36 1 1 A 32 32 SER N N 32 111.962 113.749 -1.787 1
1 358 . 36 1 1 A 33 33 GLN H H 33 8.333 7.852 0.481 1
1 359 . 36 1 1 A 33 33 GLN HA H 33 3.992 4.245 -0.253 1
1 366 . 36 1 1 A 33 33 GLN C C 33 177.486 177.171 0.315 1
1 367 . 36 1 1 A 33 33 GLN CA C 33 58.277 57.670 0.607 1
1 368 . 36 1 1 A 33 33 GLN CB C 33 29.140 30.118 -0.978 1
1 370 . 36 1 1 A 33 33 GLN N N 33 119.527 119.218 0.309 1
1 372 . 36 1 1 A 34 34 TYR H H 34 8.587 8.310 0.277 1
1 373 . 36 1 1 A 34 34 TYR HA H 34 4.792 4.645 0.147 1
1 380 . 36 1 1 A 34 34 TYR C C 34 176.499 176.624 -0.125 1
1 381 . 36 1 1 A 34 34 TYR CA C 34 57.711 58.725 -1.014 1
1 382 . 36 1 1 A 34 34 TYR CB C 34 39.561 39.364 0.197 1
1 387 . 36 1 1 A 34 34 TYR N N 34 114.610 114.605 0.005 1
1 388 . 36 1 1 A 35 35 GLY H H 35 7.346 8.493 -1.147 1
1 389 . 36 1 1 A 35 35 GLY HA2 H 35 4.785 4.125 0.660 1
1 390 . 36 1 1 A 35 35 GLY HA3 H 35 4.007 4.131 -0.124 1
1 391 . 36 1 1 A 35 35 GLY C C 35 175.796 173.259 2.537 1
1 392 . 36 1 1 A 35 35 GLY CA C 35 44.355 44.618 -0.263 1
1 393 . 36 1 1 A 35 35 GLY N N 35 108.501 106.837 1.664 1
1 394 . 36 1 1 A 36 36 ALA H H 36 9.363 7.786 1.577 1
1 395 . 36 1 1 A 36 36 ALA HA H 36 4.217 4.516 -0.299 1
1 399 . 36 1 1 A 36 36 ALA C C 36 178.039 178.331 -0.292 1
1 400 . 36 1 1 A 36 36 ALA CA C 36 56.114 51.906 4.208 1
1 401 . 36 1 1 A 36 36 ALA CB C 36 19.179 19.910 -0.731 1
1 402 . 36 1 1 A 36 36 ALA N N 36 125.811 123.583 2.228 1
1 403 . 36 1 1 A 37 37 THR H H 37 8.070 8.757 -0.687 1
1 404 . 36 1 1 A 37 37 THR HA H 37 4.570 4.030 0.540 1
1 409 . 36 1 1 A 37 37 THR C C 37 173.685 173.844 -0.159 1
1 410 . 36 1 1 A 37 37 THR CA C 37 59.822 65.406 -5.584 1
1 411 . 36 1 1 A 37 37 THR CB C 37 68.267 66.802 1.465 1
1 413 . 36 1 1 A 37 37 THR N N 37 129.410 109.813 19.597 1
1 414 . 36 1 1 A 38 38 ALA H H 38 6.853 7.821 -0.968 1
1 415 . 36 1 1 A 38 38 ALA HA H 38 4.601 4.597 0.004 1
1 419 . 36 1 1 A 38 38 ALA CA C 38 50.758 50.628 0.130 1
1 420 . 36 1 1 A 38 38 ALA CB C 38 18.325 19.783 -1.458 1
1 421 . 36 1 1 A 38 38 ALA N N 38 124.674 125.077 -0.403 1
1 422 . 36 1 1 A 40 40 TYR HA H 40 4.032 4.028 0.004 1
1 429 . 36 1 1 A 40 40 TYR C C 40 176.456 177.397 -0.941 1
1 430 . 36 1 1 A 40 40 TYR CA C 40 61.010 61.858 -0.848 1
1 431 . 36 1 1 A 40 40 TYR CB C 40 39.286 38.694 0.592 1
1 436 . 36 1 1 A 41 41 THR H H 41 6.874 7.950 -1.076 1
1 437 . 36 1 1 A 41 41 THR HA H 41 3.616 3.763 -0.147 1
1 442 . 36 1 1 A 41 41 THR C C 41 176.930 176.544 0.386 1
1 443 . 36 1 1 A 41 41 THR CA C 41 65.557 65.448 0.109 1
1 444 . 36 1 1 A 41 41 THR CB C 41 68.228 69.009 -0.781 1
1 446 . 36 1 1 A 41 41 THR N N 41 115.143 113.965 1.178 1
1 447 . 36 1 1 A 42 42 LEU H H 42 8.623 7.315 1.308 1
1 448 . 36 1 1 A 42 42 LEU HA H 42 3.708 4.055 -0.347 1
1 458 . 36 1 1 A 42 42 LEU C C 42 178.206 178.983 -0.777 1
1 459 . 36 1 1 A 42 42 LEU CA C 42 57.417 57.765 -0.348 1
1 460 . 36 1 1 A 42 42 LEU CB C 42 41.342 41.248 0.094 1
1 464 . 36 1 1 A 42 42 LEU N N 42 120.418 118.604 1.814 1
1 465 . 36 1 1 A 43 43 ALA H H 43 7.735 7.859 -0.124 1
1 466 . 36 1 1 A 43 43 ALA HA H 43 4.020 3.999 0.021 1
1 470 . 36 1 1 A 43 43 ALA C C 43 180.826 180.502 0.324 1
1 471 . 36 1 1 A 43 43 ALA CA C 43 54.925 54.980 -0.055 1
1 472 . 36 1 1 A 43 43 ALA CB C 43 17.506 18.232 -0.726 1
1 473 . 36 1 1 A 43 43 ALA N N 43 120.203 121.810 -1.607 1
1 474 . 36 1 1 A 44 44 ILE H H 44 7.149 7.380 -0.231 1
1 475 . 36 1 1 A 44 44 ILE HA H 44 3.603 3.604 -0.001 1
1 485 . 36 1 1 A 44 44 ILE C C 44 178.594 178.232 0.362 1
1 486 . 36 1 1 A 44 44 ILE CA C 44 64.782 64.439 0.343 1
1 487 . 36 1 1 A 44 44 ILE CB C 44 37.472 37.267 0.205 1
1 491 . 36 1 1 A 44 44 ILE N N 44 118.881 119.344 -0.463 1
1 492 . 36 1 1 A 45 45 VAL H H 45 7.968 7.884 0.084 1
1 493 . 36 1 1 A 45 45 VAL HA H 45 2.925 3.430 -0.505 1
1 501 . 36 1 1 A 45 45 VAL C C 45 177.023 177.506 -0.483 1
1 502 . 36 1 1 A 45 45 VAL CA C 45 67.081 66.465 0.616 1
1 503 . 36 1 1 A 45 45 VAL CB C 45 30.854 31.105 -0.251 1
1 506 . 36 1 1 A 45 45 VAL N N 45 120.764 119.884 0.880 1
1 507 . 36 1 1 A 46 46 GLU H H 46 8.399 8.313 0.086 1
1 508 . 36 1 1 A 46 46 GLU HA H 46 3.848 3.840 0.008 1
1 513 . 36 1 1 A 46 46 GLU C C 46 178.656 179.304 -0.648 1
1 514 . 36 1 1 A 46 46 GLU CA C 46 59.491 59.632 -0.141 1
1 515 . 36 1 1 A 46 46 GLU CB C 46 28.991 29.287 -0.296 1
1 517 . 36 1 1 A 46 46 GLU N N 46 116.599 119.569 -2.970 1
1 518 . 36 1 1 A 47 47 SER H H 47 7.273 7.758 -0.485 1
1 519 . 36 1 1 A 47 47 SER HA H 47 4.287 4.190 0.097 1
1 521 . 36 1 1 A 47 47 SER CA C 47 61.047 62.596 -1.549 1
1 522 . 36 1 1 A 47 47 SER CB C 47 63.016 63.002 0.014 1
1 523 . 36 1 1 A 47 47 SER N N 47 113.609 116.585 -2.976 1
1 524 . 36 1 1 A 48 48 VAL H H 48 8.006 7.917 0.089 1
1 525 . 36 1 1 A 48 48 VAL HA H 48 3.556 3.869 -0.313 1
1 533 . 36 1 1 A 48 48 VAL C C 48 177.257 177.394 -0.137 1
1 534 . 36 1 1 A 48 48 VAL CA C 48 65.025 64.665 0.360 1
1 535 . 36 1 1 A 48 48 VAL CB C 48 31.841 31.699 0.142 1
1 538 . 36 1 1 A 48 48 VAL N N 48 122.327 119.136 3.191 1
1 539 . 36 1 1 A 49 49 ALA H H 49 8.369 7.797 0.572 1
1 540 . 36 1 1 A 49 49 ALA HA H 49 4.115 4.234 -0.119 1
1 544 . 36 1 1 A 49 49 ALA C C 49 177.307 177.136 0.171 1
1 545 . 36 1 1 A 49 49 ALA CA C 49 53.253 52.961 0.292 1
1 546 . 36 1 1 A 49 49 ALA CB C 49 20.131 18.108 2.023 1
1 547 . 36 1 1 A 49 49 ALA N N 49 118.050 123.877 -5.827 1
1 548 . 36 1 1 A 50 50 ASP H H 50 7.052 7.577 -0.525 1
1 549 . 36 1 1 A 50 50 ASP HA H 50 4.788 4.807 -0.019 1
1 552 . 36 1 1 A 50 50 ASP C C 50 175.481 176.267 -0.786 1
1 553 . 36 1 1 A 50 50 ASP CA C 50 53.681 54.693 -1.012 1
1 554 . 36 1 1 A 50 50 ASP CB C 50 39.333 41.191 -1.858 1
1 555 . 36 1 1 A 50 50 ASP N N 50 116.997 117.169 -0.172 1
1 556 . 36 1 1 A 51 51 ASN H H 51 8.535 7.602 0.933 1
1 557 . 36 1 1 A 51 51 ASN HA H 51 4.628 4.967 -0.339 1
1 562 . 36 1 1 A 51 51 ASN C C 51 174.077 175.695 -1.618 1
1 563 . 36 1 1 A 51 51 ASN CA C 51 52.315 51.764 0.551 1
1 564 . 36 1 1 A 51 51 ASN CB C 51 41.928 40.478 1.450 1
1 565 . 36 1 1 A 51 51 ASN N N 51 118.626 117.810 0.816 1
1 567 . 36 1 1 A 52 52 TRP H H 52 8.555 8.291 0.264 1
1 574 . 36 1 1 A 52 52 TRP C C 52 173.269 175.963 -2.694 1
1 575 . 36 1 1 A 52 52 TRP CA C 52 55.031 56.825 -1.794 1
1 576 . 36 1 1 A 52 52 TRP CB C 52 26.801 28.833 -2.032 1
1 582 . 36 1 1 A 52 52 TRP N N 52 120.693 121.237 -0.544 1
1 584 . 36 1 1 A 53 53 LEU H H 53 7.847 7.570 0.277 1
1 585 . 36 1 1 A 53 53 LEU HA H 53 4.859 4.174 0.685 1
1 595 . 36 1 1 A 53 53 LEU C C 53 177.397 175.723 1.674 1
1 596 . 36 1 1 A 53 53 LEU CA C 53 53.619 55.907 -2.288 1
1 597 . 36 1 1 A 53 53 LEU CB C 53 41.812 42.404 -0.592 1
1 601 . 36 1 1 A 53 53 LEU N N 53 124.741 123.416 1.325 1
1 602 . 36 1 1 A 54 54 THR H H 54 8.850 8.741 0.109 1
1 603 . 36 1 1 A 54 54 THR HA H 54 4.598 4.450 0.148 1
1 608 . 36 1 1 A 54 54 THR CA C 54 60.531 60.179 0.352 1
1 609 . 36 1 1 A 54 54 THR CB C 54 67.183 68.956 -1.773 1
1 611 . 36 1 1 A 54 54 THR N N 54 113.407 116.518 -3.111 1
1 612 . 36 1 1 A 55 55 PRO HA H 55 4.511 4.354 0.157 1
1 619 . 36 1 1 A 55 55 PRO C C 55 179.383 179.087 0.296 1
1 620 . 36 1 1 A 55 55 PRO CA C 55 67.159 65.534 1.625 1
1 621 . 36 1 1 A 55 55 PRO CB C 55 32.095 31.544 0.551 1
1 622 . 36 1 1 A 56 56 THR H H 56 8.575 7.925 0.650 1
1 623 . 36 1 1 A 56 56 THR HA H 56 4.229 4.058 0.171 1
1 628 . 36 1 1 A 56 56 THR C C 56 176.668 175.803 0.865 1
1 629 . 36 1 1 A 56 56 THR CA C 56 66.943 65.808 1.135 1
1 630 . 36 1 1 A 56 56 THR CB C 56 68.129 68.099 0.030 1
1 632 . 36 1 1 A 56 56 THR N N 56 114.855 113.802 1.053 1
1 633 . 36 1 1 A 57 57 ASP H H 57 8.730 8.271 0.459 1
1 634 . 36 1 1 A 57 57 ASP HA H 57 4.425 4.407 0.018 1
1 637 . 36 1 1 A 57 57 ASP C C 57 178.351 179.244 -0.893 1
1 638 . 36 1 1 A 57 57 ASP CA C 57 57.963 57.593 0.370 1
1 639 . 36 1 1 A 57 57 ASP CB C 57 40.134 40.678 -0.544 1
1 640 . 36 1 1 A 57 57 ASP N N 57 126.239 120.195 6.044 1
1 641 . 36 1 1 A 58 58 TRP H H 58 8.244 8.761 -0.517 1
1 642 . 36 1 1 A 58 58 TRP HA H 58 4.030 4.501 -0.471 1
1 650 . 36 1 1 A 58 58 TRP C C 58 177.432 178.792 -1.360 1
1 651 . 36 1 1 A 58 58 TRP CA C 58 62.731 60.014 2.717 1
1 652 . 36 1 1 A 58 58 TRP CB C 58 29.122 29.428 -0.306 1
1 657 . 36 1 1 A 58 58 TRP N N 58 119.241 120.370 -1.129 1
1 659 . 36 1 1 A 59 59 ASN H H 59 8.098 8.719 -0.621 1
1 660 . 36 1 1 A 59 59 ASN HA H 59 4.424 4.526 -0.102 1
1 663 . 36 1 1 A 59 59 ASN C C 59 176.952 178.535 -1.583 1
1 664 . 36 1 1 A 59 59 ASN CA C 59 58.135 56.546 1.589 1
1 665 . 36 1 1 A 59 59 ASN CB C 59 40.168 39.361 0.807 1
1 666 . 36 1 1 A 59 59 ASN N N 59 115.747 117.638 -1.891 1
1 667 . 36 1 1 A 60 60 THR H H 60 8.712 8.103 0.609 1
1 668 . 36 1 1 A 60 60 THR HA H 60 3.717 4.116 -0.399 1
1 673 . 36 1 1 A 60 60 THR C C 60 176.044 176.846 -0.802 1
1 674 . 36 1 1 A 60 60 THR CA C 60 66.576 66.945 -0.369 1
1 675 . 36 1 1 A 60 60 THR CB C 60 69.251 68.033 1.218 1
1 677 . 36 1 1 A 60 60 THR N N 60 114.896 115.877 -0.981 1
1 678 . 36 1 1 A 61 61 LEU H H 61 8.485 8.401 0.084 1
1 679 . 36 1 1 A 61 61 LEU HA H 61 3.391 3.834 -0.443 1
1 689 . 36 1 1 A 61 61 LEU C C 61 177.433 178.410 -0.977 1
1 690 . 36 1 1 A 61 61 LEU CA C 61 58.354 58.313 0.041 1
1 691 . 36 1 1 A 61 61 LEU CB C 61 41.761 42.228 -0.467 1
1 695 . 36 1 1 A 61 61 LEU N N 61 123.433 122.479 0.954 1
1 696 . 36 1 1 A 62 62 VAL H H 62 8.073 8.265 -0.192 1
1 697 . 36 1 1 A 62 62 VAL HA H 62 3.207 3.745 -0.538 1
1 705 . 36 1 1 A 62 62 VAL C C 62 177.585 177.910 -0.325 1
1 706 . 36 1 1 A 62 62 VAL CA C 62 67.345 65.123 2.222 1
1 707 . 36 1 1 A 62 62 VAL CB C 62 30.905 30.732 0.173 1
1 710 . 36 1 1 A 62 62 VAL N N 62 116.018 118.408 -2.390 1
1 711 . 36 1 1 A 63 63 ARG H H 63 7.765 7.854 -0.089 1
1 712 . 36 1 1 A 63 63 ARG HA H 63 3.602 3.870 -0.268 1
1 719 . 36 1 1 A 63 63 ARG C C 63 177.818 177.579 0.239 1
1 720 . 36 1 1 A 63 63 ARG CA C 63 58.049 59.654 -1.605 1
1 721 . 36 1 1 A 63 63 ARG CB C 63 29.955 30.003 -0.048 1
1 724 . 36 1 1 A 63 63 ARG N N 63 116.700 122.061 -5.361 1
1 725 . 36 1 1 A 64 64 ALA H H 64 7.574 7.881 -0.307 1
1 726 . 36 1 1 A 64 64 ALA HA H 64 4.158 4.372 -0.214 1
1 730 . 36 1 1 A 64 64 ALA C C 64 179.886 177.217 2.669 1
1 731 . 36 1 1 A 64 64 ALA CA C 64 54.007 51.926 2.081 1
1 732 . 36 1 1 A 64 64 ALA CB C 64 19.147 19.387 -0.240 1
1 733 . 36 1 1 A 64 64 ALA N N 64 117.555 120.193 -2.638 1
1 734 . 36 1 1 A 65 65 VAL H H 65 7.554 7.375 0.179 1
1 735 . 36 1 1 A 65 65 VAL HA H 65 4.253 4.030 0.223 1
1 743 . 36 1 1 A 65 65 VAL C C 65 174.180 175.495 -1.315 1
1 744 . 36 1 1 A 65 65 VAL CA C 65 62.683 63.595 -0.912 1
1 745 . 36 1 1 A 65 65 VAL CB C 65 33.458 33.047 0.411 1
1 748 . 36 1 1 A 65 65 VAL N N 65 110.013 116.857 -6.844 1
1 749 . 36 1 1 A 66 66 LEU H H 66 7.792 7.921 -0.129 1
1 750 . 36 1 1 A 66 66 LEU HA H 66 4.790 4.699 0.091 1
1 760 . 36 1 1 A 66 66 LEU C C 66 177.537 174.302 3.235 1
1 761 . 36 1 1 A 66 66 LEU CA C 66 52.823 53.493 -0.670 1
1 762 . 36 1 1 A 66 66 LEU CB C 66 44.071 45.749 -1.678 1
1 766 . 36 1 1 A 66 66 LEU N N 66 118.967 120.769 -1.802 1
1 767 . 36 1 1 A 67 67 SER H H 67 9.208 8.479 0.729 1
1 768 . 36 1 1 A 67 67 SER HA H 67 4.414 4.948 -0.534 1
1 771 . 36 1 1 A 67 67 SER CA C 67 57.943 57.108 0.835 1
1 772 . 36 1 1 A 67 67 SER CB C 67 64.743 66.910 -2.167 1
1 773 . 36 1 1 A 67 67 SER N N 67 116.378 116.442 -0.064 1
1 774 . 36 1 1 A 69 69 GLY HA2 H 69 3.916 3.741 0.175 1
1 775 . 36 1 1 A 69 69 GLY HA3 H 69 3.867 3.771 0.096 1
1 776 . 36 1 1 A 69 69 GLY C C 69 176.783 175.563 1.220 1
1 777 . 36 1 1 A 69 69 GLY CA C 69 46.977 46.756 0.221 1
1 778 . 36 1 1 A 70 70 ASP H H 70 7.674 8.164 -0.490 1
1 779 . 36 1 1 A 70 70 ASP HA H 70 4.511 3.888 0.623 1
1 782 . 36 1 1 A 70 70 ASP C C 70 178.096 178.299 -0.203 1
1 783 . 36 1 1 A 70 70 ASP CA C 70 57.262 56.523 0.739 1
1 784 . 36 1 1 A 70 70 ASP CB C 70 40.594 39.812 0.782 1
1 785 . 36 1 1 A 70 70 ASP N N 70 123.930 122.065 1.865 1
1 786 . 36 1 1 A 71 71 HIS H H 71 8.729 7.778 0.951 1
1 787 . 36 1 1 A 71 71 HIS HA H 71 4.235 4.231 0.004 1
1 790 . 36 1 1 A 71 71 HIS C C 71 176.769 176.800 -0.031 1
1 791 . 36 1 1 A 71 71 HIS CA C 71 60.041 59.898 0.143 1
1 792 . 36 1 1 A 71 71 HIS CB C 71 30.682 30.369 0.313 1
1 793 . 36 1 1 A 71 71 HIS N N 71 121.003 119.471 1.532 1
1 794 . 36 1 1 A 72 72 LEU H H 72 7.620 7.666 -0.046 1
1 795 . 36 1 1 A 72 72 LEU HA H 72 3.769 3.846 -0.077 1
1 805 . 36 1 1 A 72 72 LEU C C 72 180.275 179.232 1.043 1
1 806 . 36 1 1 A 72 72 LEU CA C 72 58.192 57.974 0.218 1
1 807 . 36 1 1 A 72 72 LEU CB C 72 41.381 41.266 0.115 1
1 811 . 36 1 1 A 72 72 LEU N N 72 118.569 118.301 0.268 1
1 812 . 36 1 1 A 73 73 LEU H H 73 7.542 7.476 0.066 1
1 813 . 36 1 1 A 73 73 LEU HA H 73 4.107 4.152 -0.045 1
1 823 . 36 1 1 A 73 73 LEU C C 73 179.436 179.196 0.240 1
1 824 . 36 1 1 A 73 73 LEU CA C 73 58.026 57.299 0.727 1
1 825 . 36 1 1 A 73 73 LEU CB C 73 41.638 42.072 -0.434 1
1 829 . 36 1 1 A 73 73 LEU N N 73 121.418 120.391 1.027 1
1 830 . 36 1 1 A 74 74 TRP H H 74 8.786 7.923 0.863 1
1 831 . 36 1 1 A 74 74 TRP HA H 74 3.589 5.337 -1.748 1
1 840 . 36 1 1 A 74 74 TRP C C 74 176.816 178.708 -1.892 1
1 841 . 36 1 1 A 74 74 TRP CA C 74 63.046 59.849 3.197 1
1 842 . 36 1 1 A 74 74 TRP CB C 74 28.065 28.947 -0.882 1
1 848 . 36 1 1 A 74 74 TRP N N 74 121.111 118.204 2.907 1
1 850 . 36 1 1 A 75 75 LYS H H 75 8.939 7.550 1.389 1
1 851 . 36 1 1 A 75 75 LYS HA H 75 3.055 4.088 -1.033 1
1 860 . 36 1 1 A 75 75 LYS C C 75 177.967 179.092 -1.125 1
1 861 . 36 1 1 A 75 75 LYS CA C 75 60.029 58.611 1.418 1
1 862 . 36 1 1 A 75 75 LYS CB C 75 32.533 32.845 -0.312 1
1 866 . 36 1 1 A 75 75 LYS N N 75 119.783 118.627 1.156 1
1 867 . 36 1 1 A 76 76 SER H H 76 7.832 7.939 -0.107 1
1 868 . 36 1 1 A 76 76 SER HA H 76 4.040 4.286 -0.246 1
1 871 . 36 1 1 A 76 76 SER C C 76 177.816 177.017 0.799 1
1 872 . 36 1 1 A 76 76 SER CA C 76 62.105 61.451 0.654 1
1 873 . 36 1 1 A 76 76 SER CB C 76 62.679 62.942 -0.263 1
1 874 . 36 1 1 A 76 76 SER N N 76 113.395 114.709 -1.314 1
1 875 . 36 1 1 A 77 77 GLU H H 77 7.590 7.713 -0.123 1
1 876 . 36 1 1 A 77 77 GLU HA H 77 4.042 4.271 -0.229 1
1 881 . 36 1 1 A 77 77 GLU C C 77 177.809 178.677 -0.868 1
1 882 . 36 1 1 A 77 77 GLU CA C 77 58.270 58.482 -0.212 1
1 883 . 36 1 1 A 77 77 GLU CB C 77 29.208 29.320 -0.112 1
1 885 . 36 1 1 A 77 77 GLU N N 77 121.574 122.095 -0.521 1
1 886 . 36 1 1 A 78 78 PHE H H 78 9.081 7.848 1.233 1
1 887 . 36 1 1 A 78 78 PHE HA H 78 3.778 4.156 -0.378 1
1 895 . 36 1 1 A 78 78 PHE C C 78 178.114 177.298 0.816 1
1 896 . 36 1 1 A 78 78 PHE CA C 78 60.629 61.314 -0.685 1
1 897 . 36 1 1 A 78 78 PHE CB C 78 38.295 38.745 -0.450 1
1 902 . 36 1 1 A 78 78 PHE N N 78 122.682 122.338 0.344 1
1 903 . 36 1 1 A 79 79 PHE H H 79 8.890 7.986 0.904 1
1 904 . 36 1 1 A 79 79 PHE HA H 79 3.800 3.970 -0.170 1
1 912 . 36 1 1 A 79 79 PHE C C 79 178.354 178.062 0.292 1
1 913 . 36 1 1 A 79 79 PHE CA C 79 60.704 61.972 -1.268 1
1 914 . 36 1 1 A 79 79 PHE CB C 79 37.184 38.742 -1.558 1
1 920 . 36 1 1 A 79 79 PHE N N 79 121.056 117.782 3.274 1
1 921 . 36 1 1 A 80 80 GLU H H 80 7.793 8.122 -0.329 1
1 922 . 36 1 1 A 80 80 GLU HA H 80 4.082 4.041 0.041 1
1 927 . 36 1 1 A 80 80 GLU C C 80 179.068 179.411 -0.343 1
1 928 . 36 1 1 A 80 80 GLU CA C 80 59.735 59.311 0.424 1
1 929 . 36 1 1 A 80 80 GLU CB C 80 28.722 29.395 -0.673 1
1 931 . 36 1 1 A 80 80 GLU N N 80 120.312 119.527 0.785 1
1 932 . 36 1 1 A 81 81 ASN H H 81 8.624 8.666 -0.042 1
1 933 . 36 1 1 A 81 81 ASN HA H 81 4.521 4.457 0.064 1
1 938 . 36 1 1 A 81 81 ASN C C 81 179.262 178.351 0.911 1
1 939 . 36 1 1 A 81 81 ASN CA C 81 55.504 56.425 -0.921 1
1 940 . 36 1 1 A 81 81 ASN CB C 81 37.517 37.635 -0.118 1
1 941 . 36 1 1 A 81 81 ASN N N 81 119.338 118.286 1.052 1
1 943 . 36 1 1 A 82 82 CYS H H 82 8.554 7.816 0.738 1
1 944 . 36 1 1 A 82 82 CYS HA H 82 3.792 3.984 -0.192 1
1 947 . 36 1 1 A 82 82 CYS C C 82 176.478 177.126 -0.648 1
1 948 . 36 1 1 A 82 82 CYS CA C 82 65.232 62.945 2.287 1
1 949 . 36 1 1 A 82 82 CYS CB C 82 26.762 27.455 -0.693 1
1 950 . 36 1 1 A 82 82 CYS N N 82 120.576 117.934 2.642 1
1 951 . 36 1 1 A 83 83 ARG H H 83 8.522 7.883 0.639 1
1 952 . 36 1 1 A 83 83 ARG HA H 83 3.932 4.142 -0.210 1
1 960 . 36 1 1 A 83 83 ARG C C 83 179.138 178.768 0.370 1
1 961 . 36 1 1 A 83 83 ARG CA C 83 60.443 58.873 1.570 1
1 962 . 36 1 1 A 83 83 ARG CB C 83 29.550 30.044 -0.494 1
1 965 . 36 1 1 A 83 83 ARG N N 83 123.035 119.809 3.226 1
1 967 . 36 1 1 A 84 84 ASP H H 84 7.791 8.432 -0.641 1
1 968 . 36 1 1 A 84 84 ASP HA H 84 4.353 4.423 -0.070 1
1 971 . 36 1 1 A 84 84 ASP C C 84 178.649 178.296 0.353 1
1 972 . 36 1 1 A 84 84 ASP CA C 84 57.767 57.587 0.180 1
1 973 . 36 1 1 A 84 84 ASP CB C 84 41.305 41.662 -0.357 1
1 974 . 36 1 1 A 84 84 ASP N N 84 120.332 119.569 0.763 1
1 975 . 36 1 1 A 85 85 THR H H 85 8.370 7.693 0.677 1
1 976 . 36 1 1 A 85 85 THR HA H 85 3.730 3.959 -0.229 1
1 981 . 36 1 1 A 85 85 THR C C 85 175.198 177.044 -1.846 1
1 982 . 36 1 1 A 85 85 THR CA C 85 66.830 65.260 1.570 1
1 983 . 36 1 1 A 85 85 THR CB C 85 68.533 68.738 -0.205 1
1 985 . 36 1 1 A 85 85 THR N N 85 117.360 113.401 3.959 1
1 986 . 36 1 1 A 86 86 ALA H H 86 8.845 8.183 0.662 1
1 987 . 36 1 1 A 86 86 ALA HA H 86 3.991 4.542 -0.551 1
1 991 . 36 1 1 A 86 86 ALA C C 86 179.980 179.490 0.490 1
1 992 . 36 1 1 A 86 86 ALA CA C 86 55.769 55.700 0.069 1
1 993 . 36 1 1 A 86 86 ALA CB C 86 17.881 18.877 -0.996 1
1 994 . 36 1 1 A 86 86 ALA N N 86 123.613 123.274 0.339 1
1 995 . 36 1 1 A 87 87 LYS H H 87 7.686 8.254 -0.568 1
1 996 . 36 1 1 A 87 87 LYS HA H 87 4.099 3.977 0.122 1
1 1005 . 36 1 1 A 87 87 LYS C C 87 179.592 178.522 1.070 1
1 1006 . 36 1 1 A 87 87 LYS CA C 87 59.708 59.317 0.391 1
1 1007 . 36 1 1 A 87 87 LYS CB C 87 32.054 31.893 0.161 1
1 1011 . 36 1 1 A 87 87 LYS N N 87 119.623 116.332 3.291 1
1 1012 . 36 1 1 A 88 88 ARG H H 88 7.683 7.513 0.170 1
1 1013 . 36 1 1 A 88 88 ARG HA H 88 4.051 4.153 -0.102 1
1 1020 . 36 1 1 A 88 88 ARG C C 88 180.053 178.645 1.408 1
1 1021 . 36 1 1 A 88 88 ARG CA C 88 59.558 58.792 0.766 1
1 1022 . 36 1 1 A 88 88 ARG CB C 88 29.684 29.632 0.052 1
1 1025 . 36 1 1 A 88 88 ARG N N 88 120.788 119.379 1.409 1
1 1026 . 36 1 1 A 89 89 ASN H H 89 8.973 8.111 0.862 1
1 1027 . 36 1 1 A 89 89 ASN HA H 89 4.354 4.670 -0.316 1
1 1032 . 36 1 1 A 89 89 ASN C C 89 178.382 177.702 0.680 1
1 1033 . 36 1 1 A 89 89 ASN CA C 89 55.334 55.738 -0.404 1
1 1034 . 36 1 1 A 89 89 ASN CB C 89 37.864 38.553 -0.689 1
1 1035 . 36 1 1 A 89 89 ASN N N 89 121.012 117.142 3.870 1
1 1037 . 36 1 1 A 90 90 GLN H H 90 8.152 7.980 0.172 1
1 1038 . 36 1 1 A 90 90 GLN HA H 90 4.020 4.133 -0.113 1
1 1045 . 36 1 1 A 90 90 GLN C C 90 179.075 178.687 0.388 1
1 1046 . 36 1 1 A 90 90 GLN CA C 90 59.318 58.331 0.987 1
1 1047 . 36 1 1 A 90 90 GLN CB C 90 28.049 28.418 -0.369 1
1 1049 . 36 1 1 A 90 90 GLN N N 90 122.122 120.368 1.754 1
1 1051 . 36 1 1 A 91 91 GLN H H 91 7.514 8.685 -1.171 1
1 1052 . 36 1 1 A 91 91 GLN HA H 91 4.053 4.101 -0.048 1
1 1059 . 36 1 1 A 91 91 GLN C C 91 177.081 177.369 -0.288 1
1 1060 . 36 1 1 A 91 91 GLN CA C 91 58.031 58.127 -0.096 1
1 1061 . 36 1 1 A 91 91 GLN CB C 91 28.365 27.291 1.074 1
1 1063 . 36 1 1 A 91 91 GLN N N 91 118.124 118.098 0.026 1
1 1065 . 36 1 1 A 92 92 ALA H H 92 7.704 7.625 0.079 1
1 1066 . 36 1 1 A 92 92 ALA HA H 92 4.246 4.351 -0.105 1
1 1070 . 36 1 1 A 92 92 ALA C C 92 178.450 177.913 0.537 1
1 1071 . 36 1 1 A 92 92 ALA CA C 92 52.671 52.199 0.472 1
1 1072 . 36 1 1 A 92 92 ALA CB C 92 19.316 19.775 -0.459 1
1 1073 . 36 1 1 A 92 92 ALA N N 92 119.880 121.021 -1.141 1
1 1074 . 36 1 1 A 93 93 GLY H H 93 7.693 7.919 -0.226 1
1 1075 . 36 1 1 A 93 93 GLY HA2 H 93 3.941 3.959 -0.018 1
1 1076 . 36 1 1 A 93 93 GLY HA3 H 93 3.744 3.964 -0.220 1
1 1077 . 36 1 1 A 93 93 GLY C C 93 174.344 175.185 -0.841 1
1 1078 . 36 1 1 A 93 93 GLY CA C 93 45.949 46.448 -0.499 1
1 1079 . 36 1 1 A 93 93 GLY N N 93 105.347 106.599 -1.252 1
1 1080 . 36 1 1 A 94 94 ASN H H 94 7.076 8.586 -1.510 1
1 1081 . 36 1 1 A 94 94 ASN HA H 94 4.115 4.742 -0.627 1
1 1085 . 36 1 1 A 94 94 ASN C C 94 175.410 176.418 -1.008 1
1 1086 . 36 1 1 A 94 94 ASN CA C 94 52.651 53.172 -0.521 1
1 1087 . 36 1 1 A 94 94 ASN CB C 94 38.330 39.644 -1.314 1
1 1088 . 36 1 1 A 94 94 ASN N N 94 115.747 116.384 -0.637 1
1 1090 . 36 1 1 A 95 95 GLY H H 95 8.236 8.768 -0.532 1
1 1091 . 36 1 1 A 95 95 GLY HA2 H 95 3.633 4.000 -0.367 1
1 1092 . 36 1 1 A 95 95 GLY HA3 H 95 3.633 4.030 -0.397 1
1 1093 . 36 1 1 A 95 95 GLY C C 95 174.450 173.732 0.718 1
1 1094 . 36 1 1 A 95 95 GLY CA C 95 45.522 46.851 -1.329 1
1 1095 . 36 1 1 A 95 95 GLY N N 95 109.166 107.672 1.494 1
1 1096 . 36 1 1 A 96 96 TRP H H 96 7.899 7.437 0.462 1
1 1097 . 36 1 1 A 96 96 TRP HA H 96 5.241 4.780 0.461 1
1 1106 . 36 1 1 A 96 96 TRP C C 96 175.661 175.308 0.353 1
1 1107 . 36 1 1 A 96 96 TRP CA C 96 55.090 56.649 -1.559 1
1 1108 . 36 1 1 A 96 96 TRP CB C 96 27.138 31.855 -4.717 1
1 1114 . 36 1 1 A 96 96 TRP N N 96 122.840 120.154 2.686 1
1 1116 . 36 1 1 A 97 97 ASP H H 97 7.344 8.231 -0.887 1
1 1117 . 36 1 1 A 97 97 ASP HA H 97 4.829 4.275 0.554 1
1 1120 . 36 1 1 A 97 97 ASP C C 97 175.019 177.495 -2.476 1
1 1121 . 36 1 1 A 97 97 ASP CA C 97 52.149 56.719 -4.570 1
1 1122 . 36 1 1 A 97 97 ASP CB C 97 42.697 40.249 2.448 1
1 1123 . 36 1 1 A 97 97 ASP N N 97 126.861 122.322 4.539 1
1 1124 . 36 1 1 A 98 98 PHE H H 98 8.566 8.426 0.140 1
1 1125 . 36 1 1 A 98 98 PHE HA H 98 3.727 3.983 -0.256 1
1 1133 . 36 1 1 A 98 98 PHE C C 98 177.443 177.426 0.017 1
1 1134 . 36 1 1 A 98 98 PHE CA C 98 62.471 61.737 0.734 1
1 1135 . 36 1 1 A 98 98 PHE CB C 98 39.919 39.283 0.636 1
1 1141 . 36 1 1 A 98 98 PHE N N 98 117.781 120.653 -2.872 1
1 1142 . 36 1 1 A 99 99 ASP H H 99 8.259 8.261 -0.002 1
1 1143 . 36 1 1 A 99 99 ASP HA H 99 3.960 4.235 -0.275 1
1 1146 . 36 1 1 A 99 99 ASP C C 99 178.132 178.792 -0.660 1
1 1147 . 36 1 1 A 99 99 ASP CA C 99 57.658 56.461 1.197 1
1 1148 . 36 1 1 A 99 99 ASP CB C 99 38.572 40.675 -2.103 1
1 1149 . 36 1 1 A 99 99 ASP N N 99 121.709 118.859 2.850 1
1 1150 . 36 1 1 A 100 100 MET H H 100 8.008 7.932 0.076 1
1 1151 . 36 1 1 A 100 100 MET HA H 100 3.644 4.188 -0.544 1
1 1156 . 36 1 1 A 100 100 MET C C 100 180.008 176.518 3.490 1
1 1157 . 36 1 1 A 100 100 MET CA C 100 58.598 58.317 0.281 1
1 1158 . 36 1 1 A 100 100 MET CB C 100 33.423 32.728 0.695 1
1 1160 . 36 1 1 A 100 100 MET N N 100 119.668 117.705 1.963 1
1 1161 . 36 1 1 A 101 101 LEU H H 101 7.961 8.374 -0.413 1
1 1162 . 36 1 1 A 101 101 LEU HA H 101 3.523 4.392 -0.869 1
1 1172 . 36 1 1 A 101 101 LEU C C 101 173.873 176.281 -2.408 1
1 1173 . 36 1 1 A 101 101 LEU CA C 101 58.743 54.447 4.296 1
1 1174 . 36 1 1 A 101 101 LEU CB C 101 42.632 43.074 -0.442 1
1 1178 . 36 1 1 A 101 101 LEU N N 101 119.752 119.576 0.176 1
1 1179 . 36 1 1 A 102 102 THR H H 102 6.955 8.677 -1.722 1
1 1180 . 36 1 1 A 102 102 THR HA H 102 4.134 4.359 -0.225 1
1 1185 . 36 1 1 A 102 102 THR C C 102 176.513 174.165 2.348 1
1 1186 . 36 1 1 A 102 102 THR CA C 102 61.125 62.778 -1.653 1
1 1187 . 36 1 1 A 102 102 THR CB C 102 71.415 68.638 2.777 1
1 1189 . 36 1 1 A 102 102 THR N N 102 124.665 122.010 2.655 1
1 1190 . 36 1 1 A 103 103 GLY H H 103 7.816 8.638 -0.822 1
1 1191 . 36 1 1 A 103 103 GLY HA2 H 103 3.824 4.061 -0.237 1
1 1192 . 36 1 1 A 103 103 GLY HA3 H 103 3.824 4.078 -0.254 1
1 1193 . 36 1 1 A 103 103 GLY C C 103 174.126 175.280 -1.154 1
1 1194 . 36 1 1 A 103 103 GLY CA C 103 47.805 46.029 1.776 1
1 1195 . 36 1 1 A 103 103 GLY N N 103 114.191 112.470 1.721 1
1 1196 . 36 1 1 A 104 104 SER H H 104 8.860 8.732 0.128 1
1 1197 . 36 1 1 A 104 104 SER HA H 104 4.758 4.450 0.308 1
1 1200 . 36 1 1 A 104 104 SER C C 104 174.591 175.344 -0.753 1
1 1201 . 36 1 1 A 104 104 SER CA C 104 56.755 59.422 -2.667 1
1 1202 . 36 1 1 A 104 104 SER CB C 104 65.050 63.223 1.827 1
1 1203 . 36 1 1 A 104 104 SER N N 104 114.771 120.063 -5.292 1
1 1204 . 36 1 1 A 105 105 GLY H H 105 8.788 7.940 0.848 1
1 1205 . 36 1 1 A 105 105 GLY HA2 H 105 3.733 3.911 -0.178 1
1 1206 . 36 1 1 A 105 105 GLY HA3 H 105 3.733 3.942 -0.209 1
1 1207 . 36 1 1 A 105 105 GLY CA C 105 47.247 45.394 1.853 1
1 1208 . 36 1 1 A 105 105 GLY N N 105 110.394 109.605 0.789 1
1 1209 . 36 1 1 A 106 106 ASN HA H 106 4.454 4.911 -0.457 1
1 1212 . 36 1 1 A 106 106 ASN C C 106 175.180 175.960 -0.780 1
1 1213 . 36 1 1 A 106 106 ASN CA C 106 54.492 54.089 0.403 1
1 1214 . 36 1 1 A 106 106 ASN CB C 106 37.282 41.575 -4.293 1
1 1215 . 36 1 1 A 107 107 TYR H H 107 8.241 7.838 0.403 1
1 1216 . 36 1 1 A 107 107 TYR HA H 107 4.335 4.825 -0.490 1
1 1223 . 36 1 1 A 107 107 TYR C C 107 173.954 176.215 -2.261 1
1 1224 . 36 1 1 A 107 107 TYR CA C 107 57.727 56.535 1.192 1
1 1225 . 36 1 1 A 107 107 TYR CB C 107 37.063 38.369 -1.306 1
1 1230 . 36 1 1 A 107 107 TYR N N 107 120.708 113.381 7.327 1
1 1231 . 36 1 1 A 108 108 SER H H 108 7.117 8.001 -0.884 1
1 1232 . 36 1 1 A 108 108 SER HA H 108 4.221 4.280 -0.059 1
1 1235 . 36 1 1 A 108 108 SER C C 108 174.834 174.149 0.685 1
1 1236 . 36 1 1 A 108 108 SER CA C 108 59.859 61.183 -1.324 1
1 1237 . 36 1 1 A 108 108 SER CB C 108 63.846 63.534 0.312 1
1 1238 . 36 1 1 A 108 108 SER N N 108 113.362 115.885 -2.523 1
1 1239 . 36 1 1 A 109 109 SER H H 109 8.053 8.112 -0.059 1
1 1240 . 36 1 1 A 109 109 SER HA H 109 4.560 4.413 0.147 1
1 1243 . 36 1 1 A 109 109 SER CA C 109 57.141 59.234 -2.093 1
1 1244 . 36 1 1 A 109 109 SER CB C 109 64.874 63.030 1.844 1
1 1245 . 36 1 1 A 109 109 SER N N 109 116.657 114.805 1.852 1
1 1246 . 36 1 1 A 110 110 THR HA H 110 3.541 3.911 -0.370 1
1 1251 . 36 1 1 A 110 110 THR C C 110 175.477 176.185 -0.708 1
1 1252 . 36 1 1 A 110 110 THR CA C 110 66.443 65.725 0.718 1
1 1253 . 36 1 1 A 110 110 THR CB C 110 68.091 68.314 -0.223 1
1 1255 . 36 1 1 A 111 111 ASP H H 111 8.224 8.039 0.185 1
1 1256 . 36 1 1 A 111 111 ASP HA H 111 4.237 4.301 -0.064 1
1 1259 . 36 1 1 A 111 111 ASP C C 111 177.520 177.817 -0.297 1
1 1260 . 36 1 1 A 111 111 ASP CA C 111 57.559 57.309 0.250 1
1 1261 . 36 1 1 A 111 111 ASP CB C 111 40.292 40.949 -0.657 1
1 1262 . 36 1 1 A 111 111 ASP N N 111 119.490 121.853 -2.363 1
1 1263 . 36 1 1 A 112 112 ALA H H 112 7.431 7.980 -0.549 1
1 1264 . 36 1 1 A 112 112 ALA HA H 112 4.191 4.095 0.096 1
1 1268 . 36 1 1 A 112 112 ALA C C 112 180.646 179.933 0.713 1
1 1269 . 36 1 1 A 112 112 ALA CA C 112 54.534 54.839 -0.305 1
1 1270 . 36 1 1 A 112 112 ALA CB C 112 18.992 18.332 0.660 1
1 1271 . 36 1 1 A 112 112 ALA N N 112 119.710 121.410 -1.700 1
1 1272 . 36 1 1 A 113 113 GLN H H 113 7.576 8.048 -0.472 1
1 1273 . 36 1 1 A 113 113 GLN HA H 113 3.562 4.154 -0.592 1
1 1278 . 36 1 1 A 113 113 GLN C C 113 176.756 178.435 -1.679 1
1 1279 . 36 1 1 A 113 113 GLN CA C 113 57.736 57.951 -0.215 1
1 1280 . 36 1 1 A 113 113 GLN CB C 113 29.110 28.572 0.538 1
1 1281 . 36 1 1 A 113 113 GLN N N 113 117.518 115.645 1.873 1
1 1283 . 36 1 1 A 114 114 MET H H 114 8.192 7.698 0.494 1
1 1284 . 36 1 1 A 114 114 MET HA H 114 4.231 4.011 0.220 1
1 1289 . 36 1 1 A 114 114 MET C C 114 175.648 176.889 -1.241 1
1 1290 . 36 1 1 A 114 114 MET CA C 114 57.446 57.444 0.002 1
1 1291 . 36 1 1 A 114 114 MET CB C 114 33.570 32.797 0.773 1
1 1293 . 36 1 1 A 114 114 MET N N 114 111.509 119.864 -8.355 1
1 1294 . 36 1 1 A 115 115 GLN H H 115 6.940 7.379 -0.439 1
1 1295 . 36 1 1 A 115 115 GLN HA H 115 4.307 4.307 0.000 1
1 1302 . 36 1 1 A 115 115 GLN C C 115 176.270 174.563 1.707 1
1 1303 . 36 1 1 A 115 115 GLN CA C 115 54.680 54.824 -0.144 1
1 1304 . 36 1 1 A 115 115 GLN CB C 115 28.233 28.872 -0.639 1
1 1306 . 36 1 1 A 115 115 GLN N N 115 114.300 116.056 -1.756 1
1 1308 . 36 1 1 A 116 116 TYR H H 116 6.677 7.128 -0.451 1
1 1309 . 36 1 1 A 116 116 TYR HA H 116 4.193 4.420 -0.227 1
1 1312 . 36 1 1 A 116 116 TYR C C 116 175.268 175.371 -0.103 1
1 1313 . 36 1 1 A 116 116 TYR CA C 116 54.357 57.743 -3.386 1
1 1314 . 36 1 1 A 116 116 TYR CB C 116 35.498 39.181 -3.683 1
1 1315 . 36 1 1 A 116 116 TYR N N 116 117.919 118.307 -0.388 1
1 1316 . 36 1 1 A 117 117 ASP H H 117 8.081 9.144 -1.063 1
1 1317 . 36 1 1 A 117 117 ASP HA H 117 4.665 4.842 -0.177 1
1 1320 . 36 1 1 A 117 117 ASP CA C 117 52.422 52.840 -0.418 1
1 1321 . 36 1 1 A 117 117 ASP CB C 117 42.416 40.569 1.847 1
1 1322 . 36 1 1 A 117 117 ASP N N 117 120.887 121.725 -0.838 1
1 1323 . 36 1 1 A 118 118 PRO C C 118 179.180 178.052 1.128 1
1 1324 . 36 1 1 A 118 118 PRO CA C 118 65.942 65.067 0.875 1
1 1325 . 36 1 1 A 118 118 PRO CB C 118 32.197 31.960 0.237 1
1 1326 . 36 1 1 A 119 119 GLY H H 119 9.742 8.732 1.010 1
1 1327 . 36 1 1 A 119 119 GLY C C 119 175.622 175.743 -0.121 1
1 1328 . 36 1 1 A 119 119 GLY CA C 119 46.785 46.404 0.381 1
1 1329 . 36 1 1 A 119 119 GLY N N 119 106.412 106.523 -0.111 1
1 1330 . 36 1 1 A 120 120 LEU H H 120 6.666 8.244 -1.578 1
1 1331 . 36 1 1 A 120 120 LEU HA H 120 3.365 3.778 -0.413 1
1 1341 . 36 1 1 A 120 120 LEU C C 120 179.262 178.464 0.798 1
1 1342 . 36 1 1 A 120 120 LEU CA C 120 56.605 57.054 -0.449 1
1 1343 . 36 1 1 A 120 120 LEU CB C 120 39.262 41.621 -2.359 1
1 1347 . 36 1 1 A 120 120 LEU N N 120 126.226 123.806 2.420 1
1 1348 . 36 1 1 A 121 121 PHE H H 121 7.356 8.682 -1.326 1
1 1349 . 36 1 1 A 121 121 PHE HA H 121 4.459 3.824 0.635 1
1 1352 . 36 1 1 A 121 121 PHE C C 121 179.716 177.614 2.102 1
1 1353 . 36 1 1 A 121 121 PHE CA C 121 62.838 62.033 0.805 1
1 1354 . 36 1 1 A 121 121 PHE CB C 121 37.603 39.066 -1.463 1
1 1355 . 36 1 1 A 121 121 PHE N N 121 117.437 119.354 -1.917 1
1 1356 . 36 1 1 A 122 122 ALA H H 122 7.926 7.997 -0.071 1
1 1357 . 36 1 1 A 122 122 ALA HA H 122 4.523 3.941 0.582 1
1 1361 . 36 1 1 A 122 122 ALA C C 122 180.435 179.960 0.475 1
1 1362 . 36 1 1 A 122 122 ALA CA C 122 55.527 55.363 0.164 1
1 1363 . 36 1 1 A 122 122 ALA CB C 122 17.814 17.991 -0.177 1
1 1364 . 36 1 1 A 122 122 ALA N N 122 121.068 121.418 -0.350 1
1 1365 . 36 1 1 A 123 123 GLN H H 123 7.507 8.119 -0.612 1
1 1366 . 36 1 1 A 123 123 GLN HA H 123 4.153 3.857 0.296 1
1 1371 . 36 1 1 A 123 123 GLN C C 123 180.561 178.390 2.171 1
1 1372 . 36 1 1 A 123 123 GLN CA C 123 59.948 59.074 0.874 1
1 1373 . 36 1 1 A 123 123 GLN CB C 123 29.135 28.134 1.001 1
1 1375 . 36 1 1 A 123 123 GLN N N 123 120.324 117.262 3.062 1
1 1376 . 36 1 1 A 124 124 ILE H H 124 8.318 8.086 0.232 1
1 1377 . 36 1 1 A 124 124 ILE HA H 124 3.635 3.800 -0.165 1
1 1387 . 36 1 1 A 124 124 ILE C C 124 176.481 178.078 -1.597 1
1 1388 . 36 1 1 A 124 124 ILE CA C 124 66.432 64.550 1.882 1
1 1389 . 36 1 1 A 124 124 ILE CB C 124 39.168 37.807 1.361 1
1 1393 . 36 1 1 A 124 124 ILE N N 124 123.747 118.124 5.623 1
1 1394 . 36 1 1 A 125 125 GLN H H 125 8.474 7.982 0.492 1
1 1395 . 36 1 1 A 125 125 GLN HA H 125 4.264 3.898 0.366 1
1 1402 . 36 1 1 A 125 125 GLN C C 125 178.947 177.890 1.057 1
1 1403 . 36 1 1 A 125 125 GLN CA C 125 59.651 58.459 1.192 1
1 1404 . 36 1 1 A 125 125 GLN CB C 125 28.880 28.472 0.408 1
1 1406 . 36 1 1 A 125 125 GLN N N 125 120.368 121.245 -0.877 1
1 1408 . 36 1 1 A 126 126 ALA H H 126 8.002 8.024 -0.022 1
1 1409 . 36 1 1 A 126 126 ALA HA H 126 4.144 4.024 0.120 1
1 1413 . 36 1 1 A 126 126 ALA C C 126 179.316 180.163 -0.847 1
1 1414 . 36 1 1 A 126 126 ALA CA C 126 55.036 54.931 0.105 1
1 1415 . 36 1 1 A 126 126 ALA CB C 126 18.087 17.813 0.274 1
1 1416 . 36 1 1 A 126 126 ALA N N 126 121.661 121.264 0.397 1
1 1417 . 36 1 1 A 127 127 ALA H H 127 7.823 8.128 -0.305 1
1 1418 . 36 1 1 A 127 127 ALA HA H 127 4.162 3.986 0.176 1
1 1422 . 36 1 1 A 127 127 ALA C C 127 180.707 179.309 1.398 1
1 1423 . 36 1 1 A 127 127 ALA CA C 127 55.080 54.845 0.235 1
1 1424 . 36 1 1 A 127 127 ALA CB C 127 19.354 18.493 0.861 1
1 1425 . 36 1 1 A 127 127 ALA N N 127 119.853 120.161 -0.308 1
1 1426 . 36 1 1 A 128 128 ALA H H 128 8.936 7.707 1.229 1
1 1427 . 36 1 1 A 128 128 ALA HA H 128 3.928 3.693 0.235 1
1 1431 . 36 1 1 A 128 128 ALA C C 128 181.031 179.350 1.681 1
1 1432 . 36 1 1 A 128 128 ALA CA C 128 55.502 54.655 0.847 1
1 1433 . 36 1 1 A 128 128 ALA CB C 128 16.609 17.811 -1.202 1
1 1434 . 36 1 1 A 128 128 ALA N N 128 121.355 120.017 1.338 1
1 1435 . 36 1 1 A 129 129 THR H H 129 8.543 8.009 0.534 1
1 1436 . 36 1 1 A 129 129 THR HA H 129 4.015 3.743 0.272 1
1 1441 . 36 1 1 A 129 129 THR C C 129 177.332 176.407 0.925 1
1 1442 . 36 1 1 A 129 129 THR CA C 129 65.893 65.747 0.146 1
1 1443 . 36 1 1 A 129 129 THR CB C 129 68.566 68.200 0.366 1
1 1445 . 36 1 1 A 129 129 THR N N 129 112.709 111.257 1.452 1
1 1446 . 36 1 1 A 130 130 LYS H H 130 8.126 7.270 0.856 1
1 1447 . 36 1 1 A 130 130 LYS HA H 130 4.000 4.026 -0.026 1
1 1456 . 36 1 1 A 130 130 LYS C C 130 179.082 178.604 0.478 1
1 1457 . 36 1 1 A 130 130 LYS CA C 130 60.299 58.517 1.782 1
1 1458 . 36 1 1 A 130 130 LYS CB C 130 32.767 32.029 0.738 1
1 1462 . 36 1 1 A 130 130 LYS N N 130 123.879 121.997 1.882 1
1 1463 . 36 1 1 A 131 131 ALA H H 131 7.184 7.688 -0.504 1
1 1464 . 36 1 1 A 131 131 ALA HA H 131 4.005 4.196 -0.191 1
1 1468 . 36 1 1 A 131 131 ALA C C 131 178.482 179.539 -1.057 1
1 1469 . 36 1 1 A 131 131 ALA CA C 131 55.027 55.178 -0.151 1
1 1470 . 36 1 1 A 131 131 ALA CB C 131 18.669 19.463 -0.794 1
1 1471 . 36 1 1 A 131 131 ALA N N 131 118.590 121.190 -2.600 1
1 1472 . 36 1 1 A 132 132 TRP H H 132 7.977 8.649 -0.672 1
1 1473 . 36 1 1 A 132 132 TRP HA H 132 4.001 4.155 -0.154 1
1 1480 . 36 1 1 A 132 132 TRP C C 132 177.332 175.737 1.595 1
1 1481 . 36 1 1 A 132 132 TRP CA C 132 60.431 57.346 3.085 1
1 1482 . 36 1 1 A 132 132 TRP CB C 132 27.786 27.628 0.158 1
1 1486 . 36 1 1 A 132 132 TRP N N 132 119.168 116.997 2.171 1
1 1488 . 36 1 1 A 133 133 ARG H H 133 8.006 8.157 -0.151 1
1 1489 . 36 1 1 A 133 133 ARG HA H 133 4.027 4.379 -0.352 1
1 1497 . 36 1 1 A 133 133 ARG C C 133 176.664 177.947 -1.283 1
1 1498 . 36 1 1 A 133 133 ARG CA C 133 59.355 57.058 2.297 1
1 1499 . 36 1 1 A 133 133 ARG CB C 133 30.451 32.275 -1.824 1
1 1502 . 36 1 1 A 133 133 ARG N N 133 113.062 120.657 -7.595 1
1 1504 . 36 1 1 A 134 134 LYS H H 134 7.322 7.693 -0.371 1
1 1505 . 36 1 1 A 134 134 LYS HA H 134 4.313 4.392 -0.079 1
1 1514 . 36 1 1 A 134 134 LYS C C 134 176.282 176.017 0.265 1
1 1515 . 36 1 1 A 134 134 LYS CA C 134 54.922 56.478 -1.556 1
1 1516 . 36 1 1 A 134 134 LYS CB C 134 32.633 31.995 0.638 1
1 1520 . 36 1 1 A 134 134 LYS N N 134 118.170 116.734 1.436 1
1 1521 . 36 1 1 A 135 135 LEU H H 135 7.440 7.135 0.305 1
1 1522 . 36 1 1 A 135 135 LEU HA H 135 4.174 4.550 -0.376 1
1 1532 . 36 1 1 A 135 135 LEU CA C 135 54.408 53.005 1.403 1
1 1533 . 36 1 1 A 135 135 LEU CB C 135 40.407 40.918 -0.511 1
1 1537 . 36 1 1 A 135 135 LEU N N 135 123.358 122.580 0.778 1
1 1538 . 36 1 1 A 136 136 PRO HA H 136 4.437 4.542 -0.105 1
1 1545 . 36 1 1 A 136 136 PRO C C 136 177.106 176.523 0.583 1
1 1546 . 36 1 1 A 136 136 PRO CA C 136 62.889 62.520 0.369 1
1 1547 . 36 1 1 A 136 136 PRO CB C 136 32.192 33.035 -0.843 1
1 1550 . 36 1 1 A 137 137 VAL H H 137 8.219 8.645 -0.426 1
1 1551 . 36 1 1 A 137 137 VAL HA H 137 4.077 4.641 -0.564 1
1 1559 . 36 1 1 A 137 137 VAL C C 137 176.305 176.594 -0.289 1
1 1560 . 36 1 1 A 137 137 VAL CA C 137 61.958 61.401 0.557 1
1 1561 . 36 1 1 A 137 137 VAL CB C 137 32.755 31.079 1.676 1
1 1564 . 36 1 1 A 137 137 VAL N N 137 120.079 120.007 0.072 1
1 1565 . 36 1 1 A 138 138 LYS H H 138 8.444 8.141 0.303 1
1 1566 . 36 1 1 A 138 138 LYS HA H 138 4.316 3.887 0.429 1
1 1575 . 36 1 1 A 138 138 LYS C C 138 176.790 176.536 0.254 1
1 1576 . 36 1 1 A 138 138 LYS CA C 138 56.792 58.538 -1.746 1
1 1577 . 36 1 1 A 138 138 LYS CB C 138 33.205 31.033 2.172 1
1 1581 . 36 1 1 A 138 138 LYS N N 138 126.449 117.010 9.439 1
1 1582 . 36 1 1 A 139 139 GLY H H 139 8.518 8.162 0.356 1
1 1583 . 36 1 1 A 139 139 GLY HA2 H 139 4.070 3.972 0.098 1
1 1584 . 36 1 1 A 139 139 GLY HA3 H 139 3.897 3.982 -0.085 1
1 1585 . 36 1 1 A 139 139 GLY C C 139 172.874 173.844 -0.970 1
1 1586 . 36 1 1 A 139 139 GLY CA C 139 45.157 45.094 0.063 1
1 1587 . 36 1 1 A 139 139 GLY N N 139 112.617 107.195 5.422 1
1 6 . 37 1 1 A 2 2 VAL H H 2 8.992 8.604 0.388 1
1 7 . 37 1 1 A 2 2 VAL HA H 2 5.370 4.275 1.095 1
1 15 . 37 1 1 A 2 2 VAL C C 2 174.325 175.206 -0.881 1
1 16 . 37 1 1 A 2 2 VAL CA C 2 61.267 62.358 -1.091 1
1 17 . 37 1 1 A 2 2 VAL CB C 2 33.890 32.115 1.775 1
1 20 . 37 1 1 A 2 2 VAL N N 2 126.939 120.535 6.404 1
1 21 . 37 1 1 A 3 3 THR H H 3 8.912 8.516 0.396 1
1 22 . 37 1 1 A 3 3 THR HA H 3 4.505 5.166 -0.661 1
1 27 . 37 1 1 A 3 3 THR C C 3 172.710 173.485 -0.775 1
1 28 . 37 1 1 A 3 3 THR CA C 3 59.689 60.079 -0.390 1
1 29 . 37 1 1 A 3 3 THR CB C 3 72.398 71.534 0.864 1
1 31 . 37 1 1 A 3 3 THR N N 3 118.091 122.444 -4.353 1
1 32 . 37 1 1 A 4 4 GLU H H 4 8.631 8.995 -0.364 1
1 33 . 37 1 1 A 4 4 GLU HA H 4 5.788 5.048 0.740 1
1 38 . 37 1 1 A 4 4 GLU C C 4 175.758 174.210 1.548 1
1 39 . 37 1 1 A 4 4 GLU CA C 4 54.902 54.214 0.688 1
1 40 . 37 1 1 A 4 4 GLU CB C 4 35.097 33.031 2.066 1
1 42 . 37 1 1 A 4 4 GLU N N 4 120.966 125.423 -4.457 1
1 43 . 37 1 1 A 5 5 THR H H 5 9.188 8.381 0.807 1
1 44 . 37 1 1 A 5 5 THR HA H 5 4.739 4.698 0.041 1
1 49 . 37 1 1 A 5 5 THR C C 5 172.757 172.363 0.394 1
1 50 . 37 1 1 A 5 5 THR CA C 5 60.382 60.404 -0.022 1
1 51 . 37 1 1 A 5 5 THR CB C 5 71.558 70.367 1.191 1
1 53 . 37 1 1 A 5 5 THR N N 5 119.366 114.798 4.568 1
1 54 . 37 1 1 A 6 6 VAL H H 6 8.476 8.824 -0.348 1
1 55 . 37 1 1 A 6 6 VAL HA H 6 5.026 5.570 -0.544 1
1 63 . 37 1 1 A 6 6 VAL C C 6 176.674 174.142 2.532 1
1 64 . 37 1 1 A 6 6 VAL CA C 6 61.008 59.307 1.701 1
1 65 . 37 1 1 A 6 6 VAL CB C 6 33.861 35.100 -1.239 1
1 68 . 37 1 1 A 6 6 VAL N N 6 121.384 118.575 2.809 1
1 69 . 37 1 1 A 7 7 ASP H H 7 8.848 8.972 -0.124 1
1 70 . 37 1 1 A 7 7 ASP HA H 7 4.797 4.927 -0.130 1
1 73 . 37 1 1 A 7 7 ASP CA C 7 52.834 54.643 -1.809 1
1 74 . 37 1 1 A 7 7 ASP CB C 7 42.219 42.169 0.050 1
1 75 . 37 1 1 A 7 7 ASP N N 7 127.061 125.537 1.524 1
1 76 . 37 1 1 A 8 8 GLY C C 8 175.143 175.173 -0.030 1
1 77 . 37 1 1 A 8 8 GLY CA C 8 46.553 47.082 -0.529 1
1 78 . 37 1 1 A 9 9 GLN H H 9 8.408 7.743 0.665 1
1 79 . 37 1 1 A 9 9 GLN HA H 9 4.541 4.209 0.332 1
1 86 . 37 1 1 A 9 9 GLN C C 9 176.463 176.443 0.020 1
1 87 . 37 1 1 A 9 9 GLN CA C 9 55.167 55.340 -0.173 1
1 88 . 37 1 1 A 9 9 GLN CB C 9 29.376 27.774 1.602 1
1 90 . 37 1 1 A 9 9 GLN N N 9 118.300 117.141 1.159 1
1 92 . 37 1 1 A 10 10 GLY H H 10 8.162 8.512 -0.350 1
1 93 . 37 1 1 A 10 10 GLY HA2 H 10 4.174 3.851 0.323 1
1 94 . 37 1 1 A 10 10 GLY HA3 H 10 3.521 3.859 -0.338 1
1 95 . 37 1 1 A 10 10 GLY C C 10 174.092 173.759 0.333 1
1 96 . 37 1 1 A 10 10 GLY CA C 10 45.558 46.216 -0.658 1
1 97 . 37 1 1 A 10 10 GLY N N 10 108.747 110.826 -2.079 1
1 98 . 37 1 1 A 11 11 GLN H H 11 8.507 7.598 0.909 1
1 99 . 37 1 1 A 11 11 GLN HA H 11 4.202 4.758 -0.556 1
1 106 . 37 1 1 A 11 11 GLN C C 11 173.992 174.171 -0.179 1
1 107 . 37 1 1 A 11 11 GLN CA C 11 55.098 53.709 1.389 1
1 108 . 37 1 1 A 11 11 GLN CB C 11 29.097 31.717 -2.620 1
1 110 . 37 1 1 A 11 11 GLN N N 11 122.979 115.819 7.160 1
1 112 . 37 1 1 A 12 12 ALA H H 12 8.259 8.514 -0.255 1
1 113 . 37 1 1 A 12 12 ALA HA H 12 5.156 5.848 -0.692 1
1 117 . 37 1 1 A 12 12 ALA C C 12 177.284 176.148 1.136 1
1 118 . 37 1 1 A 12 12 ALA CA C 12 51.087 50.280 0.807 1
1 119 . 37 1 1 A 12 12 ALA CB C 12 20.500 21.729 -1.229 1
1 120 . 37 1 1 A 12 12 ALA N N 12 127.100 123.362 3.738 1
1 121 . 37 1 1 A 13 13 TRP H H 13 9.245 8.858 0.387 1
1 122 . 37 1 1 A 13 13 TRP HA H 13 4.717 5.369 -0.652 1
1 131 . 37 1 1 A 13 13 TRP C C 13 175.108 174.244 0.864 1
1 132 . 37 1 1 A 13 13 TRP CA C 13 55.966 55.438 0.528 1
1 133 . 37 1 1 A 13 13 TRP CB C 13 31.912 32.223 -0.311 1
1 139 . 37 1 1 A 13 13 TRP N N 13 123.088 118.592 4.496 1
1 141 . 37 1 1 A 14 14 ARG H H 14 8.575 8.693 -0.118 1
1 142 . 37 1 1 A 14 14 ARG HA H 14 5.335 4.470 0.865 1
1 150 . 37 1 1 A 14 14 ARG C C 14 175.191 174.290 0.901 1
1 151 . 37 1 1 A 14 14 ARG CA C 14 53.106 55.149 -2.043 1
1 152 . 37 1 1 A 14 14 ARG CB C 14 32.749 31.523 1.226 1
1 154 . 37 1 1 A 14 14 ARG N N 14 121.163 120.033 1.130 1
1 156 . 37 1 1 A 15 15 HIS H H 15 8.595 8.282 0.313 1
1 157 . 37 1 1 A 15 15 HIS HA H 15 4.790 5.159 -0.369 1
1 161 . 37 1 1 A 15 15 HIS C C 15 173.770 175.065 -1.295 1
1 162 . 37 1 1 A 15 15 HIS CA C 15 55.289 53.544 1.745 1
1 163 . 37 1 1 A 15 15 HIS CB C 15 33.208 32.521 0.687 1
1 165 . 37 1 1 A 15 15 HIS N N 15 117.643 119.672 -2.029 1
1 166 . 37 1 1 A 16 16 HIS H H 16 8.993 8.884 0.109 1
1 167 . 37 1 1 A 16 16 HIS HA H 16 5.158 4.743 0.415 1
1 171 . 37 1 1 A 16 16 HIS C C 16 173.608 174.630 -1.022 1
1 172 . 37 1 1 A 16 16 HIS CA C 16 56.450 56.637 -0.187 1
1 173 . 37 1 1 A 16 16 HIS CB C 16 34.171 30.948 3.223 1
1 175 . 37 1 1 A 16 16 HIS N N 16 123.520 121.212 2.308 1
1 176 . 37 1 1 A 17 17 ASN H H 17 7.829 8.934 -1.105 1
1 177 . 37 1 1 A 17 17 ASN HA H 17 4.713 5.279 -0.566 1
1 182 . 37 1 1 A 17 17 ASN C C 17 173.682 174.600 -0.918 1
1 183 . 37 1 1 A 17 17 ASN CA C 17 51.822 51.751 0.071 1
1 184 . 37 1 1 A 17 17 ASN CB C 17 43.176 42.154 1.022 1
1 185 . 37 1 1 A 17 17 ASN N N 17 122.213 120.833 1.380 1
1 187 . 37 1 1 A 18 18 GLY H H 18 8.423 8.641 -0.218 1
1 188 . 37 1 1 A 18 18 GLY HA2 H 18 3.931 4.114 -0.183 1
1 189 . 37 1 1 A 18 18 GLY HA3 H 18 3.707 4.135 -0.428 1
1 190 . 37 1 1 A 18 18 GLY C C 18 173.985 173.428 0.557 1
1 191 . 37 1 1 A 18 18 GLY CA C 18 43.949 44.206 -0.257 1
1 192 . 37 1 1 A 18 18 GLY N N 18 106.991 111.783 -4.792 1
1 193 . 37 1 1 A 19 19 PHE H H 19 8.338 8.511 -0.173 1
1 194 . 37 1 1 A 19 19 PHE HA H 19 4.068 5.171 -1.103 1
1 197 . 37 1 1 A 19 19 PHE C C 19 176.568 174.685 1.883 1
1 198 . 37 1 1 A 19 19 PHE CA C 19 59.338 56.499 2.839 1
1 199 . 37 1 1 A 19 19 PHE CB C 19 40.201 43.140 -2.939 1
1 200 . 37 1 1 A 19 19 PHE N N 19 116.857 119.239 -2.382 1
1 201 . 37 1 1 A 20 20 ASP H H 20 8.794 8.891 -0.097 1
1 202 . 37 1 1 A 20 20 ASP HA H 20 4.485 4.910 -0.425 1
1 205 . 37 1 1 A 20 20 ASP C C 20 177.379 177.476 -0.097 1
1 206 . 37 1 1 A 20 20 ASP CA C 20 54.140 53.974 0.166 1
1 207 . 37 1 1 A 20 20 ASP CB C 20 41.915 42.797 -0.882 1
1 208 . 37 1 1 A 20 20 ASP N N 20 123.025 123.342 -0.317 1
1 209 . 37 1 1 A 21 21 PHE H H 21 8.862 9.131 -0.269 1
1 210 . 37 1 1 A 21 21 PHE HA H 21 4.087 4.114 -0.027 1
1 218 . 37 1 1 A 21 21 PHE C C 21 176.952 177.260 -0.308 1
1 219 . 37 1 1 A 21 21 PHE CA C 21 61.095 61.986 -0.891 1
1 220 . 37 1 1 A 21 21 PHE CB C 21 38.678 39.258 -0.580 1
1 226 . 37 1 1 A 21 21 PHE N N 21 127.163 127.727 -0.564 1
1 227 . 37 1 1 A 22 22 ALA H H 22 8.561 8.017 0.544 1
1 228 . 37 1 1 A 22 22 ALA HA H 22 3.878 4.026 -0.148 1
1 232 . 37 1 1 A 22 22 ALA C C 22 180.710 180.180 0.530 1
1 233 . 37 1 1 A 22 22 ALA CA C 22 55.211 55.100 0.111 1
1 234 . 37 1 1 A 22 22 ALA CB C 22 18.321 18.241 0.080 1
1 235 . 37 1 1 A 22 22 ALA N N 22 120.293 121.322 -1.029 1
1 236 . 37 1 1 A 23 23 VAL H H 23 7.241 7.942 -0.701 1
1 237 . 37 1 1 A 23 23 VAL HA H 23 3.684 3.489 0.195 1
1 245 . 37 1 1 A 23 23 VAL C C 23 177.101 178.419 -1.318 1
1 246 . 37 1 1 A 23 23 VAL CA C 23 65.237 67.013 -1.776 1
1 247 . 37 1 1 A 23 23 VAL CB C 23 31.780 31.694 0.086 1
1 250 . 37 1 1 A 23 23 VAL N N 23 118.775 119.177 -0.402 1
1 251 . 37 1 1 A 24 24 ILE H H 24 6.761 7.923 -1.162 1
1 252 . 37 1 1 A 24 24 ILE HA H 24 3.196 3.480 -0.284 1
1 262 . 37 1 1 A 24 24 ILE C C 24 177.287 177.987 -0.700 1
1 263 . 37 1 1 A 24 24 ILE CA C 24 63.404 65.526 -2.122 1
1 264 . 37 1 1 A 24 24 ILE CB C 24 36.294 37.683 -1.389 1
1 268 . 37 1 1 A 24 24 ILE N N 24 119.036 119.787 -0.751 1
1 269 . 37 1 1 A 25 25 LYS H H 25 8.032 8.123 -0.091 1
1 270 . 37 1 1 A 25 25 LYS HA H 25 3.809 3.720 0.089 1
1 279 . 37 1 1 A 25 25 LYS C C 25 179.450 178.747 0.703 1
1 280 . 37 1 1 A 25 25 LYS CA C 25 59.621 59.499 0.122 1
1 281 . 37 1 1 A 25 25 LYS CB C 25 32.259 31.877 0.382 1
1 285 . 37 1 1 A 25 25 LYS N N 25 118.368 120.319 -1.951 1
1 286 . 37 1 1 A 26 26 GLU H H 26 7.845 8.321 -0.476 1
1 287 . 37 1 1 A 26 26 GLU HA H 26 4.021 4.120 -0.099 1
1 292 . 37 1 1 A 26 26 GLU C C 26 179.191 178.765 0.426 1
1 293 . 37 1 1 A 26 26 GLU CA C 26 59.530 59.013 0.517 1
1 294 . 37 1 1 A 26 26 GLU CB C 26 29.449 29.308 0.141 1
1 296 . 37 1 1 A 26 26 GLU N N 26 120.522 118.963 1.559 1
1 297 . 37 1 1 A 27 27 LEU H H 27 8.165 7.770 0.395 1
1 298 . 37 1 1 A 27 27 LEU HA H 27 4.163 4.146 0.017 1
1 308 . 37 1 1 A 27 27 LEU C C 27 177.256 178.283 -1.027 1
1 309 . 37 1 1 A 27 27 LEU CA C 27 58.049 57.857 0.192 1
1 310 . 37 1 1 A 27 27 LEU CB C 27 41.365 41.979 -0.614 1
1 314 . 37 1 1 A 27 27 LEU N N 27 120.879 121.019 -0.140 1
1 315 . 37 1 1 A 28 28 LYS H H 28 8.902 7.704 1.198 1
1 316 . 37 1 1 A 28 28 LYS HA H 28 4.199 4.363 -0.164 1
1 317 . 37 1 1 A 28 28 LYS C C 28 179.707 179.234 0.473 1
1 318 . 37 1 1 A 28 28 LYS CA C 28 60.097 59.206 0.891 1
1 319 . 37 1 1 A 28 28 LYS CB C 28 33.420 31.665 1.755 1
1 320 . 37 1 1 A 28 28 LYS N N 28 120.050 119.471 0.579 1
1 321 . 37 1 1 A 29 29 THR H H 29 8.294 8.129 0.165 1
1 322 . 37 1 1 A 29 29 THR HA H 29 3.892 3.909 -0.017 1
1 327 . 37 1 1 A 29 29 THR C C 29 175.711 176.257 -0.546 1
1 328 . 37 1 1 A 29 29 THR CA C 29 66.846 66.519 0.327 1
1 329 . 37 1 1 A 29 29 THR CB C 29 68.794 68.759 0.035 1
1 331 . 37 1 1 A 29 29 THR N N 29 115.933 116.463 -0.530 1
1 332 . 37 1 1 A 30 30 ALA H H 30 8.244 8.989 -0.745 1
1 333 . 37 1 1 A 30 30 ALA HA H 30 4.241 4.103 0.138 1
1 337 . 37 1 1 A 30 30 ALA C C 30 179.128 179.204 -0.076 1
1 338 . 37 1 1 A 30 30 ALA CA C 30 55.714 55.690 0.024 1
1 339 . 37 1 1 A 30 30 ALA CB C 30 18.955 18.100 0.855 1
1 340 . 37 1 1 A 30 30 ALA N N 30 124.617 123.167 1.450 1
1 341 . 37 1 1 A 31 31 ALA H H 31 8.968 8.679 0.289 1
1 342 . 37 1 1 A 31 31 ALA HA H 31 3.890 4.053 -0.163 1
1 346 . 37 1 1 A 31 31 ALA C C 31 180.352 179.624 0.728 1
1 347 . 37 1 1 A 31 31 ALA CA C 31 55.454 55.443 0.011 1
1 348 . 37 1 1 A 31 31 ALA CB C 31 17.124 18.101 -0.977 1
1 349 . 37 1 1 A 31 31 ALA N N 31 119.327 120.519 -1.192 1
1 350 . 37 1 1 A 32 32 SER H H 32 7.995 8.134 -0.139 1
1 351 . 37 1 1 A 32 32 SER HA H 32 4.238 4.254 -0.016 1
1 354 . 37 1 1 A 32 32 SER C C 32 175.612 177.300 -1.688 1
1 355 . 37 1 1 A 32 32 SER CA C 32 61.203 61.399 -0.196 1
1 356 . 37 1 1 A 32 32 SER CB C 32 63.406 63.242 0.164 1
1 357 . 37 1 1 A 32 32 SER N N 32 111.962 112.568 -0.606 1
1 358 . 37 1 1 A 33 33 GLN H H 33 8.333 8.054 0.279 1
1 359 . 37 1 1 A 33 33 GLN HA H 33 3.992 4.158 -0.166 1
1 366 . 37 1 1 A 33 33 GLN C C 33 177.486 177.346 0.140 1
1 367 . 37 1 1 A 33 33 GLN CA C 33 58.277 58.368 -0.091 1
1 368 . 37 1 1 A 33 33 GLN CB C 33 29.140 29.711 -0.571 1
1 370 . 37 1 1 A 33 33 GLN N N 33 119.527 121.511 -1.984 1
1 372 . 37 1 1 A 34 34 TYR H H 34 8.587 8.250 0.337 1
1 373 . 37 1 1 A 34 34 TYR HA H 34 4.792 4.579 0.213 1
1 380 . 37 1 1 A 34 34 TYR C C 34 176.499 176.615 -0.116 1
1 381 . 37 1 1 A 34 34 TYR CA C 34 57.711 58.573 -0.862 1
1 382 . 37 1 1 A 34 34 TYR CB C 34 39.561 39.267 0.294 1
1 387 . 37 1 1 A 34 34 TYR N N 34 114.610 114.626 -0.016 1
1 388 . 37 1 1 A 35 35 GLY H H 35 7.346 8.565 -1.219 1
1 389 . 37 1 1 A 35 35 GLY HA2 H 35 4.785 4.145 0.640 1
1 390 . 37 1 1 A 35 35 GLY HA3 H 35 4.007 4.146 -0.139 1
1 391 . 37 1 1 A 35 35 GLY C C 35 175.796 172.994 2.802 1
1 392 . 37 1 1 A 35 35 GLY CA C 35 44.355 44.632 -0.277 1
1 393 . 37 1 1 A 35 35 GLY N N 35 108.501 106.421 2.080 1
1 394 . 37 1 1 A 36 36 ALA H H 36 9.363 8.344 1.019 1
1 395 . 37 1 1 A 36 36 ALA HA H 36 4.217 4.645 -0.428 1
1 399 . 37 1 1 A 36 36 ALA C C 36 178.039 178.213 -0.174 1
1 400 . 37 1 1 A 36 36 ALA CA C 36 56.114 51.508 4.606 1
1 401 . 37 1 1 A 36 36 ALA CB C 36 19.179 20.573 -1.394 1
1 402 . 37 1 1 A 36 36 ALA N N 36 125.811 122.562 3.249 1
1 403 . 37 1 1 A 37 37 THR H H 37 8.070 8.887 -0.817 1
1 404 . 37 1 1 A 37 37 THR HA H 37 4.570 4.389 0.181 1
1 409 . 37 1 1 A 37 37 THR C C 37 173.685 173.779 -0.094 1
1 410 . 37 1 1 A 37 37 THR CA C 37 59.822 63.836 -4.014 1
1 411 . 37 1 1 A 37 37 THR CB C 37 68.267 67.025 1.242 1
1 413 . 37 1 1 A 37 37 THR N N 37 129.410 115.608 13.802 1
1 414 . 37 1 1 A 38 38 ALA H H 38 6.853 7.761 -0.908 1
1 415 . 37 1 1 A 38 38 ALA HA H 38 4.601 4.525 0.076 1
1 419 . 37 1 1 A 38 38 ALA CA C 38 50.758 50.633 0.125 1
1 420 . 37 1 1 A 38 38 ALA CB C 38 18.325 19.259 -0.934 1
1 421 . 37 1 1 A 38 38 ALA N N 38 124.674 125.245 -0.571 1
1 422 . 37 1 1 A 40 40 TYR HA H 40 4.032 4.025 0.007 1
1 429 . 37 1 1 A 40 40 TYR C C 40 176.456 177.247 -0.791 1
1 430 . 37 1 1 A 40 40 TYR CA C 40 61.010 61.680 -0.670 1
1 431 . 37 1 1 A 40 40 TYR CB C 40 39.286 38.704 0.582 1
1 436 . 37 1 1 A 41 41 THR H H 41 6.874 8.290 -1.416 1
1 437 . 37 1 1 A 41 41 THR HA H 41 3.616 3.972 -0.356 1
1 442 . 37 1 1 A 41 41 THR C C 41 176.930 177.499 -0.569 1
1 443 . 37 1 1 A 41 41 THR CA C 41 65.557 67.156 -1.599 1
1 444 . 37 1 1 A 41 41 THR CB C 41 68.228 68.833 -0.605 1
1 446 . 37 1 1 A 41 41 THR N N 41 115.143 113.932 1.211 1
1 447 . 37 1 1 A 42 42 LEU H H 42 8.623 7.489 1.134 1
1 448 . 37 1 1 A 42 42 LEU HA H 42 3.708 4.006 -0.298 1
1 458 . 37 1 1 A 42 42 LEU C C 42 178.206 179.058 -0.852 1
1 459 . 37 1 1 A 42 42 LEU CA C 42 57.417 57.864 -0.447 1
1 460 . 37 1 1 A 42 42 LEU CB C 42 41.342 41.203 0.139 1
1 464 . 37 1 1 A 42 42 LEU N N 42 120.418 117.860 2.558 1
1 465 . 37 1 1 A 43 43 ALA H H 43 7.735 7.803 -0.068 1
1 466 . 37 1 1 A 43 43 ALA HA H 43 4.020 3.943 0.077 1
1 470 . 37 1 1 A 43 43 ALA C C 43 180.826 180.502 0.324 1
1 471 . 37 1 1 A 43 43 ALA CA C 43 54.925 55.105 -0.180 1
1 472 . 37 1 1 A 43 43 ALA CB C 43 17.506 18.012 -0.506 1
1 473 . 37 1 1 A 43 43 ALA N N 43 120.203 121.714 -1.511 1
1 474 . 37 1 1 A 44 44 ILE H H 44 7.149 7.377 -0.228 1
1 475 . 37 1 1 A 44 44 ILE HA H 44 3.603 3.559 0.044 1
1 485 . 37 1 1 A 44 44 ILE C C 44 178.594 178.209 0.385 1
1 486 . 37 1 1 A 44 44 ILE CA C 44 64.782 64.640 0.142 1
1 487 . 37 1 1 A 44 44 ILE CB C 44 37.472 37.730 -0.258 1
1 491 . 37 1 1 A 44 44 ILE N N 44 118.881 119.612 -0.731 1
1 492 . 37 1 1 A 45 45 VAL H H 45 7.968 7.706 0.262 1
1 493 . 37 1 1 A 45 45 VAL HA H 45 2.925 3.362 -0.437 1
1 501 . 37 1 1 A 45 45 VAL C C 45 177.023 177.909 -0.886 1
1 502 . 37 1 1 A 45 45 VAL CA C 45 67.081 67.031 0.050 1
1 503 . 37 1 1 A 45 45 VAL CB C 45 30.854 31.307 -0.453 1
1 506 . 37 1 1 A 45 45 VAL N N 45 120.764 119.656 1.108 1
1 507 . 37 1 1 A 46 46 GLU H H 46 8.399 8.492 -0.093 1
1 508 . 37 1 1 A 46 46 GLU HA H 46 3.848 3.934 -0.086 1
1 513 . 37 1 1 A 46 46 GLU C C 46 178.656 178.492 0.164 1
1 514 . 37 1 1 A 46 46 GLU CA C 46 59.491 58.592 0.899 1
1 515 . 37 1 1 A 46 46 GLU CB C 46 28.991 28.011 0.980 1
1 517 . 37 1 1 A 46 46 GLU N N 46 116.599 119.589 -2.990 1
1 518 . 37 1 1 A 47 47 SER H H 47 7.273 7.678 -0.405 1
1 519 . 37 1 1 A 47 47 SER HA H 47 4.287 4.121 0.166 1
1 521 . 37 1 1 A 47 47 SER CA C 47 61.047 62.453 -1.406 1
1 522 . 37 1 1 A 47 47 SER CB C 47 63.016 62.991 0.025 1
1 523 . 37 1 1 A 47 47 SER N N 47 113.609 117.910 -4.301 1
1 524 . 37 1 1 A 48 48 VAL H H 48 8.006 8.183 -0.177 1
1 525 . 37 1 1 A 48 48 VAL HA H 48 3.556 3.580 -0.024 1
1 533 . 37 1 1 A 48 48 VAL C C 48 177.257 177.319 -0.062 1
1 534 . 37 1 1 A 48 48 VAL CA C 48 65.025 66.452 -1.427 1
1 535 . 37 1 1 A 48 48 VAL CB C 48 31.841 31.425 0.416 1
1 538 . 37 1 1 A 48 48 VAL N N 48 122.327 121.274 1.053 1
1 539 . 37 1 1 A 49 49 ALA H H 49 8.369 8.034 0.335 1
1 540 . 37 1 1 A 49 49 ALA HA H 49 4.115 4.197 -0.082 1
1 544 . 37 1 1 A 49 49 ALA C C 49 177.307 177.343 -0.036 1
1 545 . 37 1 1 A 49 49 ALA CA C 49 53.253 53.280 -0.027 1
1 546 . 37 1 1 A 49 49 ALA CB C 49 20.131 18.229 1.902 1
1 547 . 37 1 1 A 49 49 ALA N N 49 118.050 120.738 -2.688 1
1 548 . 37 1 1 A 50 50 ASP H H 50 7.052 7.767 -0.715 1
1 549 . 37 1 1 A 50 50 ASP HA H 50 4.788 4.515 0.273 1
1 552 . 37 1 1 A 50 50 ASP C C 50 175.481 176.042 -0.561 1
1 553 . 37 1 1 A 50 50 ASP CA C 50 53.681 54.401 -0.720 1
1 554 . 37 1 1 A 50 50 ASP CB C 50 39.333 41.184 -1.851 1
1 555 . 37 1 1 A 50 50 ASP N N 50 116.997 117.156 -0.159 1
1 556 . 37 1 1 A 51 51 ASN H H 51 8.535 7.742 0.793 1
1 557 . 37 1 1 A 51 51 ASN HA H 51 4.628 4.653 -0.025 1
1 562 . 37 1 1 A 51 51 ASN C C 51 174.077 175.264 -1.187 1
1 563 . 37 1 1 A 51 51 ASN CA C 51 52.315 52.522 -0.207 1
1 564 . 37 1 1 A 51 51 ASN CB C 51 41.928 39.588 2.340 1
1 565 . 37 1 1 A 51 51 ASN N N 51 118.626 117.496 1.130 1
1 567 . 37 1 1 A 52 52 TRP H H 52 8.555 8.698 -0.143 1
1 574 . 37 1 1 A 52 52 TRP C C 52 173.269 176.399 -3.130 1
1 575 . 37 1 1 A 52 52 TRP CA C 52 55.031 56.650 -1.619 1
1 576 . 37 1 1 A 52 52 TRP CB C 52 26.801 29.118 -2.317 1
1 582 . 37 1 1 A 52 52 TRP N N 52 120.693 120.985 -0.292 1
1 584 . 37 1 1 A 53 53 LEU H H 53 7.847 8.778 -0.931 1
1 585 . 37 1 1 A 53 53 LEU HA H 53 4.859 5.400 -0.541 1
1 595 . 37 1 1 A 53 53 LEU C C 53 177.397 175.620 1.777 1
1 596 . 37 1 1 A 53 53 LEU CA C 53 53.619 53.198 0.421 1
1 597 . 37 1 1 A 53 53 LEU CB C 53 41.812 46.461 -4.649 1
1 601 . 37 1 1 A 53 53 LEU N N 53 124.741 120.681 4.060 1
1 602 . 37 1 1 A 54 54 THR H H 54 8.850 8.696 0.154 1
1 603 . 37 1 1 A 54 54 THR HA H 54 4.598 4.764 -0.166 1
1 608 . 37 1 1 A 54 54 THR CA C 54 60.531 59.679 0.852 1
1 609 . 37 1 1 A 54 54 THR CB C 54 67.183 69.136 -1.953 1
1 611 . 37 1 1 A 54 54 THR N N 54 113.407 111.557 1.850 1
1 612 . 37 1 1 A 55 55 PRO HA H 55 4.511 3.904 0.607 1
1 619 . 37 1 1 A 55 55 PRO C C 55 179.383 178.848 0.535 1
1 620 . 37 1 1 A 55 55 PRO CA C 55 67.159 64.889 2.270 1
1 621 . 37 1 1 A 55 55 PRO CB C 55 32.095 31.610 0.485 1
1 622 . 37 1 1 A 56 56 THR H H 56 8.575 7.737 0.838 1
1 623 . 37 1 1 A 56 56 THR HA H 56 4.229 4.048 0.181 1
1 628 . 37 1 1 A 56 56 THR C C 56 176.668 175.756 0.912 1
1 629 . 37 1 1 A 56 56 THR CA C 56 66.943 65.749 1.194 1
1 630 . 37 1 1 A 56 56 THR CB C 56 68.129 68.123 0.006 1
1 632 . 37 1 1 A 56 56 THR N N 56 114.855 112.396 2.459 1
1 633 . 37 1 1 A 57 57 ASP H H 57 8.730 8.116 0.614 1
1 634 . 37 1 1 A 57 57 ASP HA H 57 4.425 4.388 0.037 1
1 637 . 37 1 1 A 57 57 ASP C C 57 178.351 178.752 -0.401 1
1 638 . 37 1 1 A 57 57 ASP CA C 57 57.963 57.060 0.903 1
1 639 . 37 1 1 A 57 57 ASP CB C 57 40.134 40.565 -0.431 1
1 640 . 37 1 1 A 57 57 ASP N N 57 126.239 120.683 5.556 1
1 641 . 37 1 1 A 58 58 TRP H H 58 8.244 8.215 0.029 1
1 642 . 37 1 1 A 58 58 TRP HA H 58 4.030 4.461 -0.431 1
1 650 . 37 1 1 A 58 58 TRP C C 58 177.432 179.014 -1.582 1
1 651 . 37 1 1 A 58 58 TRP CA C 58 62.731 59.961 2.770 1
1 652 . 37 1 1 A 58 58 TRP CB C 58 29.122 29.213 -0.091 1
1 657 . 37 1 1 A 58 58 TRP N N 58 119.241 120.945 -1.704 1
1 659 . 37 1 1 A 59 59 ASN H H 59 8.098 8.408 -0.310 1
1 660 . 37 1 1 A 59 59 ASN HA H 59 4.424 4.412 0.012 1
1 663 . 37 1 1 A 59 59 ASN C C 59 176.952 178.266 -1.314 1
1 664 . 37 1 1 A 59 59 ASN CA C 59 58.135 56.365 1.770 1
1 665 . 37 1 1 A 59 59 ASN CB C 59 40.168 39.088 1.080 1
1 666 . 37 1 1 A 59 59 ASN N N 59 115.747 117.749 -2.002 1
1 667 . 37 1 1 A 60 60 THR H H 60 8.712 7.813 0.899 1
1 668 . 37 1 1 A 60 60 THR HA H 60 3.717 4.060 -0.343 1
1 673 . 37 1 1 A 60 60 THR C C 60 176.044 176.692 -0.648 1
1 674 . 37 1 1 A 60 60 THR CA C 60 66.576 67.207 -0.631 1
1 675 . 37 1 1 A 60 60 THR CB C 60 69.251 67.817 1.434 1
1 677 . 37 1 1 A 60 60 THR N N 60 114.896 116.413 -1.517 1
1 678 . 37 1 1 A 61 61 LEU H H 61 8.485 8.536 -0.051 1
1 679 . 37 1 1 A 61 61 LEU HA H 61 3.391 4.031 -0.640 1
1 689 . 37 1 1 A 61 61 LEU C C 61 177.433 178.679 -1.246 1
1 690 . 37 1 1 A 61 61 LEU CA C 61 58.354 58.555 -0.201 1
1 691 . 37 1 1 A 61 61 LEU CB C 61 41.761 42.263 -0.502 1
1 695 . 37 1 1 A 61 61 LEU N N 61 123.433 121.923 1.510 1
1 696 . 37 1 1 A 62 62 VAL H H 62 8.073 8.467 -0.394 1
1 697 . 37 1 1 A 62 62 VAL HA H 62 3.207 3.784 -0.577 1
1 705 . 37 1 1 A 62 62 VAL C C 62 177.585 177.463 0.122 1
1 706 . 37 1 1 A 62 62 VAL CA C 62 67.345 65.249 2.096 1
1 707 . 37 1 1 A 62 62 VAL CB C 62 30.905 30.505 0.400 1
1 710 . 37 1 1 A 62 62 VAL N N 62 116.018 118.448 -2.430 1
1 711 . 37 1 1 A 63 63 ARG H H 63 7.765 7.916 -0.151 1
1 712 . 37 1 1 A 63 63 ARG HA H 63 3.602 3.965 -0.363 1
1 719 . 37 1 1 A 63 63 ARG C C 63 177.818 178.153 -0.335 1
1 720 . 37 1 1 A 63 63 ARG CA C 63 58.049 57.968 0.081 1
1 721 . 37 1 1 A 63 63 ARG CB C 63 29.955 29.281 0.674 1
1 724 . 37 1 1 A 63 63 ARG N N 63 116.700 120.776 -4.076 1
1 725 . 37 1 1 A 64 64 ALA H H 64 7.574 7.590 -0.016 1
1 726 . 37 1 1 A 64 64 ALA HA H 64 4.158 4.333 -0.175 1
1 730 . 37 1 1 A 64 64 ALA C C 64 179.886 179.644 0.242 1
1 731 . 37 1 1 A 64 64 ALA CA C 64 54.007 54.410 -0.403 1
1 732 . 37 1 1 A 64 64 ALA CB C 64 19.147 19.120 0.027 1
1 733 . 37 1 1 A 64 64 ALA N N 64 117.555 121.880 -4.325 1
1 734 . 37 1 1 A 65 65 VAL H H 65 7.554 7.850 -0.296 1
1 735 . 37 1 1 A 65 65 VAL HA H 65 4.253 3.821 0.432 1
1 743 . 37 1 1 A 65 65 VAL C C 65 174.180 176.255 -2.075 1
1 744 . 37 1 1 A 65 65 VAL CA C 65 62.683 65.355 -2.672 1
1 745 . 37 1 1 A 65 65 VAL CB C 65 33.458 31.633 1.825 1
1 748 . 37 1 1 A 65 65 VAL N N 65 110.013 115.841 -5.828 1
1 749 . 37 1 1 A 66 66 LEU H H 66 7.792 7.295 0.497 1
1 750 . 37 1 1 A 66 66 LEU HA H 66 4.790 4.749 0.041 1
1 760 . 37 1 1 A 66 66 LEU C C 66 177.537 175.266 2.271 1
1 761 . 37 1 1 A 66 66 LEU CA C 66 52.823 52.673 0.150 1
1 762 . 37 1 1 A 66 66 LEU CB C 66 44.071 45.193 -1.122 1
1 766 . 37 1 1 A 66 66 LEU N N 66 118.967 121.469 -2.502 1
1 767 . 37 1 1 A 67 67 SER H H 67 9.208 8.311 0.897 1
1 768 . 37 1 1 A 67 67 SER HA H 67 4.414 5.060 -0.646 1
1 771 . 37 1 1 A 67 67 SER CA C 67 57.943 56.832 1.111 1
1 772 . 37 1 1 A 67 67 SER CB C 67 64.743 65.965 -1.222 1
1 773 . 37 1 1 A 67 67 SER N N 67 116.378 112.878 3.500 1
1 774 . 37 1 1 A 69 69 GLY HA2 H 69 3.916 3.737 0.179 1
1 775 . 37 1 1 A 69 69 GLY HA3 H 69 3.867 3.784 0.083 1
1 776 . 37 1 1 A 69 69 GLY C C 69 176.783 175.509 1.274 1
1 777 . 37 1 1 A 69 69 GLY CA C 69 46.977 47.006 -0.029 1
1 778 . 37 1 1 A 70 70 ASP H H 70 7.674 8.096 -0.422 1
1 779 . 37 1 1 A 70 70 ASP HA H 70 4.511 3.730 0.781 1
1 782 . 37 1 1 A 70 70 ASP C C 70 178.096 178.393 -0.297 1
1 783 . 37 1 1 A 70 70 ASP CA C 70 57.262 56.241 1.021 1
1 784 . 37 1 1 A 70 70 ASP CB C 70 40.594 39.745 0.849 1
1 785 . 37 1 1 A 70 70 ASP N N 70 123.930 122.151 1.779 1
1 786 . 37 1 1 A 71 71 HIS H H 71 8.729 7.884 0.845 1
1 787 . 37 1 1 A 71 71 HIS HA H 71 4.235 4.168 0.067 1
1 790 . 37 1 1 A 71 71 HIS C C 71 176.769 177.971 -1.202 1
1 791 . 37 1 1 A 71 71 HIS CA C 71 60.041 58.986 1.055 1
1 792 . 37 1 1 A 71 71 HIS CB C 71 30.682 30.061 0.621 1
1 793 . 37 1 1 A 71 71 HIS N N 71 121.003 117.224 3.779 1
1 794 . 37 1 1 A 72 72 LEU H H 72 7.620 7.923 -0.303 1
1 795 . 37 1 1 A 72 72 LEU HA H 72 3.769 3.966 -0.197 1
1 805 . 37 1 1 A 72 72 LEU C C 72 180.275 179.271 1.004 1
1 806 . 37 1 1 A 72 72 LEU CA C 72 58.192 58.045 0.147 1
1 807 . 37 1 1 A 72 72 LEU CB C 72 41.381 41.221 0.160 1
1 811 . 37 1 1 A 72 72 LEU N N 72 118.569 117.009 1.560 1
1 812 . 37 1 1 A 73 73 LEU H H 73 7.542 7.447 0.095 1
1 813 . 37 1 1 A 73 73 LEU HA H 73 4.107 4.248 -0.141 1
1 823 . 37 1 1 A 73 73 LEU C C 73 179.436 179.261 0.175 1
1 824 . 37 1 1 A 73 73 LEU CA C 73 58.026 57.256 0.770 1
1 825 . 37 1 1 A 73 73 LEU CB C 73 41.638 42.109 -0.471 1
1 829 . 37 1 1 A 73 73 LEU N N 73 121.418 120.651 0.767 1
1 830 . 37 1 1 A 74 74 TRP H H 74 8.786 8.014 0.772 1
1 831 . 37 1 1 A 74 74 TRP HA H 74 3.589 5.495 -1.906 1
1 840 . 37 1 1 A 74 74 TRP C C 74 176.816 178.800 -1.984 1
1 841 . 37 1 1 A 74 74 TRP CA C 74 63.046 59.902 3.144 1
1 842 . 37 1 1 A 74 74 TRP CB C 74 28.065 29.012 -0.947 1
1 848 . 37 1 1 A 74 74 TRP N N 74 121.111 118.254 2.857 1
1 850 . 37 1 1 A 75 75 LYS H H 75 8.939 7.812 1.127 1
1 851 . 37 1 1 A 75 75 LYS HA H 75 3.055 4.210 -1.155 1
1 860 . 37 1 1 A 75 75 LYS C C 75 177.967 179.278 -1.311 1
1 861 . 37 1 1 A 75 75 LYS CA C 75 60.029 58.751 1.278 1
1 862 . 37 1 1 A 75 75 LYS CB C 75 32.533 32.934 -0.401 1
1 866 . 37 1 1 A 75 75 LYS N N 75 119.783 118.597 1.186 1
1 867 . 37 1 1 A 76 76 SER H H 76 7.832 7.940 -0.108 1
1 868 . 37 1 1 A 76 76 SER HA H 76 4.040 4.482 -0.442 1
1 871 . 37 1 1 A 76 76 SER C C 76 177.816 177.501 0.315 1
1 872 . 37 1 1 A 76 76 SER CA C 76 62.105 61.630 0.475 1
1 873 . 37 1 1 A 76 76 SER CB C 76 62.679 63.051 -0.372 1
1 874 . 37 1 1 A 76 76 SER N N 76 113.395 114.934 -1.539 1
1 875 . 37 1 1 A 77 77 GLU H H 77 7.590 7.737 -0.147 1
1 876 . 37 1 1 A 77 77 GLU HA H 77 4.042 4.266 -0.224 1
1 881 . 37 1 1 A 77 77 GLU C C 77 177.809 178.787 -0.978 1
1 882 . 37 1 1 A 77 77 GLU CA C 77 58.270 58.830 -0.560 1
1 883 . 37 1 1 A 77 77 GLU CB C 77 29.208 29.412 -0.204 1
1 885 . 37 1 1 A 77 77 GLU N N 77 121.574 122.204 -0.630 1
1 886 . 37 1 1 A 78 78 PHE H H 78 9.081 7.931 1.150 1
1 887 . 37 1 1 A 78 78 PHE HA H 78 3.778 4.214 -0.436 1
1 895 . 37 1 1 A 78 78 PHE C C 78 178.114 177.372 0.742 1
1 896 . 37 1 1 A 78 78 PHE CA C 78 60.629 61.424 -0.795 1
1 897 . 37 1 1 A 78 78 PHE CB C 78 38.295 38.735 -0.440 1
1 902 . 37 1 1 A 78 78 PHE N N 78 122.682 122.530 0.152 1
1 903 . 37 1 1 A 79 79 PHE H H 79 8.890 8.073 0.817 1
1 904 . 37 1 1 A 79 79 PHE HA H 79 3.800 4.105 -0.305 1
1 912 . 37 1 1 A 79 79 PHE C C 79 178.354 178.439 -0.085 1
1 913 . 37 1 1 A 79 79 PHE CA C 79 60.704 61.961 -1.257 1
1 914 . 37 1 1 A 79 79 PHE CB C 79 37.184 38.375 -1.191 1
1 920 . 37 1 1 A 79 79 PHE N N 79 121.056 118.398 2.658 1
1 921 . 37 1 1 A 80 80 GLU H H 80 7.793 8.458 -0.665 1
1 922 . 37 1 1 A 80 80 GLU HA H 80 4.082 3.978 0.104 1
1 927 . 37 1 1 A 80 80 GLU C C 80 179.068 179.387 -0.319 1
1 928 . 37 1 1 A 80 80 GLU CA C 80 59.735 59.962 -0.227 1
1 929 . 37 1 1 A 80 80 GLU CB C 80 28.722 29.156 -0.434 1
1 931 . 37 1 1 A 80 80 GLU N N 80 120.312 118.483 1.829 1
1 932 . 37 1 1 A 81 81 ASN H H 81 8.624 8.584 0.040 1
1 933 . 37 1 1 A 81 81 ASN HA H 81 4.521 4.504 0.017 1
1 938 . 37 1 1 A 81 81 ASN C C 81 179.262 178.094 1.168 1
1 939 . 37 1 1 A 81 81 ASN CA C 81 55.504 56.297 -0.793 1
1 940 . 37 1 1 A 81 81 ASN CB C 81 37.517 38.143 -0.626 1
1 941 . 37 1 1 A 81 81 ASN N N 81 119.338 118.667 0.671 1
1 943 . 37 1 1 A 82 82 CYS H H 82 8.554 8.031 0.523 1
1 944 . 37 1 1 A 82 82 CYS HA H 82 3.792 3.964 -0.172 1
1 947 . 37 1 1 A 82 82 CYS C C 82 176.478 177.322 -0.844 1
1 948 . 37 1 1 A 82 82 CYS CA C 82 65.232 63.615 1.617 1
1 949 . 37 1 1 A 82 82 CYS CB C 82 26.762 26.614 0.148 1
1 950 . 37 1 1 A 82 82 CYS N N 82 120.576 117.680 2.896 1
1 951 . 37 1 1 A 83 83 ARG H H 83 8.522 8.043 0.479 1
1 952 . 37 1 1 A 83 83 ARG HA H 83 3.932 4.263 -0.331 1
1 960 . 37 1 1 A 83 83 ARG C C 83 179.138 178.637 0.501 1
1 961 . 37 1 1 A 83 83 ARG CA C 83 60.443 58.945 1.498 1
1 962 . 37 1 1 A 83 83 ARG CB C 83 29.550 29.793 -0.243 1
1 965 . 37 1 1 A 83 83 ARG N N 83 123.035 119.795 3.240 1
1 967 . 37 1 1 A 84 84 ASP H H 84 7.791 8.178 -0.387 1
1 968 . 37 1 1 A 84 84 ASP HA H 84 4.353 4.478 -0.125 1
1 971 . 37 1 1 A 84 84 ASP C C 84 178.649 178.687 -0.038 1
1 972 . 37 1 1 A 84 84 ASP CA C 84 57.767 57.529 0.238 1
1 973 . 37 1 1 A 84 84 ASP CB C 84 41.305 41.320 -0.015 1
1 974 . 37 1 1 A 84 84 ASP N N 84 120.332 119.725 0.607 1
1 975 . 37 1 1 A 85 85 THR H H 85 8.370 8.361 0.009 1
1 976 . 37 1 1 A 85 85 THR HA H 85 3.730 3.882 -0.152 1
1 981 . 37 1 1 A 85 85 THR C C 85 175.198 176.438 -1.240 1
1 982 . 37 1 1 A 85 85 THR CA C 85 66.830 66.378 0.452 1
1 983 . 37 1 1 A 85 85 THR CB C 85 68.533 68.346 0.187 1
1 985 . 37 1 1 A 85 85 THR N N 85 117.360 115.866 1.494 1
1 986 . 37 1 1 A 86 86 ALA H H 86 8.845 8.481 0.364 1
1 987 . 37 1 1 A 86 86 ALA HA H 86 3.991 4.129 -0.138 1
1 991 . 37 1 1 A 86 86 ALA C C 86 179.980 179.668 0.312 1
1 992 . 37 1 1 A 86 86 ALA CA C 86 55.769 55.754 0.015 1
1 993 . 37 1 1 A 86 86 ALA CB C 86 17.881 18.319 -0.438 1
1 994 . 37 1 1 A 86 86 ALA N N 86 123.613 123.379 0.234 1
1 995 . 37 1 1 A 87 87 LYS H H 87 7.686 7.809 -0.123 1
1 996 . 37 1 1 A 87 87 LYS HA H 87 4.099 4.027 0.072 1
1 1005 . 37 1 1 A 87 87 LYS C C 87 179.592 178.543 1.049 1
1 1006 . 37 1 1 A 87 87 LYS CA C 87 59.708 59.083 0.625 1
1 1007 . 37 1 1 A 87 87 LYS CB C 87 32.054 31.870 0.184 1
1 1011 . 37 1 1 A 87 87 LYS N N 87 119.623 116.709 2.914 1
1 1012 . 37 1 1 A 88 88 ARG H H 88 7.683 7.643 0.040 1
1 1013 . 37 1 1 A 88 88 ARG HA H 88 4.051 4.136 -0.085 1
1 1020 . 37 1 1 A 88 88 ARG C C 88 180.053 178.254 1.799 1
1 1021 . 37 1 1 A 88 88 ARG CA C 88 59.558 59.074 0.484 1
1 1022 . 37 1 1 A 88 88 ARG CB C 88 29.684 30.075 -0.391 1
1 1025 . 37 1 1 A 88 88 ARG N N 88 120.788 119.174 1.614 1
1 1026 . 37 1 1 A 89 89 ASN H H 89 8.973 8.169 0.804 1
1 1027 . 37 1 1 A 89 89 ASN HA H 89 4.354 4.635 -0.281 1
1 1032 . 37 1 1 A 89 89 ASN C C 89 178.382 178.425 -0.043 1
1 1033 . 37 1 1 A 89 89 ASN CA C 89 55.334 55.451 -0.117 1
1 1034 . 37 1 1 A 89 89 ASN CB C 89 37.864 38.559 -0.695 1
1 1035 . 37 1 1 A 89 89 ASN N N 89 121.012 116.689 4.323 1
1 1037 . 37 1 1 A 90 90 GLN H H 90 8.152 8.274 -0.122 1
1 1038 . 37 1 1 A 90 90 GLN HA H 90 4.020 4.033 -0.013 1
1 1045 . 37 1 1 A 90 90 GLN C C 90 179.075 178.692 0.383 1
1 1046 . 37 1 1 A 90 90 GLN CA C 90 59.318 58.864 0.454 1
1 1047 . 37 1 1 A 90 90 GLN CB C 90 28.049 28.196 -0.147 1
1 1049 . 37 1 1 A 90 90 GLN N N 90 122.122 120.204 1.918 1
1 1051 . 37 1 1 A 91 91 GLN H H 91 7.514 8.275 -0.761 1
1 1052 . 37 1 1 A 91 91 GLN HA H 91 4.053 4.150 -0.097 1
1 1059 . 37 1 1 A 91 91 GLN C C 91 177.081 177.109 -0.028 1
1 1060 . 37 1 1 A 91 91 GLN CA C 91 58.031 57.827 0.204 1
1 1061 . 37 1 1 A 91 91 GLN CB C 91 28.365 27.373 0.992 1
1 1063 . 37 1 1 A 91 91 GLN N N 91 118.124 117.935 0.189 1
1 1065 . 37 1 1 A 92 92 ALA H H 92 7.704 7.782 -0.078 1
1 1066 . 37 1 1 A 92 92 ALA HA H 92 4.246 4.389 -0.143 1
1 1070 . 37 1 1 A 92 92 ALA C C 92 178.450 177.985 0.465 1
1 1071 . 37 1 1 A 92 92 ALA CA C 92 52.671 51.949 0.722 1
1 1072 . 37 1 1 A 92 92 ALA CB C 92 19.316 19.754 -0.438 1
1 1073 . 37 1 1 A 92 92 ALA N N 92 119.880 121.266 -1.386 1
1 1074 . 37 1 1 A 93 93 GLY H H 93 7.693 8.017 -0.324 1
1 1075 . 37 1 1 A 93 93 GLY HA2 H 93 3.941 3.852 0.089 1
1 1076 . 37 1 1 A 93 93 GLY HA3 H 93 3.744 3.857 -0.113 1
1 1077 . 37 1 1 A 93 93 GLY C C 93 174.344 174.938 -0.594 1
1 1078 . 37 1 1 A 93 93 GLY CA C 93 45.949 46.773 -0.824 1
1 1079 . 37 1 1 A 93 93 GLY N N 93 105.347 107.034 -1.687 1
1 1080 . 37 1 1 A 94 94 ASN H H 94 7.076 8.644 -1.568 1
1 1081 . 37 1 1 A 94 94 ASN HA H 94 4.115 4.409 -0.294 1
1 1085 . 37 1 1 A 94 94 ASN C C 94 175.410 175.747 -0.337 1
1 1086 . 37 1 1 A 94 94 ASN CA C 94 52.651 52.581 0.070 1
1 1087 . 37 1 1 A 94 94 ASN CB C 94 38.330 38.742 -0.412 1
1 1088 . 37 1 1 A 94 94 ASN N N 94 115.747 117.285 -1.538 1
1 1090 . 37 1 1 A 95 95 GLY H H 95 8.236 8.560 -0.324 1
1 1091 . 37 1 1 A 95 95 GLY HA2 H 95 3.633 3.780 -0.147 1
1 1092 . 37 1 1 A 95 95 GLY HA3 H 95 3.633 3.937 -0.304 1
1 1093 . 37 1 1 A 95 95 GLY C C 95 174.450 173.899 0.551 1
1 1094 . 37 1 1 A 95 95 GLY CA C 95 45.522 45.938 -0.416 1
1 1095 . 37 1 1 A 95 95 GLY N N 95 109.166 108.110 1.056 1
1 1096 . 37 1 1 A 96 96 TRP H H 96 7.899 7.766 0.133 1
1 1097 . 37 1 1 A 96 96 TRP HA H 96 5.241 5.053 0.188 1
1 1106 . 37 1 1 A 96 96 TRP C C 96 175.661 176.038 -0.377 1
1 1107 . 37 1 1 A 96 96 TRP CA C 96 55.090 56.644 -1.554 1
1 1108 . 37 1 1 A 96 96 TRP CB C 96 27.138 31.722 -4.584 1
1 1114 . 37 1 1 A 96 96 TRP N N 96 122.840 120.062 2.778 1
1 1116 . 37 1 1 A 97 97 ASP H H 97 7.344 9.060 -1.716 1
1 1117 . 37 1 1 A 97 97 ASP HA H 97 4.829 4.380 0.449 1
1 1120 . 37 1 1 A 97 97 ASP C C 97 175.019 176.323 -1.304 1
1 1121 . 37 1 1 A 97 97 ASP CA C 97 52.149 56.380 -4.231 1
1 1122 . 37 1 1 A 97 97 ASP CB C 97 42.697 38.626 4.071 1
1 1123 . 37 1 1 A 97 97 ASP N N 97 126.861 117.143 9.718 1
1 1124 . 37 1 1 A 98 98 PHE H H 98 8.566 8.580 -0.014 1
1 1125 . 37 1 1 A 98 98 PHE HA H 98 3.727 4.254 -0.527 1
1 1133 . 37 1 1 A 98 98 PHE C C 98 177.443 177.272 0.171 1
1 1134 . 37 1 1 A 98 98 PHE CA C 98 62.471 61.368 1.103 1
1 1135 . 37 1 1 A 98 98 PHE CB C 98 39.919 39.768 0.151 1
1 1141 . 37 1 1 A 98 98 PHE N N 98 117.781 121.267 -3.486 1
1 1142 . 37 1 1 A 99 99 ASP H H 99 8.259 8.355 -0.096 1
1 1143 . 37 1 1 A 99 99 ASP HA H 99 3.960 4.660 -0.700 1
1 1146 . 37 1 1 A 99 99 ASP C C 99 178.132 178.547 -0.415 1
1 1147 . 37 1 1 A 99 99 ASP CA C 99 57.658 56.441 1.217 1
1 1148 . 37 1 1 A 99 99 ASP CB C 99 38.572 41.126 -2.554 1
1 1149 . 37 1 1 A 99 99 ASP N N 99 121.709 119.883 1.826 1
1 1150 . 37 1 1 A 100 100 MET H H 100 8.008 8.338 -0.330 1
1 1151 . 37 1 1 A 100 100 MET HA H 100 3.644 4.290 -0.646 1
1 1156 . 37 1 1 A 100 100 MET C C 100 180.008 177.085 2.923 1
1 1157 . 37 1 1 A 100 100 MET CA C 100 58.598 58.672 -0.074 1
1 1158 . 37 1 1 A 100 100 MET CB C 100 33.423 32.938 0.485 1
1 1160 . 37 1 1 A 100 100 MET N N 100 119.668 118.521 1.147 1
1 1161 . 37 1 1 A 101 101 LEU H H 101 7.961 7.960 0.001 1
1 1162 . 37 1 1 A 101 101 LEU HA H 101 3.523 4.063 -0.540 1
1 1172 . 37 1 1 A 101 101 LEU C C 101 173.873 177.488 -3.615 1
1 1173 . 37 1 1 A 101 101 LEU CA C 101 58.743 55.729 3.014 1
1 1174 . 37 1 1 A 101 101 LEU CB C 101 42.632 42.622 0.010 1
1 1178 . 37 1 1 A 101 101 LEU N N 101 119.752 119.166 0.586 1
1 1179 . 37 1 1 A 102 102 THR H H 102 6.955 9.307 -2.352 1
1 1180 . 37 1 1 A 102 102 THR HA H 102 4.134 3.810 0.324 1
1 1185 . 37 1 1 A 102 102 THR C C 102 176.513 175.028 1.485 1
1 1186 . 37 1 1 A 102 102 THR CA C 102 61.125 65.323 -4.198 1
1 1187 . 37 1 1 A 102 102 THR CB C 102 71.415 66.819 4.596 1
1 1189 . 37 1 1 A 102 102 THR N N 102 124.665 115.831 8.834 1
1 1190 . 37 1 1 A 103 103 GLY H H 103 7.816 8.862 -1.046 1
1 1191 . 37 1 1 A 103 103 GLY HA2 H 103 3.824 4.018 -0.194 1
1 1192 . 37 1 1 A 103 103 GLY HA3 H 103 3.824 4.088 -0.264 1
1 1193 . 37 1 1 A 103 103 GLY C C 103 174.126 173.660 0.466 1
1 1194 . 37 1 1 A 103 103 GLY CA C 103 47.805 46.770 1.035 1
1 1195 . 37 1 1 A 103 103 GLY N N 103 114.191 109.502 4.689 1
1 1196 . 37 1 1 A 104 104 SER H H 104 8.860 7.366 1.494 1
1 1197 . 37 1 1 A 104 104 SER HA H 104 4.758 5.050 -0.292 1
1 1200 . 37 1 1 A 104 104 SER C C 104 174.591 173.003 1.588 1
1 1201 . 37 1 1 A 104 104 SER CA C 104 56.755 57.550 -0.795 1
1 1202 . 37 1 1 A 104 104 SER CB C 104 65.050 65.385 -0.335 1
1 1203 . 37 1 1 A 104 104 SER N N 104 114.771 113.961 0.810 1
1 1204 . 37 1 1 A 105 105 GLY H H 105 8.788 8.345 0.443 1
1 1205 . 37 1 1 A 105 105 GLY HA2 H 105 3.733 4.055 -0.322 1
1 1206 . 37 1 1 A 105 105 GLY HA3 H 105 3.733 4.113 -0.380 1
1 1207 . 37 1 1 A 105 105 GLY CA C 105 47.247 45.013 2.234 1
1 1208 . 37 1 1 A 105 105 GLY N N 105 110.394 113.956 -3.562 1
1 1209 . 37 1 1 A 106 106 ASN HA H 106 4.454 4.663 -0.209 1
1 1212 . 37 1 1 A 106 106 ASN C C 106 175.180 176.406 -1.226 1
1 1213 . 37 1 1 A 106 106 ASN CA C 106 54.492 54.624 -0.132 1
1 1214 . 37 1 1 A 106 106 ASN CB C 106 37.282 39.467 -2.185 1
1 1215 . 37 1 1 A 107 107 TYR H H 107 8.241 7.526 0.715 1
1 1216 . 37 1 1 A 107 107 TYR HA H 107 4.335 4.519 -0.184 1
1 1223 . 37 1 1 A 107 107 TYR C C 107 173.954 175.783 -1.829 1
1 1224 . 37 1 1 A 107 107 TYR CA C 107 57.727 59.020 -1.293 1
1 1225 . 37 1 1 A 107 107 TYR CB C 107 37.063 38.280 -1.217 1
1 1230 . 37 1 1 A 107 107 TYR N N 107 120.708 116.613 4.095 1
1 1231 . 37 1 1 A 108 108 SER H H 108 7.117 7.498 -0.381 1
1 1232 . 37 1 1 A 108 108 SER HA H 108 4.221 4.462 -0.241 1
1 1235 . 37 1 1 A 108 108 SER C C 108 174.834 173.834 1.000 1
1 1236 . 37 1 1 A 108 108 SER CA C 108 59.859 59.121 0.738 1
1 1237 . 37 1 1 A 108 108 SER CB C 108 63.846 63.556 0.290 1
1 1238 . 37 1 1 A 108 108 SER N N 108 113.362 116.181 -2.819 1
1 1239 . 37 1 1 A 109 109 SER H H 109 8.053 8.655 -0.602 1
1 1240 . 37 1 1 A 109 109 SER HA H 109 4.560 5.001 -0.441 1
1 1243 . 37 1 1 A 109 109 SER CA C 109 57.141 57.239 -0.098 1
1 1244 . 37 1 1 A 109 109 SER CB C 109 64.874 64.931 -0.057 1
1 1245 . 37 1 1 A 109 109 SER N N 109 116.657 117.899 -1.242 1
1 1246 . 37 1 1 A 110 110 THR HA H 110 3.541 3.992 -0.451 1
1 1251 . 37 1 1 A 110 110 THR C C 110 175.477 176.022 -0.545 1
1 1252 . 37 1 1 A 110 110 THR CA C 110 66.443 65.376 1.067 1
1 1253 . 37 1 1 A 110 110 THR CB C 110 68.091 68.812 -0.721 1
1 1255 . 37 1 1 A 111 111 ASP H H 111 8.224 8.230 -0.006 1
1 1256 . 37 1 1 A 111 111 ASP HA H 111 4.237 4.432 -0.195 1
1 1259 . 37 1 1 A 111 111 ASP C C 111 177.520 177.737 -0.217 1
1 1260 . 37 1 1 A 111 111 ASP CA C 111 57.559 57.373 0.186 1
1 1261 . 37 1 1 A 111 111 ASP CB C 111 40.292 41.532 -1.240 1
1 1262 . 37 1 1 A 111 111 ASP N N 111 119.490 121.656 -2.166 1
1 1263 . 37 1 1 A 112 112 ALA H H 112 7.431 7.929 -0.498 1
1 1264 . 37 1 1 A 112 112 ALA HA H 112 4.191 4.046 0.145 1
1 1268 . 37 1 1 A 112 112 ALA C C 112 180.646 179.819 0.827 1
1 1269 . 37 1 1 A 112 112 ALA CA C 112 54.534 54.566 -0.032 1
1 1270 . 37 1 1 A 112 112 ALA CB C 112 18.992 18.294 0.698 1
1 1271 . 37 1 1 A 112 112 ALA N N 112 119.710 121.410 -1.700 1
1 1272 . 37 1 1 A 113 113 GLN H H 113 7.576 7.773 -0.197 1
1 1273 . 37 1 1 A 113 113 GLN HA H 113 3.562 4.245 -0.683 1
1 1278 . 37 1 1 A 113 113 GLN C C 113 176.756 177.913 -1.157 1
1 1279 . 37 1 1 A 113 113 GLN CA C 113 57.736 58.606 -0.870 1
1 1280 . 37 1 1 A 113 113 GLN CB C 113 29.110 28.724 0.386 1
1 1281 . 37 1 1 A 113 113 GLN N N 113 117.518 118.278 -0.760 1
1 1283 . 37 1 1 A 114 114 MET H H 114 8.192 8.342 -0.150 1
1 1284 . 37 1 1 A 114 114 MET HA H 114 4.231 4.278 -0.047 1
1 1289 . 37 1 1 A 114 114 MET C C 114 175.648 177.406 -1.758 1
1 1290 . 37 1 1 A 114 114 MET CA C 114 57.446 58.097 -0.651 1
1 1291 . 37 1 1 A 114 114 MET CB C 114 33.570 32.406 1.164 1
1 1293 . 37 1 1 A 114 114 MET N N 114 111.509 119.395 -7.886 1
1 1294 . 37 1 1 A 115 115 GLN H H 115 6.940 7.781 -0.841 1
1 1295 . 37 1 1 A 115 115 GLN HA H 115 4.307 4.328 -0.021 1
1 1302 . 37 1 1 A 115 115 GLN C C 115 176.270 174.586 1.684 1
1 1303 . 37 1 1 A 115 115 GLN CA C 115 54.680 54.955 -0.275 1
1 1304 . 37 1 1 A 115 115 GLN CB C 115 28.233 28.653 -0.420 1
1 1306 . 37 1 1 A 115 115 GLN N N 115 114.300 115.898 -1.598 1
1 1308 . 37 1 1 A 116 116 TYR H H 116 6.677 7.352 -0.675 1
1 1309 . 37 1 1 A 116 116 TYR HA H 116 4.193 4.978 -0.785 1
1 1312 . 37 1 1 A 116 116 TYR C C 116 175.268 174.668 0.600 1
1 1313 . 37 1 1 A 116 116 TYR CA C 116 54.357 57.803 -3.446 1
1 1314 . 37 1 1 A 116 116 TYR CB C 116 35.498 39.016 -3.518 1
1 1315 . 37 1 1 A 116 116 TYR N N 116 117.919 119.076 -1.157 1
1 1316 . 37 1 1 A 117 117 ASP H H 117 8.081 8.447 -0.366 1
1 1317 . 37 1 1 A 117 117 ASP HA H 117 4.665 4.750 -0.085 1
1 1320 . 37 1 1 A 117 117 ASP CA C 117 52.422 51.801 0.621 1
1 1321 . 37 1 1 A 117 117 ASP CB C 117 42.416 42.397 0.019 1
1 1322 . 37 1 1 A 117 117 ASP N N 117 120.887 123.738 -2.851 1
1 1323 . 37 1 1 A 118 118 PRO C C 118 179.180 178.902 0.278 1
1 1324 . 37 1 1 A 118 118 PRO CA C 118 65.942 65.032 0.910 1
1 1325 . 37 1 1 A 118 118 PRO CB C 118 32.197 31.918 0.279 1
1 1326 . 37 1 1 A 119 119 GLY H H 119 9.742 8.760 0.982 1
1 1327 . 37 1 1 A 119 119 GLY C C 119 175.622 175.473 0.149 1
1 1328 . 37 1 1 A 119 119 GLY CA C 119 46.785 46.846 -0.061 1
1 1329 . 37 1 1 A 119 119 GLY N N 119 106.412 106.602 -0.190 1
1 1330 . 37 1 1 A 120 120 LEU H H 120 6.666 7.661 -0.995 1
1 1331 . 37 1 1 A 120 120 LEU HA H 120 3.365 3.646 -0.281 1
1 1341 . 37 1 1 A 120 120 LEU C C 120 179.262 178.644 0.618 1
1 1342 . 37 1 1 A 120 120 LEU CA C 120 56.605 57.582 -0.977 1
1 1343 . 37 1 1 A 120 120 LEU CB C 120 39.262 41.262 -2.000 1
1 1347 . 37 1 1 A 120 120 LEU N N 120 126.226 122.522 3.704 1
1 1348 . 37 1 1 A 121 121 PHE H H 121 7.356 9.094 -1.738 1
1 1349 . 37 1 1 A 121 121 PHE HA H 121 4.459 3.976 0.483 1
1 1352 . 37 1 1 A 121 121 PHE C C 121 179.716 177.198 2.518 1
1 1353 . 37 1 1 A 121 121 PHE CA C 121 62.838 62.177 0.661 1
1 1354 . 37 1 1 A 121 121 PHE CB C 121 37.603 38.971 -1.368 1
1 1355 . 37 1 1 A 121 121 PHE N N 121 117.437 119.381 -1.944 1
1 1356 . 37 1 1 A 122 122 ALA H H 122 7.926 8.089 -0.163 1
1 1357 . 37 1 1 A 122 122 ALA HA H 122 4.523 3.934 0.589 1
1 1361 . 37 1 1 A 122 122 ALA C C 122 180.435 179.551 0.884 1
1 1362 . 37 1 1 A 122 122 ALA CA C 122 55.527 54.783 0.744 1
1 1363 . 37 1 1 A 122 122 ALA CB C 122 17.814 18.193 -0.379 1
1 1364 . 37 1 1 A 122 122 ALA N N 122 121.068 120.803 0.265 1
1 1365 . 37 1 1 A 123 123 GLN H H 123 7.507 7.743 -0.236 1
1 1366 . 37 1 1 A 123 123 GLN HA H 123 4.153 4.017 0.136 1
1 1371 . 37 1 1 A 123 123 GLN C C 123 180.561 178.303 2.258 1
1 1372 . 37 1 1 A 123 123 GLN CA C 123 59.948 58.821 1.127 1
1 1373 . 37 1 1 A 123 123 GLN CB C 123 29.135 28.530 0.605 1
1 1375 . 37 1 1 A 123 123 GLN N N 123 120.324 117.588 2.736 1
1 1376 . 37 1 1 A 124 124 ILE H H 124 8.318 8.074 0.244 1
1 1377 . 37 1 1 A 124 124 ILE HA H 124 3.635 3.859 -0.224 1
1 1387 . 37 1 1 A 124 124 ILE C C 124 176.481 177.998 -1.517 1
1 1388 . 37 1 1 A 124 124 ILE CA C 124 66.432 64.348 2.084 1
1 1389 . 37 1 1 A 124 124 ILE CB C 124 39.168 37.848 1.320 1
1 1393 . 37 1 1 A 124 124 ILE N N 124 123.747 119.106 4.641 1
1 1394 . 37 1 1 A 125 125 GLN H H 125 8.474 7.940 0.534 1
1 1395 . 37 1 1 A 125 125 GLN HA H 125 4.264 3.901 0.363 1
1 1402 . 37 1 1 A 125 125 GLN C C 125 178.947 178.089 0.858 1
1 1403 . 37 1 1 A 125 125 GLN CA C 125 59.651 58.858 0.793 1
1 1404 . 37 1 1 A 125 125 GLN CB C 125 28.880 28.120 0.760 1
1 1406 . 37 1 1 A 125 125 GLN N N 125 120.368 121.237 -0.869 1
1 1408 . 37 1 1 A 126 126 ALA H H 126 8.002 7.595 0.407 1
1 1409 . 37 1 1 A 126 126 ALA HA H 126 4.144 4.011 0.133 1
1 1413 . 37 1 1 A 126 126 ALA C C 126 179.316 179.602 -0.286 1
1 1414 . 37 1 1 A 126 126 ALA CA C 126 55.036 54.843 0.193 1
1 1415 . 37 1 1 A 126 126 ALA CB C 126 18.087 18.435 -0.348 1
1 1416 . 37 1 1 A 126 126 ALA N N 126 121.661 120.506 1.155 1
1 1417 . 37 1 1 A 127 127 ALA H H 127 7.823 8.074 -0.251 1
1 1418 . 37 1 1 A 127 127 ALA HA H 127 4.162 3.992 0.170 1
1 1422 . 37 1 1 A 127 127 ALA C C 127 180.707 179.538 1.169 1
1 1423 . 37 1 1 A 127 127 ALA CA C 127 55.080 54.883 0.197 1
1 1424 . 37 1 1 A 127 127 ALA CB C 127 19.354 18.277 1.077 1
1 1425 . 37 1 1 A 127 127 ALA N N 127 119.853 119.643 0.210 1
1 1426 . 37 1 1 A 128 128 ALA H H 128 8.936 7.853 1.083 1
1 1427 . 37 1 1 A 128 128 ALA HA H 128 3.928 3.669 0.259 1
1 1431 . 37 1 1 A 128 128 ALA C C 128 181.031 179.346 1.685 1
1 1432 . 37 1 1 A 128 128 ALA CA C 128 55.502 54.591 0.911 1
1 1433 . 37 1 1 A 128 128 ALA CB C 128 16.609 17.717 -1.108 1
1 1434 . 37 1 1 A 128 128 ALA N N 128 121.355 120.248 1.107 1
1 1435 . 37 1 1 A 129 129 THR H H 129 8.543 7.392 1.151 1
1 1436 . 37 1 1 A 129 129 THR HA H 129 4.015 3.598 0.417 1
1 1441 . 37 1 1 A 129 129 THR C C 129 177.332 176.332 1.000 1
1 1442 . 37 1 1 A 129 129 THR CA C 129 65.893 65.008 0.885 1
1 1443 . 37 1 1 A 129 129 THR CB C 129 68.566 68.438 0.128 1
1 1445 . 37 1 1 A 129 129 THR N N 129 112.709 112.171 0.538 1
1 1446 . 37 1 1 A 130 130 LYS H H 130 8.126 7.553 0.573 1
1 1447 . 37 1 1 A 130 130 LYS HA H 130 4.000 3.999 0.001 1
1 1456 . 37 1 1 A 130 130 LYS C C 130 179.082 178.592 0.490 1
1 1457 . 37 1 1 A 130 130 LYS CA C 130 60.299 58.496 1.803 1
1 1458 . 37 1 1 A 130 130 LYS CB C 130 32.767 31.908 0.859 1
1 1462 . 37 1 1 A 130 130 LYS N N 130 123.879 120.466 3.413 1
1 1463 . 37 1 1 A 131 131 ALA H H 131 7.184 7.706 -0.522 1
1 1464 . 37 1 1 A 131 131 ALA HA H 131 4.005 4.235 -0.230 1
1 1468 . 37 1 1 A 131 131 ALA C C 131 178.482 179.568 -1.086 1
1 1469 . 37 1 1 A 131 131 ALA CA C 131 55.027 55.213 -0.186 1
1 1470 . 37 1 1 A 131 131 ALA CB C 131 18.669 19.323 -0.654 1
1 1471 . 37 1 1 A 131 131 ALA N N 131 118.590 121.218 -2.628 1
1 1472 . 37 1 1 A 132 132 TRP H H 132 7.977 8.575 -0.598 1
1 1473 . 37 1 1 A 132 132 TRP HA H 132 4.001 4.314 -0.313 1
1 1480 . 37 1 1 A 132 132 TRP C C 132 177.332 175.694 1.638 1
1 1481 . 37 1 1 A 132 132 TRP CA C 132 60.431 57.405 3.026 1
1 1482 . 37 1 1 A 132 132 TRP CB C 132 27.786 27.696 0.090 1
1 1486 . 37 1 1 A 132 132 TRP N N 132 119.168 116.969 2.199 1
1 1488 . 37 1 1 A 133 133 ARG H H 133 8.006 8.064 -0.058 1
1 1489 . 37 1 1 A 133 133 ARG HA H 133 4.027 4.282 -0.255 1
1 1497 . 37 1 1 A 133 133 ARG C C 133 176.664 178.731 -2.067 1
1 1498 . 37 1 1 A 133 133 ARG CA C 133 59.355 57.380 1.975 1
1 1499 . 37 1 1 A 133 133 ARG CB C 133 30.451 31.972 -1.521 1
1 1502 . 37 1 1 A 133 133 ARG N N 133 113.062 120.953 -7.891 1
1 1504 . 37 1 1 A 134 134 LYS H H 134 7.322 7.681 -0.359 1
1 1505 . 37 1 1 A 134 134 LYS HA H 134 4.313 4.360 -0.047 1
1 1514 . 37 1 1 A 134 134 LYS C C 134 176.282 176.570 -0.288 1
1 1515 . 37 1 1 A 134 134 LYS CA C 134 54.922 57.644 -2.722 1
1 1516 . 37 1 1 A 134 134 LYS CB C 134 32.633 32.253 0.380 1
1 1520 . 37 1 1 A 134 134 LYS N N 134 118.170 118.597 -0.427 1
1 1521 . 37 1 1 A 135 135 LEU H H 135 7.440 7.494 -0.054 1
1 1522 . 37 1 1 A 135 135 LEU HA H 135 4.174 4.594 -0.420 1
1 1532 . 37 1 1 A 135 135 LEU CA C 135 54.408 52.821 1.587 1
1 1533 . 37 1 1 A 135 135 LEU CB C 135 40.407 42.362 -1.955 1
1 1537 . 37 1 1 A 135 135 LEU N N 135 123.358 116.845 6.513 1
1 1538 . 37 1 1 A 136 136 PRO HA H 136 4.437 4.519 -0.082 1
1 1545 . 37 1 1 A 136 136 PRO C C 136 177.106 177.125 -0.019 1
1 1546 . 37 1 1 A 136 136 PRO CA C 136 62.889 62.743 0.146 1
1 1547 . 37 1 1 A 136 136 PRO CB C 136 32.192 32.280 -0.088 1
1 1550 . 37 1 1 A 137 137 VAL H H 137 8.219 8.445 -0.226 1
1 1551 . 37 1 1 A 137 137 VAL HA H 137 4.077 4.412 -0.335 1
1 1559 . 37 1 1 A 137 137 VAL C C 137 176.305 175.912 0.393 1
1 1560 . 37 1 1 A 137 137 VAL CA C 137 61.958 63.103 -1.145 1
1 1561 . 37 1 1 A 137 137 VAL CB C 137 32.755 32.489 0.266 1
1 1564 . 37 1 1 A 137 137 VAL N N 137 120.079 122.094 -2.015 1
1 1565 . 37 1 1 A 138 138 LYS H H 138 8.444 8.275 0.169 1
1 1566 . 37 1 1 A 138 138 LYS HA H 138 4.316 4.387 -0.071 1
1 1575 . 37 1 1 A 138 138 LYS C C 138 176.790 176.718 0.072 1
1 1576 . 37 1 1 A 138 138 LYS CA C 138 56.792 55.813 0.979 1
1 1577 . 37 1 1 A 138 138 LYS CB C 138 33.205 30.768 2.437 1
1 1581 . 37 1 1 A 138 138 LYS N N 138 126.449 125.312 1.137 1
1 1582 . 37 1 1 A 139 139 GLY H H 139 8.518 8.384 0.134 1
1 1583 . 37 1 1 A 139 139 GLY HA2 H 139 4.070 4.106 -0.036 1
1 1584 . 37 1 1 A 139 139 GLY HA3 H 139 3.897 4.109 -0.212 1
1 1585 . 37 1 1 A 139 139 GLY C C 139 172.874 173.028 -0.154 1
1 1586 . 37 1 1 A 139 139 GLY CA C 139 45.157 45.657 -0.500 1
1 1587 . 37 1 1 A 139 139 GLY N N 139 112.617 110.851 1.766 1
1 6 . 38 1 1 A 2 2 VAL H H 2 8.992 8.082 0.910 1
1 7 . 38 1 1 A 2 2 VAL HA H 2 5.370 4.688 0.682 1
1 15 . 38 1 1 A 2 2 VAL C C 2 174.325 174.279 0.046 1
1 16 . 38 1 1 A 2 2 VAL CA C 2 61.267 60.597 0.670 1
1 17 . 38 1 1 A 2 2 VAL CB C 2 33.890 34.577 -0.687 1
1 20 . 38 1 1 A 2 2 VAL N N 2 126.939 117.693 9.246 1
1 21 . 38 1 1 A 3 3 THR H H 3 8.912 8.637 0.275 1
1 22 . 38 1 1 A 3 3 THR HA H 3 4.505 5.417 -0.912 1
1 27 . 38 1 1 A 3 3 THR C C 3 172.710 172.652 0.058 1
1 28 . 38 1 1 A 3 3 THR CA C 3 59.689 59.635 0.054 1
1 29 . 38 1 1 A 3 3 THR CB C 3 72.398 72.397 0.001 1
1 31 . 38 1 1 A 3 3 THR N N 3 118.091 121.836 -3.745 1
1 32 . 38 1 1 A 4 4 GLU H H 4 8.631 9.005 -0.374 1
1 33 . 38 1 1 A 4 4 GLU HA H 4 5.788 5.004 0.784 1
1 38 . 38 1 1 A 4 4 GLU C C 4 175.758 174.179 1.579 1
1 39 . 38 1 1 A 4 4 GLU CA C 4 54.902 54.530 0.372 1
1 40 . 38 1 1 A 4 4 GLU CB C 4 35.097 33.217 1.880 1
1 42 . 38 1 1 A 4 4 GLU N N 4 120.966 124.600 -3.634 1
1 43 . 38 1 1 A 5 5 THR H H 5 9.188 9.294 -0.106 1
1 44 . 38 1 1 A 5 5 THR HA H 5 4.739 4.828 -0.089 1
1 49 . 38 1 1 A 5 5 THR C C 5 172.757 173.160 -0.403 1
1 50 . 38 1 1 A 5 5 THR CA C 5 60.382 59.480 0.902 1
1 51 . 38 1 1 A 5 5 THR CB C 5 71.558 70.901 0.657 1
1 53 . 38 1 1 A 5 5 THR N N 5 119.366 119.147 0.219 1
1 54 . 38 1 1 A 6 6 VAL H H 6 8.476 8.629 -0.153 1
1 55 . 38 1 1 A 6 6 VAL HA H 6 5.026 5.454 -0.428 1
1 63 . 38 1 1 A 6 6 VAL C C 6 176.674 174.798 1.876 1
1 64 . 38 1 1 A 6 6 VAL CA C 6 61.008 60.999 0.009 1
1 65 . 38 1 1 A 6 6 VAL CB C 6 33.861 35.299 -1.438 1
1 68 . 38 1 1 A 6 6 VAL N N 6 121.384 121.986 -0.602 1
1 69 . 38 1 1 A 7 7 ASP H H 7 8.848 9.062 -0.214 1
1 70 . 38 1 1 A 7 7 ASP HA H 7 4.797 4.776 0.021 1
1 73 . 38 1 1 A 7 7 ASP CA C 7 52.834 54.719 -1.885 1
1 74 . 38 1 1 A 7 7 ASP CB C 7 42.219 42.322 -0.103 1
1 75 . 38 1 1 A 7 7 ASP N N 7 127.061 127.231 -0.170 1
1 76 . 38 1 1 A 8 8 GLY C C 8 175.143 174.486 0.657 1
1 77 . 38 1 1 A 8 8 GLY CA C 8 46.553 46.775 -0.222 1
1 78 . 38 1 1 A 9 9 GLN H H 9 8.408 7.567 0.841 1
1 79 . 38 1 1 A 9 9 GLN HA H 9 4.541 4.250 0.291 1
1 86 . 38 1 1 A 9 9 GLN C C 9 176.463 176.915 -0.452 1
1 87 . 38 1 1 A 9 9 GLN CA C 9 55.167 55.220 -0.053 1
1 88 . 38 1 1 A 9 9 GLN CB C 9 29.376 27.977 1.399 1
1 90 . 38 1 1 A 9 9 GLN N N 9 118.300 116.789 1.511 1
1 92 . 38 1 1 A 10 10 GLY H H 10 8.162 8.525 -0.363 1
1 93 . 38 1 1 A 10 10 GLY HA2 H 10 4.174 3.896 0.278 1
1 94 . 38 1 1 A 10 10 GLY HA3 H 10 3.521 3.912 -0.391 1
1 95 . 38 1 1 A 10 10 GLY C C 10 174.092 174.503 -0.411 1
1 96 . 38 1 1 A 10 10 GLY CA C 10 45.558 45.884 -0.326 1
1 97 . 38 1 1 A 10 10 GLY N N 10 108.747 110.283 -1.536 1
1 98 . 38 1 1 A 11 11 GLN H H 11 8.507 7.927 0.580 1
1 99 . 38 1 1 A 11 11 GLN HA H 11 4.202 4.525 -0.323 1
1 106 . 38 1 1 A 11 11 GLN C C 11 173.992 174.810 -0.818 1
1 107 . 38 1 1 A 11 11 GLN CA C 11 55.098 55.279 -0.181 1
1 108 . 38 1 1 A 11 11 GLN CB C 11 29.097 29.805 -0.708 1
1 110 . 38 1 1 A 11 11 GLN N N 11 122.979 119.178 3.801 1
1 112 . 38 1 1 A 12 12 ALA H H 12 8.259 8.529 -0.270 1
1 113 . 38 1 1 A 12 12 ALA HA H 12 5.156 5.961 -0.805 1
1 117 . 38 1 1 A 12 12 ALA C C 12 177.284 176.455 0.829 1
1 118 . 38 1 1 A 12 12 ALA CA C 12 51.087 50.712 0.375 1
1 119 . 38 1 1 A 12 12 ALA CB C 12 20.500 20.858 -0.358 1
1 120 . 38 1 1 A 12 12 ALA N N 12 127.100 123.403 3.697 1
1 121 . 38 1 1 A 13 13 TRP H H 13 9.245 8.987 0.258 1
1 122 . 38 1 1 A 13 13 TRP HA H 13 4.717 5.325 -0.608 1
1 131 . 38 1 1 A 13 13 TRP C C 13 175.108 174.164 0.944 1
1 132 . 38 1 1 A 13 13 TRP CA C 13 55.966 55.554 0.412 1
1 133 . 38 1 1 A 13 13 TRP CB C 13 31.912 32.150 -0.238 1
1 139 . 38 1 1 A 13 13 TRP N N 13 123.088 119.715 3.373 1
1 141 . 38 1 1 A 14 14 ARG H H 14 8.575 8.623 -0.048 1
1 142 . 38 1 1 A 14 14 ARG HA H 14 5.335 4.264 1.071 1
1 150 . 38 1 1 A 14 14 ARG C C 14 175.191 173.998 1.193 1
1 151 . 38 1 1 A 14 14 ARG CA C 14 53.106 54.945 -1.839 1
1 152 . 38 1 1 A 14 14 ARG CB C 14 32.749 31.352 1.397 1
1 154 . 38 1 1 A 14 14 ARG N N 14 121.163 120.272 0.891 1
1 156 . 38 1 1 A 15 15 HIS H H 15 8.595 7.895 0.700 1
1 157 . 38 1 1 A 15 15 HIS HA H 15 4.790 5.069 -0.279 1
1 161 . 38 1 1 A 15 15 HIS C C 15 173.770 173.825 -0.055 1
1 162 . 38 1 1 A 15 15 HIS CA C 15 55.289 54.509 0.780 1
1 163 . 38 1 1 A 15 15 HIS CB C 15 33.208 33.944 -0.736 1
1 165 . 38 1 1 A 15 15 HIS N N 15 117.643 117.901 -0.258 1
1 166 . 38 1 1 A 16 16 HIS H H 16 8.993 8.996 -0.003 1
1 167 . 38 1 1 A 16 16 HIS HA H 16 5.158 5.163 -0.005 1
1 171 . 38 1 1 A 16 16 HIS C C 16 173.608 175.134 -1.526 1
1 172 . 38 1 1 A 16 16 HIS CA C 16 56.450 55.085 1.365 1
1 173 . 38 1 1 A 16 16 HIS CB C 16 34.171 31.274 2.897 1
1 175 . 38 1 1 A 16 16 HIS N N 16 123.520 118.102 5.418 1
1 176 . 38 1 1 A 17 17 ASN H H 17 7.829 9.561 -1.732 1
1 177 . 38 1 1 A 17 17 ASN HA H 17 4.713 5.383 -0.670 1
1 182 . 38 1 1 A 17 17 ASN C C 17 173.682 175.281 -1.599 1
1 183 . 38 1 1 A 17 17 ASN CA C 17 51.822 51.784 0.038 1
1 184 . 38 1 1 A 17 17 ASN CB C 17 43.176 42.021 1.155 1
1 185 . 38 1 1 A 17 17 ASN N N 17 122.213 120.892 1.321 1
1 187 . 38 1 1 A 18 18 GLY H H 18 8.423 8.321 0.102 1
1 188 . 38 1 1 A 18 18 GLY HA2 H 18 3.931 3.871 0.060 1
1 189 . 38 1 1 A 18 18 GLY HA3 H 18 3.707 3.927 -0.220 1
1 190 . 38 1 1 A 18 18 GLY C C 18 173.985 173.326 0.659 1
1 191 . 38 1 1 A 18 18 GLY CA C 18 43.949 43.857 0.092 1
1 192 . 38 1 1 A 18 18 GLY N N 18 106.991 106.936 0.055 1
1 193 . 38 1 1 A 19 19 PHE H H 19 8.338 7.941 0.397 1
1 194 . 38 1 1 A 19 19 PHE HA H 19 4.068 4.911 -0.843 1
1 197 . 38 1 1 A 19 19 PHE C C 19 176.568 174.958 1.610 1
1 198 . 38 1 1 A 19 19 PHE CA C 19 59.338 58.539 0.799 1
1 199 . 38 1 1 A 19 19 PHE CB C 19 40.201 39.676 0.525 1
1 200 . 38 1 1 A 19 19 PHE N N 19 116.857 120.096 -3.239 1
1 201 . 38 1 1 A 20 20 ASP H H 20 8.794 8.754 0.040 1
1 202 . 38 1 1 A 20 20 ASP HA H 20 4.485 4.806 -0.321 1
1 205 . 38 1 1 A 20 20 ASP C C 20 177.379 176.239 1.140 1
1 206 . 38 1 1 A 20 20 ASP CA C 20 54.140 53.245 0.895 1
1 207 . 38 1 1 A 20 20 ASP CB C 20 41.915 40.955 0.960 1
1 208 . 38 1 1 A 20 20 ASP N N 20 123.025 124.526 -1.501 1
1 209 . 38 1 1 A 21 21 PHE H H 21 8.862 9.039 -0.177 1
1 210 . 38 1 1 A 21 21 PHE HA H 21 4.087 4.011 0.076 1
1 218 . 38 1 1 A 21 21 PHE C C 21 176.952 177.096 -0.144 1
1 219 . 38 1 1 A 21 21 PHE CA C 21 61.095 62.461 -1.366 1
1 220 . 38 1 1 A 21 21 PHE CB C 21 38.678 39.703 -1.025 1
1 226 . 38 1 1 A 21 21 PHE N N 21 127.163 127.337 -0.174 1
1 227 . 38 1 1 A 22 22 ALA H H 22 8.561 8.273 0.288 1
1 228 . 38 1 1 A 22 22 ALA HA H 22 3.878 3.942 -0.064 1
1 232 . 38 1 1 A 22 22 ALA C C 22 180.710 179.877 0.833 1
1 233 . 38 1 1 A 22 22 ALA CA C 22 55.211 55.194 0.017 1
1 234 . 38 1 1 A 22 22 ALA CB C 22 18.321 18.476 -0.155 1
1 235 . 38 1 1 A 22 22 ALA N N 22 120.293 121.000 -0.707 1
1 236 . 38 1 1 A 23 23 VAL H H 23 7.241 8.047 -0.806 1
1 237 . 38 1 1 A 23 23 VAL HA H 23 3.684 3.503 0.181 1
1 245 . 38 1 1 A 23 23 VAL C C 23 177.101 178.015 -0.914 1
1 246 . 38 1 1 A 23 23 VAL CA C 23 65.237 66.946 -1.709 1
1 247 . 38 1 1 A 23 23 VAL CB C 23 31.780 31.611 0.169 1
1 250 . 38 1 1 A 23 23 VAL N N 23 118.775 117.823 0.952 1
1 251 . 38 1 1 A 24 24 ILE H H 24 6.761 7.994 -1.233 1
1 252 . 38 1 1 A 24 24 ILE HA H 24 3.196 3.561 -0.365 1
1 262 . 38 1 1 A 24 24 ILE C C 24 177.287 178.601 -1.314 1
1 263 . 38 1 1 A 24 24 ILE CA C 24 63.404 65.677 -2.273 1
1 264 . 38 1 1 A 24 24 ILE CB C 24 36.294 37.605 -1.311 1
1 268 . 38 1 1 A 24 24 ILE N N 24 119.036 119.262 -0.226 1
1 269 . 38 1 1 A 25 25 LYS H H 25 8.032 7.962 0.070 1
1 270 . 38 1 1 A 25 25 LYS HA H 25 3.809 3.615 0.194 1
1 279 . 38 1 1 A 25 25 LYS C C 25 179.450 179.176 0.274 1
1 280 . 38 1 1 A 25 25 LYS CA C 25 59.621 59.031 0.590 1
1 281 . 38 1 1 A 25 25 LYS CB C 25 32.259 31.785 0.474 1
1 285 . 38 1 1 A 25 25 LYS N N 25 118.368 120.571 -2.203 1
1 286 . 38 1 1 A 26 26 GLU H H 26 7.845 8.076 -0.231 1
1 287 . 38 1 1 A 26 26 GLU HA H 26 4.021 4.278 -0.257 1
1 292 . 38 1 1 A 26 26 GLU C C 26 179.191 179.449 -0.258 1
1 293 . 38 1 1 A 26 26 GLU CA C 26 59.530 58.993 0.537 1
1 294 . 38 1 1 A 26 26 GLU CB C 26 29.449 29.656 -0.207 1
1 296 . 38 1 1 A 26 26 GLU N N 26 120.522 120.392 0.130 1
1 297 . 38 1 1 A 27 27 LEU H H 27 8.165 8.146 0.019 1
1 298 . 38 1 1 A 27 27 LEU HA H 27 4.163 4.129 0.034 1
1 308 . 38 1 1 A 27 27 LEU C C 27 177.256 178.302 -1.046 1
1 309 . 38 1 1 A 27 27 LEU CA C 27 58.049 57.752 0.297 1
1 310 . 38 1 1 A 27 27 LEU CB C 27 41.365 41.758 -0.393 1
1 314 . 38 1 1 A 27 27 LEU N N 27 120.879 121.316 -0.437 1
1 315 . 38 1 1 A 28 28 LYS H H 28 8.902 8.086 0.816 1
1 316 . 38 1 1 A 28 28 LYS HA H 28 4.199 4.183 0.016 1
1 317 . 38 1 1 A 28 28 LYS C C 28 179.707 179.032 0.675 1
1 318 . 38 1 1 A 28 28 LYS CA C 28 60.097 59.206 0.891 1
1 319 . 38 1 1 A 28 28 LYS CB C 28 33.420 31.853 1.567 1
1 320 . 38 1 1 A 28 28 LYS N N 28 120.050 119.583 0.467 1
1 321 . 38 1 1 A 29 29 THR H H 29 8.294 7.972 0.322 1
1 322 . 38 1 1 A 29 29 THR HA H 29 3.892 3.926 -0.034 1
1 327 . 38 1 1 A 29 29 THR C C 29 175.711 176.553 -0.842 1
1 328 . 38 1 1 A 29 29 THR CA C 29 66.846 66.640 0.206 1
1 329 . 38 1 1 A 29 29 THR CB C 29 68.794 68.669 0.125 1
1 331 . 38 1 1 A 29 29 THR N N 29 115.933 116.768 -0.835 1
1 332 . 38 1 1 A 30 30 ALA H H 30 8.244 8.396 -0.152 1
1 333 . 38 1 1 A 30 30 ALA HA H 30 4.241 4.161 0.080 1
1 337 . 38 1 1 A 30 30 ALA C C 30 179.128 179.343 -0.215 1
1 338 . 38 1 1 A 30 30 ALA CA C 30 55.714 55.703 0.011 1
1 339 . 38 1 1 A 30 30 ALA CB C 30 18.955 18.199 0.756 1
1 340 . 38 1 1 A 30 30 ALA N N 30 124.617 123.207 1.410 1
1 341 . 38 1 1 A 31 31 ALA H H 31 8.968 8.836 0.132 1
1 342 . 38 1 1 A 31 31 ALA HA H 31 3.890 4.081 -0.191 1
1 346 . 38 1 1 A 31 31 ALA C C 31 180.352 179.337 1.015 1
1 347 . 38 1 1 A 31 31 ALA CA C 31 55.454 55.420 0.034 1
1 348 . 38 1 1 A 31 31 ALA CB C 31 17.124 18.248 -1.124 1
1 349 . 38 1 1 A 31 31 ALA N N 31 119.327 120.307 -0.980 1
1 350 . 38 1 1 A 32 32 SER H H 32 7.995 7.831 0.164 1
1 351 . 38 1 1 A 32 32 SER HA H 32 4.238 4.189 0.049 1
1 354 . 38 1 1 A 32 32 SER C C 32 175.612 177.401 -1.789 1
1 355 . 38 1 1 A 32 32 SER CA C 32 61.203 61.503 -0.300 1
1 356 . 38 1 1 A 32 32 SER CB C 32 63.406 62.983 0.423 1
1 357 . 38 1 1 A 32 32 SER N N 32 111.962 113.773 -1.811 1
1 358 . 38 1 1 A 33 33 GLN H H 33 8.333 7.797 0.536 1
1 359 . 38 1 1 A 33 33 GLN HA H 33 3.992 4.093 -0.101 1
1 366 . 38 1 1 A 33 33 GLN C C 33 177.486 177.943 -0.457 1
1 367 . 38 1 1 A 33 33 GLN CA C 33 58.277 58.474 -0.197 1
1 368 . 38 1 1 A 33 33 GLN CB C 33 29.140 29.122 0.018 1
1 370 . 38 1 1 A 33 33 GLN N N 33 119.527 120.643 -1.116 1
1 372 . 38 1 1 A 34 34 TYR H H 34 8.587 8.355 0.232 1
1 373 . 38 1 1 A 34 34 TYR HA H 34 4.792 4.489 0.303 1
1 380 . 38 1 1 A 34 34 TYR C C 34 176.499 176.762 -0.263 1
1 381 . 38 1 1 A 34 34 TYR CA C 34 57.711 59.913 -2.202 1
1 382 . 38 1 1 A 34 34 TYR CB C 34 39.561 39.075 0.486 1
1 387 . 38 1 1 A 34 34 TYR N N 34 114.610 116.755 -2.145 1
1 388 . 38 1 1 A 35 35 GLY H H 35 7.346 8.381 -1.035 1
1 389 . 38 1 1 A 35 35 GLY HA2 H 35 4.785 4.122 0.663 1
1 390 . 38 1 1 A 35 35 GLY HA3 H 35 4.007 4.128 -0.121 1
1 391 . 38 1 1 A 35 35 GLY C C 35 175.796 173.546 2.250 1
1 392 . 38 1 1 A 35 35 GLY CA C 35 44.355 44.916 -0.561 1
1 393 . 38 1 1 A 35 35 GLY N N 35 108.501 107.059 1.442 1
1 394 . 38 1 1 A 36 36 ALA H H 36 9.363 8.317 1.046 1
1 395 . 38 1 1 A 36 36 ALA HA H 36 4.217 4.548 -0.331 1
1 399 . 38 1 1 A 36 36 ALA C C 36 178.039 178.136 -0.097 1
1 400 . 38 1 1 A 36 36 ALA CA C 36 56.114 51.502 4.612 1
1 401 . 38 1 1 A 36 36 ALA CB C 36 19.179 20.011 -0.832 1
1 402 . 38 1 1 A 36 36 ALA N N 36 125.811 124.931 0.880 1
1 403 . 38 1 1 A 37 37 THR H H 37 8.070 8.610 -0.540 1
1 404 . 38 1 1 A 37 37 THR HA H 37 4.570 4.004 0.566 1
1 409 . 38 1 1 A 37 37 THR C C 37 173.685 173.812 -0.127 1
1 410 . 38 1 1 A 37 37 THR CA C 37 59.822 64.224 -4.402 1
1 411 . 38 1 1 A 37 37 THR CB C 37 68.267 67.130 1.137 1
1 413 . 38 1 1 A 37 37 THR N N 37 129.410 108.794 20.616 1
1 414 . 38 1 1 A 38 38 ALA H H 38 6.853 7.795 -0.942 1
1 415 . 38 1 1 A 38 38 ALA HA H 38 4.601 4.637 -0.036 1
1 419 . 38 1 1 A 38 38 ALA CA C 38 50.758 49.636 1.122 1
1 420 . 38 1 1 A 38 38 ALA CB C 38 18.325 20.039 -1.714 1
1 421 . 38 1 1 A 38 38 ALA N N 38 124.674 123.829 0.845 1
1 422 . 38 1 1 A 40 40 TYR HA H 40 4.032 3.999 0.033 1
1 429 . 38 1 1 A 40 40 TYR C C 40 176.456 177.166 -0.710 1
1 430 . 38 1 1 A 40 40 TYR CA C 40 61.010 61.775 -0.765 1
1 431 . 38 1 1 A 40 40 TYR CB C 40 39.286 38.580 0.706 1
1 436 . 38 1 1 A 41 41 THR H H 41 6.874 8.199 -1.325 1
1 437 . 38 1 1 A 41 41 THR HA H 41 3.616 3.901 -0.285 1
1 442 . 38 1 1 A 41 41 THR C C 41 176.930 177.239 -0.309 1
1 443 . 38 1 1 A 41 41 THR CA C 41 65.557 66.812 -1.255 1
1 444 . 38 1 1 A 41 41 THR CB C 41 68.228 68.457 -0.229 1
1 446 . 38 1 1 A 41 41 THR N N 41 115.143 113.833 1.310 1
1 447 . 38 1 1 A 42 42 LEU H H 42 8.623 7.903 0.720 1
1 448 . 38 1 1 A 42 42 LEU HA H 42 3.708 4.120 -0.412 1
1 458 . 38 1 1 A 42 42 LEU C C 42 178.206 179.204 -0.998 1
1 459 . 38 1 1 A 42 42 LEU CA C 42 57.417 57.622 -0.205 1
1 460 . 38 1 1 A 42 42 LEU CB C 42 41.342 41.269 0.073 1
1 464 . 38 1 1 A 42 42 LEU N N 42 120.418 117.624 2.794 1
1 465 . 38 1 1 A 43 43 ALA H H 43 7.735 7.747 -0.012 1
1 466 . 38 1 1 A 43 43 ALA HA H 43 4.020 4.003 0.017 1
1 470 . 38 1 1 A 43 43 ALA C C 43 180.826 180.337 0.489 1
1 471 . 38 1 1 A 43 43 ALA CA C 43 54.925 54.897 0.028 1
1 472 . 38 1 1 A 43 43 ALA CB C 43 17.506 18.263 -0.757 1
1 473 . 38 1 1 A 43 43 ALA N N 43 120.203 121.909 -1.706 1
1 474 . 38 1 1 A 44 44 ILE H H 44 7.149 7.400 -0.251 1
1 475 . 38 1 1 A 44 44 ILE HA H 44 3.603 3.534 0.069 1
1 485 . 38 1 1 A 44 44 ILE C C 44 178.594 178.005 0.589 1
1 486 . 38 1 1 A 44 44 ILE CA C 44 64.782 64.629 0.153 1
1 487 . 38 1 1 A 44 44 ILE CB C 44 37.472 37.591 -0.119 1
1 491 . 38 1 1 A 44 44 ILE N N 44 118.881 119.818 -0.937 1
1 492 . 38 1 1 A 45 45 VAL H H 45 7.968 7.603 0.365 1
1 493 . 38 1 1 A 45 45 VAL HA H 45 2.925 3.340 -0.415 1
1 501 . 38 1 1 A 45 45 VAL C C 45 177.023 177.743 -0.720 1
1 502 . 38 1 1 A 45 45 VAL CA C 45 67.081 67.109 -0.028 1
1 503 . 38 1 1 A 45 45 VAL CB C 45 30.854 31.265 -0.411 1
1 506 . 38 1 1 A 45 45 VAL N N 45 120.764 119.714 1.050 1
1 507 . 38 1 1 A 46 46 GLU H H 46 8.399 8.217 0.182 1
1 508 . 38 1 1 A 46 46 GLU HA H 46 3.848 3.998 -0.150 1
1 513 . 38 1 1 A 46 46 GLU C C 46 178.656 178.637 0.019 1
1 514 . 38 1 1 A 46 46 GLU CA C 46 59.491 58.632 0.859 1
1 515 . 38 1 1 A 46 46 GLU CB C 46 28.991 28.049 0.942 1
1 517 . 38 1 1 A 46 46 GLU N N 46 116.599 119.627 -3.028 1
1 518 . 38 1 1 A 47 47 SER H H 47 7.273 7.336 -0.063 1
1 519 . 38 1 1 A 47 47 SER HA H 47 4.287 4.253 0.034 1
1 521 . 38 1 1 A 47 47 SER CA C 47 61.047 61.089 -0.042 1
1 522 . 38 1 1 A 47 47 SER CB C 47 63.016 62.748 0.268 1
1 523 . 38 1 1 A 47 47 SER N N 47 113.609 116.495 -2.886 1
1 524 . 38 1 1 A 48 48 VAL H H 48 8.006 8.484 -0.478 1
1 525 . 38 1 1 A 48 48 VAL HA H 48 3.556 3.527 0.029 1
1 533 . 38 1 1 A 48 48 VAL C C 48 177.257 177.856 -0.599 1
1 534 . 38 1 1 A 48 48 VAL CA C 48 65.025 66.519 -1.494 1
1 535 . 38 1 1 A 48 48 VAL CB C 48 31.841 31.457 0.384 1
1 538 . 38 1 1 A 48 48 VAL N N 48 122.327 121.591 0.736 1
1 539 . 38 1 1 A 49 49 ALA H H 49 8.369 7.785 0.584 1
1 540 . 38 1 1 A 49 49 ALA HA H 49 4.115 4.334 -0.219 1
1 544 . 38 1 1 A 49 49 ALA C C 49 177.307 178.079 -0.772 1
1 545 . 38 1 1 A 49 49 ALA CA C 49 53.253 53.647 -0.394 1
1 546 . 38 1 1 A 49 49 ALA CB C 49 20.131 18.249 1.882 1
1 547 . 38 1 1 A 49 49 ALA N N 49 118.050 121.150 -3.100 1
1 548 . 38 1 1 A 50 50 ASP H H 50 7.052 7.795 -0.743 1
1 549 . 38 1 1 A 50 50 ASP HA H 50 4.788 4.593 0.195 1
1 552 . 38 1 1 A 50 50 ASP C C 50 175.481 176.040 -0.559 1
1 553 . 38 1 1 A 50 50 ASP CA C 50 53.681 55.229 -1.548 1
1 554 . 38 1 1 A 50 50 ASP CB C 50 39.333 41.036 -1.703 1
1 555 . 38 1 1 A 50 50 ASP N N 50 116.997 117.637 -0.640 1
1 556 . 38 1 1 A 51 51 ASN H H 51 8.535 7.718 0.817 1
1 557 . 38 1 1 A 51 51 ASN HA H 51 4.628 4.679 -0.051 1
1 562 . 38 1 1 A 51 51 ASN C C 51 174.077 175.193 -1.116 1
1 563 . 38 1 1 A 51 51 ASN CA C 51 52.315 51.789 0.526 1
1 564 . 38 1 1 A 51 51 ASN CB C 51 41.928 39.564 2.364 1
1 565 . 38 1 1 A 51 51 ASN N N 51 118.626 117.323 1.303 1
1 567 . 38 1 1 A 52 52 TRP H H 52 8.555 8.304 0.251 1
1 574 . 38 1 1 A 52 52 TRP C C 52 173.269 176.519 -3.250 1
1 575 . 38 1 1 A 52 52 TRP CA C 52 55.031 57.956 -2.925 1
1 576 . 38 1 1 A 52 52 TRP CB C 52 26.801 29.277 -2.476 1
1 582 . 38 1 1 A 52 52 TRP N N 52 120.693 121.591 -0.898 1
1 584 . 38 1 1 A 53 53 LEU H H 53 7.847 9.160 -1.313 1
1 585 . 38 1 1 A 53 53 LEU HA H 53 4.859 5.155 -0.296 1
1 595 . 38 1 1 A 53 53 LEU C C 53 177.397 175.522 1.875 1
1 596 . 38 1 1 A 53 53 LEU CA C 53 53.619 53.319 0.300 1
1 597 . 38 1 1 A 53 53 LEU CB C 53 41.812 46.117 -4.305 1
1 601 . 38 1 1 A 53 53 LEU N N 53 124.741 120.768 3.973 1
1 602 . 38 1 1 A 54 54 THR H H 54 8.850 8.464 0.386 1
1 603 . 38 1 1 A 54 54 THR HA H 54 4.598 4.818 -0.220 1
1 608 . 38 1 1 A 54 54 THR CA C 54 60.531 59.207 1.324 1
1 609 . 38 1 1 A 54 54 THR CB C 54 67.183 69.435 -2.252 1
1 611 . 38 1 1 A 54 54 THR N N 54 113.407 111.418 1.989 1
1 612 . 38 1 1 A 55 55 PRO HA H 55 4.511 4.288 0.223 1
1 619 . 38 1 1 A 55 55 PRO C C 55 179.383 177.680 1.703 1
1 620 . 38 1 1 A 55 55 PRO CA C 55 67.159 65.442 1.717 1
1 621 . 38 1 1 A 55 55 PRO CB C 55 32.095 31.796 0.299 1
1 622 . 38 1 1 A 56 56 THR H H 56 8.575 7.715 0.860 1
1 623 . 38 1 1 A 56 56 THR HA H 56 4.229 4.183 0.046 1
1 628 . 38 1 1 A 56 56 THR C C 56 176.668 176.456 0.212 1
1 629 . 38 1 1 A 56 56 THR CA C 56 66.943 65.145 1.798 1
1 630 . 38 1 1 A 56 56 THR CB C 56 68.129 68.920 -0.791 1
1 632 . 38 1 1 A 56 56 THR N N 56 114.855 111.599 3.256 1
1 633 . 38 1 1 A 57 57 ASP H H 57 8.730 8.096 0.634 1
1 634 . 38 1 1 A 57 57 ASP HA H 57 4.425 4.593 -0.168 1
1 637 . 38 1 1 A 57 57 ASP C C 57 178.351 178.606 -0.255 1
1 638 . 38 1 1 A 57 57 ASP CA C 57 57.963 57.522 0.441 1
1 639 . 38 1 1 A 57 57 ASP CB C 57 40.134 41.640 -1.506 1
1 640 . 38 1 1 A 57 57 ASP N N 57 126.239 121.007 5.232 1
1 641 . 38 1 1 A 58 58 TRP H H 58 8.244 8.599 -0.355 1
1 642 . 38 1 1 A 58 58 TRP HA H 58 4.030 4.495 -0.465 1
1 650 . 38 1 1 A 58 58 TRP C C 58 177.432 179.262 -1.830 1
1 651 . 38 1 1 A 58 58 TRP CA C 58 62.731 60.005 2.726 1
1 652 . 38 1 1 A 58 58 TRP CB C 58 29.122 29.327 -0.205 1
1 657 . 38 1 1 A 58 58 TRP N N 58 119.241 120.964 -1.723 1
1 659 . 38 1 1 A 59 59 ASN H H 59 8.098 8.689 -0.591 1
1 660 . 38 1 1 A 59 59 ASN HA H 59 4.424 4.428 -0.004 1
1 663 . 38 1 1 A 59 59 ASN C C 59 176.952 177.881 -0.929 1
1 664 . 38 1 1 A 59 59 ASN CA C 59 58.135 56.419 1.716 1
1 665 . 38 1 1 A 59 59 ASN CB C 59 40.168 37.924 2.244 1
1 666 . 38 1 1 A 59 59 ASN N N 59 115.747 117.875 -2.128 1
1 667 . 38 1 1 A 60 60 THR H H 60 8.712 7.888 0.824 1
1 668 . 38 1 1 A 60 60 THR HA H 60 3.717 3.932 -0.215 1
1 673 . 38 1 1 A 60 60 THR C C 60 176.044 176.590 -0.546 1
1 674 . 38 1 1 A 60 60 THR CA C 60 66.576 66.913 -0.337 1
1 675 . 38 1 1 A 60 60 THR CB C 60 69.251 67.663 1.588 1
1 677 . 38 1 1 A 60 60 THR N N 60 114.896 118.381 -3.485 1
1 678 . 38 1 1 A 61 61 LEU H H 61 8.485 8.585 -0.100 1
1 679 . 38 1 1 A 61 61 LEU HA H 61 3.391 4.079 -0.688 1
1 689 . 38 1 1 A 61 61 LEU C C 61 177.433 178.531 -1.098 1
1 690 . 38 1 1 A 61 61 LEU CA C 61 58.354 58.624 -0.270 1
1 691 . 38 1 1 A 61 61 LEU CB C 61 41.761 42.328 -0.567 1
1 695 . 38 1 1 A 61 61 LEU N N 61 123.433 122.106 1.327 1
1 696 . 38 1 1 A 62 62 VAL H H 62 8.073 8.586 -0.513 1
1 697 . 38 1 1 A 62 62 VAL HA H 62 3.207 3.824 -0.617 1
1 705 . 38 1 1 A 62 62 VAL C C 62 177.585 177.893 -0.308 1
1 706 . 38 1 1 A 62 62 VAL CA C 62 67.345 65.350 1.995 1
1 707 . 38 1 1 A 62 62 VAL CB C 62 30.905 30.686 0.219 1
1 710 . 38 1 1 A 62 62 VAL N N 62 116.018 118.493 -2.475 1
1 711 . 38 1 1 A 63 63 ARG H H 63 7.765 7.814 -0.049 1
1 712 . 38 1 1 A 63 63 ARG HA H 63 3.602 3.884 -0.282 1
1 719 . 38 1 1 A 63 63 ARG C C 63 177.818 178.473 -0.655 1
1 720 . 38 1 1 A 63 63 ARG CA C 63 58.049 59.644 -1.595 1
1 721 . 38 1 1 A 63 63 ARG CB C 63 29.955 29.925 0.030 1
1 724 . 38 1 1 A 63 63 ARG N N 63 116.700 121.546 -4.846 1
1 725 . 38 1 1 A 64 64 ALA H H 64 7.574 7.677 -0.103 1
1 726 . 38 1 1 A 64 64 ALA HA H 64 4.158 4.380 -0.222 1
1 730 . 38 1 1 A 64 64 ALA C C 64 179.886 179.504 0.382 1
1 731 . 38 1 1 A 64 64 ALA CA C 64 54.007 54.058 -0.051 1
1 732 . 38 1 1 A 64 64 ALA CB C 64 19.147 19.714 -0.567 1
1 733 . 38 1 1 A 64 64 ALA N N 64 117.555 120.862 -3.307 1
1 734 . 38 1 1 A 65 65 VAL H H 65 7.554 8.139 -0.585 1
1 735 . 38 1 1 A 65 65 VAL HA H 65 4.253 3.780 0.473 1
1 743 . 38 1 1 A 65 65 VAL C C 65 174.180 176.302 -2.122 1
1 744 . 38 1 1 A 65 65 VAL CA C 65 62.683 65.453 -2.770 1
1 745 . 38 1 1 A 65 65 VAL CB C 65 33.458 31.307 2.151 1
1 748 . 38 1 1 A 65 65 VAL N N 65 110.013 115.809 -5.796 1
1 749 . 38 1 1 A 66 66 LEU H H 66 7.792 7.171 0.621 1
1 750 . 38 1 1 A 66 66 LEU HA H 66 4.790 4.736 0.054 1
1 760 . 38 1 1 A 66 66 LEU C C 66 177.537 175.554 1.983 1
1 761 . 38 1 1 A 66 66 LEU CA C 66 52.823 52.716 0.107 1
1 762 . 38 1 1 A 66 66 LEU CB C 66 44.071 45.592 -1.521 1
1 766 . 38 1 1 A 66 66 LEU N N 66 118.967 121.354 -2.387 1
1 767 . 38 1 1 A 67 67 SER H H 67 9.208 8.438 0.770 1
1 768 . 38 1 1 A 67 67 SER HA H 67 4.414 4.735 -0.321 1
1 771 . 38 1 1 A 67 67 SER CA C 67 57.943 57.283 0.660 1
1 772 . 38 1 1 A 67 67 SER CB C 67 64.743 65.542 -0.799 1
1 773 . 38 1 1 A 67 67 SER N N 67 116.378 116.332 0.046 1
1 774 . 38 1 1 A 69 69 GLY HA2 H 69 3.916 3.700 0.216 1
1 775 . 38 1 1 A 69 69 GLY HA3 H 69 3.867 3.748 0.119 1
1 776 . 38 1 1 A 69 69 GLY C C 69 176.783 175.328 1.455 1
1 777 . 38 1 1 A 69 69 GLY CA C 69 46.977 47.035 -0.058 1
1 778 . 38 1 1 A 70 70 ASP H H 70 7.674 8.072 -0.398 1
1 779 . 38 1 1 A 70 70 ASP HA H 70 4.511 3.649 0.862 1
1 782 . 38 1 1 A 70 70 ASP C C 70 178.096 178.092 0.004 1
1 783 . 38 1 1 A 70 70 ASP CA C 70 57.262 56.387 0.875 1
1 784 . 38 1 1 A 70 70 ASP CB C 70 40.594 39.658 0.936 1
1 785 . 38 1 1 A 70 70 ASP N N 70 123.930 122.217 1.713 1
1 786 . 38 1 1 A 71 71 HIS H H 71 8.729 7.972 0.757 1
1 787 . 38 1 1 A 71 71 HIS HA H 71 4.235 4.113 0.122 1
1 790 . 38 1 1 A 71 71 HIS C C 71 176.769 176.616 0.153 1
1 791 . 38 1 1 A 71 71 HIS CA C 71 60.041 59.936 0.105 1
1 792 . 38 1 1 A 71 71 HIS CB C 71 30.682 29.726 0.956 1
1 793 . 38 1 1 A 71 71 HIS N N 71 121.003 119.813 1.190 1
1 794 . 38 1 1 A 72 72 LEU H H 72 7.620 7.983 -0.363 1
1 795 . 38 1 1 A 72 72 LEU HA H 72 3.769 3.905 -0.136 1
1 805 . 38 1 1 A 72 72 LEU C C 72 180.275 179.157 1.118 1
1 806 . 38 1 1 A 72 72 LEU CA C 72 58.192 58.118 0.074 1
1 807 . 38 1 1 A 72 72 LEU CB C 72 41.381 41.155 0.226 1
1 811 . 38 1 1 A 72 72 LEU N N 72 118.569 117.888 0.681 1
1 812 . 38 1 1 A 73 73 LEU H H 73 7.542 7.411 0.131 1
1 813 . 38 1 1 A 73 73 LEU HA H 73 4.107 4.179 -0.072 1
1 823 . 38 1 1 A 73 73 LEU C C 73 179.436 179.146 0.290 1
1 824 . 38 1 1 A 73 73 LEU CA C 73 58.026 57.262 0.764 1
1 825 . 38 1 1 A 73 73 LEU CB C 73 41.638 42.083 -0.445 1
1 829 . 38 1 1 A 73 73 LEU N N 73 121.418 120.868 0.550 1
1 830 . 38 1 1 A 74 74 TRP H H 74 8.786 8.322 0.464 1
1 831 . 38 1 1 A 74 74 TRP HA H 74 3.589 5.354 -1.765 1
1 840 . 38 1 1 A 74 74 TRP C C 74 176.816 178.731 -1.915 1
1 841 . 38 1 1 A 74 74 TRP CA C 74 63.046 59.956 3.090 1
1 842 . 38 1 1 A 74 74 TRP CB C 74 28.065 28.970 -0.905 1
1 848 . 38 1 1 A 74 74 TRP N N 74 121.111 118.075 3.036 1
1 850 . 38 1 1 A 75 75 LYS H H 75 8.939 7.670 1.269 1
1 851 . 38 1 1 A 75 75 LYS HA H 75 3.055 4.142 -1.087 1
1 860 . 38 1 1 A 75 75 LYS C C 75 177.967 179.289 -1.322 1
1 861 . 38 1 1 A 75 75 LYS CA C 75 60.029 58.532 1.497 1
1 862 . 38 1 1 A 75 75 LYS CB C 75 32.533 32.750 -0.217 1
1 866 . 38 1 1 A 75 75 LYS N N 75 119.783 118.582 1.201 1
1 867 . 38 1 1 A 76 76 SER H H 76 7.832 7.976 -0.144 1
1 868 . 38 1 1 A 76 76 SER HA H 76 4.040 4.273 -0.233 1
1 871 . 38 1 1 A 76 76 SER C C 76 177.816 176.854 0.962 1
1 872 . 38 1 1 A 76 76 SER CA C 76 62.105 62.380 -0.275 1
1 873 . 38 1 1 A 76 76 SER CB C 76 62.679 62.860 -0.181 1
1 874 . 38 1 1 A 76 76 SER N N 76 113.395 117.248 -3.853 1
1 875 . 38 1 1 A 77 77 GLU H H 77 7.590 7.687 -0.097 1
1 876 . 38 1 1 A 77 77 GLU HA H 77 4.042 4.363 -0.321 1
1 881 . 38 1 1 A 77 77 GLU C C 77 177.809 178.532 -0.723 1
1 882 . 38 1 1 A 77 77 GLU CA C 77 58.270 58.224 0.046 1
1 883 . 38 1 1 A 77 77 GLU CB C 77 29.208 29.460 -0.252 1
1 885 . 38 1 1 A 77 77 GLU N N 77 121.574 122.349 -0.775 1
1 886 . 38 1 1 A 78 78 PHE H H 78 9.081 7.867 1.214 1
1 887 . 38 1 1 A 78 78 PHE HA H 78 3.778 4.232 -0.454 1
1 895 . 38 1 1 A 78 78 PHE C C 78 178.114 177.426 0.688 1
1 896 . 38 1 1 A 78 78 PHE CA C 78 60.629 61.277 -0.648 1
1 897 . 38 1 1 A 78 78 PHE CB C 78 38.295 38.775 -0.480 1
1 902 . 38 1 1 A 78 78 PHE N N 78 122.682 122.374 0.308 1
1 903 . 38 1 1 A 79 79 PHE H H 79 8.890 8.089 0.801 1
1 904 . 38 1 1 A 79 79 PHE HA H 79 3.800 4.030 -0.230 1
1 912 . 38 1 1 A 79 79 PHE C C 79 178.354 178.114 0.240 1
1 913 . 38 1 1 A 79 79 PHE CA C 79 60.704 62.189 -1.485 1
1 914 . 38 1 1 A 79 79 PHE CB C 79 37.184 38.761 -1.577 1
1 920 . 38 1 1 A 79 79 PHE N N 79 121.056 117.740 3.316 1
1 921 . 38 1 1 A 80 80 GLU H H 80 7.793 8.133 -0.340 1
1 922 . 38 1 1 A 80 80 GLU HA H 80 4.082 4.021 0.061 1
1 927 . 38 1 1 A 80 80 GLU C C 80 179.068 179.359 -0.291 1
1 928 . 38 1 1 A 80 80 GLU CA C 80 59.735 59.381 0.354 1
1 929 . 38 1 1 A 80 80 GLU CB C 80 28.722 29.422 -0.700 1
1 931 . 38 1 1 A 80 80 GLU N N 80 120.312 119.613 0.699 1
1 932 . 38 1 1 A 81 81 ASN H H 81 8.624 8.682 -0.058 1
1 933 . 38 1 1 A 81 81 ASN HA H 81 4.521 4.477 0.044 1
1 938 . 38 1 1 A 81 81 ASN C C 81 179.262 178.159 1.103 1
1 939 . 38 1 1 A 81 81 ASN CA C 81 55.504 56.499 -0.995 1
1 940 . 38 1 1 A 81 81 ASN CB C 81 37.517 37.941 -0.424 1
1 941 . 38 1 1 A 81 81 ASN N N 81 119.338 118.574 0.764 1
1 943 . 38 1 1 A 82 82 CYS H H 82 8.554 7.933 0.621 1
1 944 . 38 1 1 A 82 82 CYS HA H 82 3.792 4.036 -0.244 1
1 947 . 38 1 1 A 82 82 CYS C C 82 176.478 176.909 -0.431 1
1 948 . 38 1 1 A 82 82 CYS CA C 82 65.232 63.117 2.115 1
1 949 . 38 1 1 A 82 82 CYS CB C 82 26.762 27.271 -0.509 1
1 950 . 38 1 1 A 82 82 CYS N N 82 120.576 117.622 2.954 1
1 951 . 38 1 1 A 83 83 ARG H H 83 8.522 7.901 0.621 1
1 952 . 38 1 1 A 83 83 ARG HA H 83 3.932 4.158 -0.226 1
1 960 . 38 1 1 A 83 83 ARG C C 83 179.138 178.586 0.552 1
1 961 . 38 1 1 A 83 83 ARG CA C 83 60.443 59.523 0.920 1
1 962 . 38 1 1 A 83 83 ARG CB C 83 29.550 29.902 -0.352 1
1 965 . 38 1 1 A 83 83 ARG N N 83 123.035 119.933 3.102 1
1 967 . 38 1 1 A 84 84 ASP H H 84 7.791 8.424 -0.633 1
1 968 . 38 1 1 A 84 84 ASP HA H 84 4.353 4.323 0.030 1
1 971 . 38 1 1 A 84 84 ASP C C 84 178.649 178.718 -0.069 1
1 972 . 38 1 1 A 84 84 ASP CA C 84 57.767 57.591 0.176 1
1 973 . 38 1 1 A 84 84 ASP CB C 84 41.305 41.805 -0.500 1
1 974 . 38 1 1 A 84 84 ASP N N 84 120.332 119.525 0.807 1
1 975 . 38 1 1 A 85 85 THR H H 85 8.370 7.924 0.446 1
1 976 . 38 1 1 A 85 85 THR HA H 85 3.730 3.886 -0.156 1
1 981 . 38 1 1 A 85 85 THR C C 85 175.198 176.172 -0.974 1
1 982 . 38 1 1 A 85 85 THR CA C 85 66.830 66.121 0.709 1
1 983 . 38 1 1 A 85 85 THR CB C 85 68.533 68.545 -0.012 1
1 985 . 38 1 1 A 85 85 THR N N 85 117.360 115.799 1.561 1
1 986 . 38 1 1 A 86 86 ALA H H 86 8.845 8.240 0.605 1
1 987 . 38 1 1 A 86 86 ALA HA H 86 3.991 3.998 -0.007 1
1 991 . 38 1 1 A 86 86 ALA C C 86 179.980 179.496 0.484 1
1 992 . 38 1 1 A 86 86 ALA CA C 86 55.769 55.291 0.478 1
1 993 . 38 1 1 A 86 86 ALA CB C 86 17.881 18.367 -0.486 1
1 994 . 38 1 1 A 86 86 ALA N N 86 123.613 123.475 0.138 1
1 995 . 38 1 1 A 87 87 LYS H H 87 7.686 8.336 -0.650 1
1 996 . 38 1 1 A 87 87 LYS HA H 87 4.099 3.972 0.127 1
1 1005 . 38 1 1 A 87 87 LYS C C 87 179.592 179.425 0.167 1
1 1006 . 38 1 1 A 87 87 LYS CA C 87 59.708 59.745 -0.037 1
1 1007 . 38 1 1 A 87 87 LYS CB C 87 32.054 32.198 -0.144 1
1 1011 . 38 1 1 A 87 87 LYS N N 87 119.623 118.427 1.196 1
1 1012 . 38 1 1 A 88 88 ARG H H 88 7.683 7.650 0.033 1
1 1013 . 38 1 1 A 88 88 ARG HA H 88 4.051 4.122 -0.071 1
1 1020 . 38 1 1 A 88 88 ARG C C 88 180.053 179.268 0.785 1
1 1021 . 38 1 1 A 88 88 ARG CA C 88 59.558 59.125 0.433 1
1 1022 . 38 1 1 A 88 88 ARG CB C 88 29.684 30.114 -0.430 1
1 1025 . 38 1 1 A 88 88 ARG N N 88 120.788 119.356 1.432 1
1 1026 . 38 1 1 A 89 89 ASN H H 89 8.973 8.560 0.413 1
1 1027 . 38 1 1 A 89 89 ASN HA H 89 4.354 4.660 -0.306 1
1 1032 . 38 1 1 A 89 89 ASN C C 89 178.382 178.715 -0.333 1
1 1033 . 38 1 1 A 89 89 ASN CA C 89 55.334 55.679 -0.345 1
1 1034 . 38 1 1 A 89 89 ASN CB C 89 37.864 37.949 -0.085 1
1 1035 . 38 1 1 A 89 89 ASN N N 89 121.012 117.722 3.290 1
1 1037 . 38 1 1 A 90 90 GLN H H 90 8.152 8.096 0.056 1
1 1038 . 38 1 1 A 90 90 GLN HA H 90 4.020 4.189 -0.169 1
1 1045 . 38 1 1 A 90 90 GLN C C 90 179.075 178.617 0.458 1
1 1046 . 38 1 1 A 90 90 GLN CA C 90 59.318 58.830 0.488 1
1 1047 . 38 1 1 A 90 90 GLN CB C 90 28.049 28.504 -0.455 1
1 1049 . 38 1 1 A 90 90 GLN N N 90 122.122 121.049 1.073 1
1 1051 . 38 1 1 A 91 91 GLN H H 91 7.514 8.314 -0.800 1
1 1052 . 38 1 1 A 91 91 GLN HA H 91 4.053 4.218 -0.165 1
1 1059 . 38 1 1 A 91 91 GLN C C 91 177.081 176.752 0.329 1
1 1060 . 38 1 1 A 91 91 GLN CA C 91 58.031 57.297 0.734 1
1 1061 . 38 1 1 A 91 91 GLN CB C 91 28.365 27.518 0.847 1
1 1063 . 38 1 1 A 91 91 GLN N N 91 118.124 117.801 0.323 1
1 1065 . 38 1 1 A 92 92 ALA H H 92 7.704 7.714 -0.010 1
1 1066 . 38 1 1 A 92 92 ALA HA H 92 4.246 4.457 -0.211 1
1 1070 . 38 1 1 A 92 92 ALA C C 92 178.450 177.957 0.493 1
1 1071 . 38 1 1 A 92 92 ALA CA C 92 52.671 51.860 0.811 1
1 1072 . 38 1 1 A 92 92 ALA CB C 92 19.316 19.264 0.052 1
1 1073 . 38 1 1 A 92 92 ALA N N 92 119.880 121.738 -1.858 1
1 1074 . 38 1 1 A 93 93 GLY H H 93 7.693 7.997 -0.304 1
1 1075 . 38 1 1 A 93 93 GLY HA2 H 93 3.941 3.930 0.011 1
1 1076 . 38 1 1 A 93 93 GLY HA3 H 93 3.744 3.940 -0.196 1
1 1077 . 38 1 1 A 93 93 GLY C C 93 174.344 174.843 -0.499 1
1 1078 . 38 1 1 A 93 93 GLY CA C 93 45.949 46.940 -0.991 1
1 1079 . 38 1 1 A 93 93 GLY N N 93 105.347 108.071 -2.724 1
1 1080 . 38 1 1 A 94 94 ASN H H 94 7.076 8.690 -1.614 1
1 1081 . 38 1 1 A 94 94 ASN HA H 94 4.115 4.861 -0.746 1
1 1085 . 38 1 1 A 94 94 ASN C C 94 175.410 175.687 -0.277 1
1 1086 . 38 1 1 A 94 94 ASN CA C 94 52.651 53.155 -0.504 1
1 1087 . 38 1 1 A 94 94 ASN CB C 94 38.330 40.115 -1.785 1
1 1088 . 38 1 1 A 94 94 ASN N N 94 115.747 117.716 -1.969 1
1 1090 . 38 1 1 A 95 95 GLY H H 95 8.236 8.160 0.076 1
1 1091 . 38 1 1 A 95 95 GLY HA2 H 95 3.633 3.501 0.132 1
1 1092 . 38 1 1 A 95 95 GLY HA3 H 95 3.633 3.732 -0.099 1
1 1093 . 38 1 1 A 95 95 GLY C C 95 174.450 173.759 0.691 1
1 1094 . 38 1 1 A 95 95 GLY CA C 95 45.522 45.080 0.442 1
1 1095 . 38 1 1 A 95 95 GLY N N 95 109.166 109.261 -0.095 1
1 1096 . 38 1 1 A 96 96 TRP H H 96 7.899 7.472 0.427 1
1 1097 . 38 1 1 A 96 96 TRP HA H 96 5.241 5.095 0.146 1
1 1106 . 38 1 1 A 96 96 TRP C C 96 175.661 175.295 0.366 1
1 1107 . 38 1 1 A 96 96 TRP CA C 96 55.090 56.606 -1.516 1
1 1108 . 38 1 1 A 96 96 TRP CB C 96 27.138 32.214 -5.076 1
1 1114 . 38 1 1 A 96 96 TRP N N 96 122.840 121.059 1.781 1
1 1116 . 38 1 1 A 97 97 ASP H H 97 7.344 9.131 -1.787 1
1 1117 . 38 1 1 A 97 97 ASP HA H 97 4.829 5.185 -0.356 1
1 1120 . 38 1 1 A 97 97 ASP C C 97 175.019 176.544 -1.525 1
1 1121 . 38 1 1 A 97 97 ASP CA C 97 52.149 53.139 -0.990 1
1 1122 . 38 1 1 A 97 97 ASP CB C 97 42.697 44.654 -1.957 1
1 1123 . 38 1 1 A 97 97 ASP N N 97 126.861 119.382 7.479 1
1 1124 . 38 1 1 A 98 98 PHE H H 98 8.566 9.229 -0.663 1
1 1125 . 38 1 1 A 98 98 PHE HA H 98 3.727 4.429 -0.702 1
1 1133 . 38 1 1 A 98 98 PHE C C 98 177.443 176.933 0.510 1
1 1134 . 38 1 1 A 98 98 PHE CA C 98 62.471 59.944 2.527 1
1 1135 . 38 1 1 A 98 98 PHE CB C 98 39.919 38.072 1.847 1
1 1141 . 38 1 1 A 98 98 PHE N N 98 117.781 118.840 -1.059 1
1 1142 . 38 1 1 A 99 99 ASP H H 99 8.259 7.726 0.533 1
1 1143 . 38 1 1 A 99 99 ASP HA H 99 3.960 4.122 -0.162 1
1 1146 . 38 1 1 A 99 99 ASP C C 99 178.132 178.879 -0.747 1
1 1147 . 38 1 1 A 99 99 ASP CA C 99 57.658 56.840 0.818 1
1 1148 . 38 1 1 A 99 99 ASP CB C 99 38.572 40.344 -1.772 1
1 1149 . 38 1 1 A 99 99 ASP N N 99 121.709 121.464 0.245 1
1 1150 . 38 1 1 A 100 100 MET H H 100 8.008 8.441 -0.433 1
1 1151 . 38 1 1 A 100 100 MET HA H 100 3.644 4.554 -0.910 1
1 1156 . 38 1 1 A 100 100 MET C C 100 180.008 176.995 3.013 1
1 1157 . 38 1 1 A 100 100 MET CA C 100 58.598 57.720 0.878 1
1 1158 . 38 1 1 A 100 100 MET CB C 100 33.423 32.858 0.565 1
1 1160 . 38 1 1 A 100 100 MET N N 100 119.668 117.292 2.376 1
1 1161 . 38 1 1 A 101 101 LEU H H 101 7.961 8.035 -0.074 1
1 1162 . 38 1 1 A 101 101 LEU HA H 101 3.523 4.416 -0.893 1
1 1172 . 38 1 1 A 101 101 LEU C C 101 173.873 176.069 -2.196 1
1 1173 . 38 1 1 A 101 101 LEU CA C 101 58.743 54.215 4.528 1
1 1174 . 38 1 1 A 101 101 LEU CB C 101 42.632 42.067 0.565 1
1 1178 . 38 1 1 A 101 101 LEU N N 101 119.752 120.584 -0.832 1
1 1179 . 38 1 1 A 102 102 THR H H 102 6.955 8.619 -1.664 1
1 1180 . 38 1 1 A 102 102 THR HA H 102 4.134 4.441 -0.307 1
1 1185 . 38 1 1 A 102 102 THR C C 102 176.513 174.267 2.246 1
1 1186 . 38 1 1 A 102 102 THR CA C 102 61.125 62.768 -1.643 1
1 1187 . 38 1 1 A 102 102 THR CB C 102 71.415 69.432 1.983 1
1 1189 . 38 1 1 A 102 102 THR N N 102 124.665 120.375 4.290 1
1 1190 . 38 1 1 A 103 103 GLY H H 103 7.816 9.045 -1.229 1
1 1191 . 38 1 1 A 103 103 GLY HA2 H 103 3.824 4.022 -0.198 1
1 1192 . 38 1 1 A 103 103 GLY HA3 H 103 3.824 4.083 -0.259 1
1 1193 . 38 1 1 A 103 103 GLY C C 103 174.126 173.699 0.427 1
1 1194 . 38 1 1 A 103 103 GLY CA C 103 47.805 47.674 0.131 1
1 1195 . 38 1 1 A 103 103 GLY N N 103 114.191 114.515 -0.324 1
1 1196 . 38 1 1 A 104 104 SER H H 104 8.860 8.479 0.381 1
1 1197 . 38 1 1 A 104 104 SER HA H 104 4.758 4.882 -0.124 1
1 1200 . 38 1 1 A 104 104 SER C C 104 174.591 174.465 0.126 1
1 1201 . 38 1 1 A 104 104 SER CA C 104 56.755 57.915 -1.160 1
1 1202 . 38 1 1 A 104 104 SER CB C 104 65.050 65.168 -0.118 1
1 1203 . 38 1 1 A 104 104 SER N N 104 114.771 118.646 -3.875 1
1 1204 . 38 1 1 A 105 105 GLY H H 105 8.788 8.683 0.105 1
1 1205 . 38 1 1 A 105 105 GLY HA2 H 105 3.733 3.521 0.212 1
1 1206 . 38 1 1 A 105 105 GLY HA3 H 105 3.733 3.757 -0.024 1
1 1207 . 38 1 1 A 105 105 GLY CA C 105 47.247 46.802 0.445 1
1 1208 . 38 1 1 A 105 105 GLY N N 105 110.394 112.976 -2.582 1
1 1209 . 38 1 1 A 106 106 ASN HA H 106 4.454 4.700 -0.246 1
1 1212 . 38 1 1 A 106 106 ASN C C 106 175.180 174.703 0.477 1
1 1213 . 38 1 1 A 106 106 ASN CA C 106 54.492 53.333 1.159 1
1 1214 . 38 1 1 A 106 106 ASN CB C 106 37.282 39.773 -2.491 1
1 1215 . 38 1 1 A 107 107 TYR H H 107 8.241 7.666 0.575 1
1 1216 . 38 1 1 A 107 107 TYR HA H 107 4.335 4.773 -0.438 1
1 1223 . 38 1 1 A 107 107 TYR C C 107 173.954 176.044 -2.090 1
1 1224 . 38 1 1 A 107 107 TYR CA C 107 57.727 58.974 -1.247 1
1 1225 . 38 1 1 A 107 107 TYR CB C 107 37.063 39.758 -2.695 1
1 1230 . 38 1 1 A 107 107 TYR N N 107 120.708 115.779 4.929 1
1 1231 . 38 1 1 A 108 108 SER H H 108 7.117 8.096 -0.979 1
1 1232 . 38 1 1 A 108 108 SER HA H 108 4.221 4.131 0.090 1
1 1235 . 38 1 1 A 108 108 SER C C 108 174.834 173.993 0.841 1
1 1236 . 38 1 1 A 108 108 SER CA C 108 59.859 60.614 -0.755 1
1 1237 . 38 1 1 A 108 108 SER CB C 108 63.846 61.923 1.923 1
1 1238 . 38 1 1 A 108 108 SER N N 108 113.362 115.469 -2.107 1
1 1239 . 38 1 1 A 109 109 SER H H 109 8.053 8.247 -0.194 1
1 1240 . 38 1 1 A 109 109 SER HA H 109 4.560 4.442 0.118 1
1 1243 . 38 1 1 A 109 109 SER CA C 109 57.141 59.529 -2.388 1
1 1244 . 38 1 1 A 109 109 SER CB C 109 64.874 63.054 1.820 1
1 1245 . 38 1 1 A 109 109 SER N N 109 116.657 116.598 0.059 1
1 1246 . 38 1 1 A 110 110 THR HA H 110 3.541 4.052 -0.511 1
1 1251 . 38 1 1 A 110 110 THR C C 110 175.477 176.092 -0.615 1
1 1252 . 38 1 1 A 110 110 THR CA C 110 66.443 65.799 0.644 1
1 1253 . 38 1 1 A 110 110 THR CB C 110 68.091 68.561 -0.470 1
1 1255 . 38 1 1 A 111 111 ASP H H 111 8.224 7.758 0.466 1
1 1256 . 38 1 1 A 111 111 ASP HA H 111 4.237 4.405 -0.168 1
1 1259 . 38 1 1 A 111 111 ASP C C 111 177.520 177.914 -0.394 1
1 1260 . 38 1 1 A 111 111 ASP CA C 111 57.559 57.399 0.160 1
1 1261 . 38 1 1 A 111 111 ASP CB C 111 40.292 41.126 -0.834 1
1 1262 . 38 1 1 A 111 111 ASP N N 111 119.490 122.001 -2.511 1
1 1263 . 38 1 1 A 112 112 ALA H H 112 7.431 8.122 -0.691 1
1 1264 . 38 1 1 A 112 112 ALA HA H 112 4.191 4.056 0.135 1
1 1268 . 38 1 1 A 112 112 ALA C C 112 180.646 179.836 0.810 1
1 1269 . 38 1 1 A 112 112 ALA CA C 112 54.534 54.572 -0.038 1
1 1270 . 38 1 1 A 112 112 ALA CB C 112 18.992 18.273 0.719 1
1 1271 . 38 1 1 A 112 112 ALA N N 112 119.710 121.513 -1.803 1
1 1272 . 38 1 1 A 113 113 GLN H H 113 7.576 7.801 -0.225 1
1 1273 . 38 1 1 A 113 113 GLN HA H 113 3.562 4.338 -0.776 1
1 1278 . 38 1 1 A 113 113 GLN C C 113 176.756 178.081 -1.325 1
1 1279 . 38 1 1 A 113 113 GLN CA C 113 57.736 58.574 -0.838 1
1 1280 . 38 1 1 A 113 113 GLN CB C 113 29.110 28.781 0.329 1
1 1281 . 38 1 1 A 113 113 GLN N N 113 117.518 118.249 -0.731 1
1 1283 . 38 1 1 A 114 114 MET H H 114 8.192 8.344 -0.152 1
1 1284 . 38 1 1 A 114 114 MET HA H 114 4.231 4.269 -0.038 1
1 1289 . 38 1 1 A 114 114 MET C C 114 175.648 177.186 -1.538 1
1 1290 . 38 1 1 A 114 114 MET CA C 114 57.446 58.039 -0.593 1
1 1291 . 38 1 1 A 114 114 MET CB C 114 33.570 32.744 0.826 1
1 1293 . 38 1 1 A 114 114 MET N N 114 111.509 119.398 -7.889 1
1 1294 . 38 1 1 A 115 115 GLN H H 115 6.940 7.369 -0.429 1
1 1295 . 38 1 1 A 115 115 GLN HA H 115 4.307 4.546 -0.239 1
1 1302 . 38 1 1 A 115 115 GLN C C 115 176.270 175.805 0.465 1
1 1303 . 38 1 1 A 115 115 GLN CA C 115 54.680 54.811 -0.131 1
1 1304 . 38 1 1 A 115 115 GLN CB C 115 28.233 29.070 -0.837 1
1 1306 . 38 1 1 A 115 115 GLN N N 115 114.300 116.678 -2.378 1
1 1308 . 38 1 1 A 116 116 TYR H H 116 6.677 7.618 -0.941 1
1 1309 . 38 1 1 A 116 116 TYR HA H 116 4.193 4.792 -0.599 1
1 1312 . 38 1 1 A 116 116 TYR C C 116 175.268 175.803 -0.535 1
1 1313 . 38 1 1 A 116 116 TYR CA C 116 54.357 61.645 -7.288 1
1 1314 . 38 1 1 A 116 116 TYR CB C 116 35.498 37.579 -2.081 1
1 1315 . 38 1 1 A 116 116 TYR N N 116 117.919 120.354 -2.435 1
1 1316 . 38 1 1 A 117 117 ASP H H 117 8.081 7.637 0.444 1
1 1317 . 38 1 1 A 117 117 ASP HA H 117 4.665 4.338 0.327 1
1 1320 . 38 1 1 A 117 117 ASP CA C 117 52.422 54.811 -2.389 1
1 1321 . 38 1 1 A 117 117 ASP CB C 117 42.416 39.600 2.816 1
1 1322 . 38 1 1 A 117 117 ASP N N 117 120.887 120.066 0.821 1
1 1323 . 38 1 1 A 118 118 PRO C C 118 179.180 178.703 0.477 1
1 1324 . 38 1 1 A 118 118 PRO CA C 118 65.942 65.939 0.003 1
1 1325 . 38 1 1 A 118 118 PRO CB C 118 32.197 31.914 0.283 1
1 1326 . 38 1 1 A 119 119 GLY H H 119 9.742 8.456 1.286 1
1 1327 . 38 1 1 A 119 119 GLY C C 119 175.622 175.037 0.585 1
1 1328 . 38 1 1 A 119 119 GLY CA C 119 46.785 46.067 0.718 1
1 1329 . 38 1 1 A 119 119 GLY N N 119 106.412 106.327 0.085 1
1 1330 . 38 1 1 A 120 120 LEU H H 120 6.666 7.645 -0.979 1
1 1331 . 38 1 1 A 120 120 LEU HA H 120 3.365 3.326 0.039 1
1 1341 . 38 1 1 A 120 120 LEU C C 120 179.262 178.326 0.936 1
1 1342 . 38 1 1 A 120 120 LEU CA C 120 56.605 57.144 -0.539 1
1 1343 . 38 1 1 A 120 120 LEU CB C 120 39.262 41.573 -2.311 1
1 1347 . 38 1 1 A 120 120 LEU N N 120 126.226 122.385 3.841 1
1 1348 . 38 1 1 A 121 121 PHE H H 121 7.356 8.591 -1.235 1
1 1349 . 38 1 1 A 121 121 PHE HA H 121 4.459 4.020 0.439 1
1 1352 . 38 1 1 A 121 121 PHE C C 121 179.716 177.626 2.090 1
1 1353 . 38 1 1 A 121 121 PHE CA C 121 62.838 62.095 0.743 1
1 1354 . 38 1 1 A 121 121 PHE CB C 121 37.603 39.231 -1.628 1
1 1355 . 38 1 1 A 121 121 PHE N N 121 117.437 119.525 -2.088 1
1 1356 . 38 1 1 A 122 122 ALA H H 122 7.926 7.949 -0.023 1
1 1357 . 38 1 1 A 122 122 ALA HA H 122 4.523 4.016 0.507 1
1 1361 . 38 1 1 A 122 122 ALA C C 122 180.435 179.788 0.647 1
1 1362 . 38 1 1 A 122 122 ALA CA C 122 55.527 55.407 0.120 1
1 1363 . 38 1 1 A 122 122 ALA CB C 122 17.814 17.918 -0.104 1
1 1364 . 38 1 1 A 122 122 ALA N N 122 121.068 120.983 0.085 1
1 1365 . 38 1 1 A 123 123 GLN H H 123 7.507 7.761 -0.254 1
1 1366 . 38 1 1 A 123 123 GLN HA H 123 4.153 3.954 0.199 1
1 1371 . 38 1 1 A 123 123 GLN C C 123 180.561 178.860 1.701 1
1 1372 . 38 1 1 A 123 123 GLN CA C 123 59.948 59.281 0.667 1
1 1373 . 38 1 1 A 123 123 GLN CB C 123 29.135 28.212 0.923 1
1 1375 . 38 1 1 A 123 123 GLN N N 123 120.324 117.321 3.003 1
1 1376 . 38 1 1 A 124 124 ILE H H 124 8.318 7.515 0.803 1
1 1377 . 38 1 1 A 124 124 ILE HA H 124 3.635 3.766 -0.131 1
1 1387 . 38 1 1 A 124 124 ILE C C 124 176.481 178.026 -1.545 1
1 1388 . 38 1 1 A 124 124 ILE CA C 124 66.432 64.168 2.264 1
1 1389 . 38 1 1 A 124 124 ILE CB C 124 39.168 37.562 1.606 1
1 1393 . 38 1 1 A 124 124 ILE N N 124 123.747 118.331 5.416 1
1 1394 . 38 1 1 A 125 125 GLN H H 125 8.474 8.094 0.380 1
1 1395 . 38 1 1 A 125 125 GLN HA H 125 4.264 3.940 0.324 1
1 1402 . 38 1 1 A 125 125 GLN C C 125 178.947 177.873 1.074 1
1 1403 . 38 1 1 A 125 125 GLN CA C 125 59.651 58.507 1.144 1
1 1404 . 38 1 1 A 125 125 GLN CB C 125 28.880 28.616 0.264 1
1 1406 . 38 1 1 A 125 125 GLN N N 125 120.368 121.116 -0.748 1
1 1408 . 38 1 1 A 126 126 ALA H H 126 8.002 7.869 0.133 1
1 1409 . 38 1 1 A 126 126 ALA HA H 126 4.144 4.026 0.118 1
1 1413 . 38 1 1 A 126 126 ALA C C 126 179.316 179.834 -0.518 1
1 1414 . 38 1 1 A 126 126 ALA CA C 126 55.036 55.069 -0.033 1
1 1415 . 38 1 1 A 126 126 ALA CB C 126 18.087 18.148 -0.061 1
1 1416 . 38 1 1 A 126 126 ALA N N 126 121.661 121.398 0.263 1
1 1417 . 38 1 1 A 127 127 ALA H H 127 7.823 7.988 -0.165 1
1 1418 . 38 1 1 A 127 127 ALA HA H 127 4.162 3.977 0.185 1
1 1422 . 38 1 1 A 127 127 ALA C C 127 180.707 179.545 1.162 1
1 1423 . 38 1 1 A 127 127 ALA CA C 127 55.080 54.897 0.183 1
1 1424 . 38 1 1 A 127 127 ALA CB C 127 19.354 18.256 1.098 1
1 1425 . 38 1 1 A 127 127 ALA N N 127 119.853 120.003 -0.150 1
1 1426 . 38 1 1 A 128 128 ALA H H 128 8.936 7.831 1.105 1
1 1427 . 38 1 1 A 128 128 ALA HA H 128 3.928 3.799 0.129 1
1 1431 . 38 1 1 A 128 128 ALA C C 128 181.031 179.352 1.679 1
1 1432 . 38 1 1 A 128 128 ALA CA C 128 55.502 54.675 0.827 1
1 1433 . 38 1 1 A 128 128 ALA CB C 128 16.609 17.817 -1.208 1
1 1434 . 38 1 1 A 128 128 ALA N N 128 121.355 120.339 1.016 1
1 1435 . 38 1 1 A 129 129 THR H H 129 8.543 7.359 1.184 1
1 1436 . 38 1 1 A 129 129 THR HA H 129 4.015 3.649 0.366 1
1 1441 . 38 1 1 A 129 129 THR C C 129 177.332 176.027 1.305 1
1 1442 . 38 1 1 A 129 129 THR CA C 129 65.893 65.019 0.874 1
1 1443 . 38 1 1 A 129 129 THR CB C 129 68.566 68.489 0.077 1
1 1445 . 38 1 1 A 129 129 THR N N 129 112.709 111.880 0.829 1
1 1446 . 38 1 1 A 130 130 LYS H H 130 8.126 7.479 0.647 1
1 1447 . 38 1 1 A 130 130 LYS HA H 130 4.000 4.060 -0.060 1
1 1456 . 38 1 1 A 130 130 LYS C C 130 179.082 178.473 0.609 1
1 1457 . 38 1 1 A 130 130 LYS CA C 130 60.299 58.891 1.408 1
1 1458 . 38 1 1 A 130 130 LYS CB C 130 32.767 32.029 0.738 1
1 1462 . 38 1 1 A 130 130 LYS N N 130 123.879 121.095 2.784 1
1 1463 . 38 1 1 A 131 131 ALA H H 131 7.184 7.796 -0.612 1
1 1464 . 38 1 1 A 131 131 ALA HA H 131 4.005 4.223 -0.218 1
1 1468 . 38 1 1 A 131 131 ALA C C 131 178.482 179.501 -1.019 1
1 1469 . 38 1 1 A 131 131 ALA CA C 131 55.027 55.177 -0.150 1
1 1470 . 38 1 1 A 131 131 ALA CB C 131 18.669 19.443 -0.774 1
1 1471 . 38 1 1 A 131 131 ALA N N 131 118.590 121.956 -3.366 1
1 1472 . 38 1 1 A 132 132 TRP H H 132 7.977 8.630 -0.653 1
1 1473 . 38 1 1 A 132 132 TRP HA H 132 4.001 4.087 -0.086 1
1 1480 . 38 1 1 A 132 132 TRP C C 132 177.332 175.717 1.615 1
1 1481 . 38 1 1 A 132 132 TRP CA C 132 60.431 57.294 3.137 1
1 1482 . 38 1 1 A 132 132 TRP CB C 132 27.786 27.566 0.220 1
1 1486 . 38 1 1 A 132 132 TRP N N 132 119.168 116.924 2.244 1
1 1488 . 38 1 1 A 133 133 ARG H H 133 8.006 7.978 0.028 1
1 1489 . 38 1 1 A 133 133 ARG HA H 133 4.027 4.385 -0.358 1
1 1497 . 38 1 1 A 133 133 ARG C C 133 176.664 178.306 -1.642 1
1 1498 . 38 1 1 A 133 133 ARG CA C 133 59.355 56.882 2.473 1
1 1499 . 38 1 1 A 133 133 ARG CB C 133 30.451 32.190 -1.739 1
1 1502 . 38 1 1 A 133 133 ARG N N 133 113.062 120.550 -7.488 1
1 1504 . 38 1 1 A 134 134 LYS H H 134 7.322 7.741 -0.419 1
1 1505 . 38 1 1 A 134 134 LYS HA H 134 4.313 4.343 -0.030 1
1 1514 . 38 1 1 A 134 134 LYS C C 134 176.282 176.723 -0.441 1
1 1515 . 38 1 1 A 134 134 LYS CA C 134 54.922 56.721 -1.799 1
1 1516 . 38 1 1 A 134 134 LYS CB C 134 32.633 32.180 0.453 1
1 1520 . 38 1 1 A 134 134 LYS N N 134 118.170 118.791 -0.621 1
1 1521 . 38 1 1 A 135 135 LEU H H 135 7.440 7.622 -0.182 1
1 1522 . 38 1 1 A 135 135 LEU HA H 135 4.174 4.565 -0.391 1
1 1532 . 38 1 1 A 135 135 LEU CA C 135 54.408 53.002 1.406 1
1 1533 . 38 1 1 A 135 135 LEU CB C 135 40.407 41.137 -0.730 1
1 1537 . 38 1 1 A 135 135 LEU N N 135 123.358 122.144 1.214 1
1 1538 . 38 1 1 A 136 136 PRO HA H 136 4.437 4.403 0.034 1
1 1545 . 38 1 1 A 136 136 PRO C C 136 177.106 175.793 1.313 1
1 1546 . 38 1 1 A 136 136 PRO CA C 136 62.889 65.908 -3.019 1
1 1547 . 38 1 1 A 136 136 PRO CB C 136 32.192 31.221 0.971 1
1 1550 . 38 1 1 A 137 137 VAL H H 137 8.219 7.417 0.802 1
1 1551 . 38 1 1 A 137 137 VAL HA H 137 4.077 5.079 -1.002 1
1 1559 . 38 1 1 A 137 137 VAL C C 137 176.305 175.636 0.669 1
1 1560 . 38 1 1 A 137 137 VAL CA C 137 61.958 60.466 1.492 1
1 1561 . 38 1 1 A 137 137 VAL CB C 137 32.755 36.026 -3.271 1
1 1564 . 38 1 1 A 137 137 VAL N N 137 120.079 114.164 5.915 1
1 1565 . 38 1 1 A 138 138 LYS H H 138 8.444 8.463 -0.019 1
1 1566 . 38 1 1 A 138 138 LYS HA H 138 4.316 4.236 0.080 1
1 1575 . 38 1 1 A 138 138 LYS C C 138 176.790 176.995 -0.205 1
1 1576 . 38 1 1 A 138 138 LYS CA C 138 56.792 57.995 -1.203 1
1 1577 . 38 1 1 A 138 138 LYS CB C 138 33.205 33.382 -0.177 1
1 1581 . 38 1 1 A 138 138 LYS N N 138 126.449 125.512 0.937 1
1 1582 . 38 1 1 A 139 139 GLY H H 139 8.518 7.375 1.143 1
1 1583 . 38 1 1 A 139 139 GLY HA2 H 139 4.070 4.047 0.023 1
1 1584 . 38 1 1 A 139 139 GLY HA3 H 139 3.897 4.061 -0.164 1
1 1585 . 38 1 1 A 139 139 GLY C C 139 172.874 172.286 0.588 1
1 1586 . 38 1 1 A 139 139 GLY CA C 139 45.157 45.791 -0.634 1
1 1587 . 38 1 1 A 139 139 GLY N N 139 112.617 106.214 6.403 1
1 6 . 39 1 1 A 2 2 VAL H H 2 8.992 9.283 -0.291 1
1 7 . 39 1 1 A 2 2 VAL HA H 2 5.370 4.563 0.807 1
1 15 . 39 1 1 A 2 2 VAL C C 2 174.325 175.062 -0.737 1
1 16 . 39 1 1 A 2 2 VAL CA C 2 61.267 61.835 -0.568 1
1 17 . 39 1 1 A 2 2 VAL CB C 2 33.890 33.371 0.519 1
1 20 . 39 1 1 A 2 2 VAL N N 2 126.939 120.909 6.030 1
1 21 . 39 1 1 A 3 3 THR H H 3 8.912 8.832 0.080 1
1 22 . 39 1 1 A 3 3 THR HA H 3 4.505 5.047 -0.542 1
1 27 . 39 1 1 A 3 3 THR C C 3 172.710 172.645 0.065 1
1 28 . 39 1 1 A 3 3 THR CA C 3 59.689 61.183 -1.494 1
1 29 . 39 1 1 A 3 3 THR CB C 3 72.398 71.553 0.845 1
1 31 . 39 1 1 A 3 3 THR N N 3 118.091 121.607 -3.516 1
1 32 . 39 1 1 A 4 4 GLU H H 4 8.631 9.384 -0.753 1
1 33 . 39 1 1 A 4 4 GLU HA H 4 5.788 5.060 0.728 1
1 38 . 39 1 1 A 4 4 GLU C C 4 175.758 174.048 1.710 1
1 39 . 39 1 1 A 4 4 GLU CA C 4 54.902 54.453 0.449 1
1 40 . 39 1 1 A 4 4 GLU CB C 4 35.097 32.891 2.206 1
1 42 . 39 1 1 A 4 4 GLU N N 4 120.966 125.961 -4.995 1
1 43 . 39 1 1 A 5 5 THR H H 5 9.188 8.038 1.150 1
1 44 . 39 1 1 A 5 5 THR HA H 5 4.739 5.187 -0.448 1
1 49 . 39 1 1 A 5 5 THR C C 5 172.757 173.068 -0.311 1
1 50 . 39 1 1 A 5 5 THR CA C 5 60.382 61.082 -0.700 1
1 51 . 39 1 1 A 5 5 THR CB C 5 71.558 72.363 -0.805 1
1 53 . 39 1 1 A 5 5 THR N N 5 119.366 112.815 6.551 1
1 54 . 39 1 1 A 6 6 VAL H H 6 8.476 9.010 -0.534 1
1 55 . 39 1 1 A 6 6 VAL HA H 6 5.026 5.595 -0.569 1
1 63 . 39 1 1 A 6 6 VAL C C 6 176.674 174.068 2.606 1
1 64 . 39 1 1 A 6 6 VAL CA C 6 61.008 59.610 1.398 1
1 65 . 39 1 1 A 6 6 VAL CB C 6 33.861 35.393 -1.532 1
1 68 . 39 1 1 A 6 6 VAL N N 6 121.384 118.291 3.093 1
1 69 . 39 1 1 A 7 7 ASP H H 7 8.848 9.299 -0.451 1
1 70 . 39 1 1 A 7 7 ASP HA H 7 4.797 5.045 -0.248 1
1 73 . 39 1 1 A 7 7 ASP CA C 7 52.834 54.634 -1.800 1
1 74 . 39 1 1 A 7 7 ASP CB C 7 42.219 42.471 -0.252 1
1 75 . 39 1 1 A 7 7 ASP N N 7 127.061 126.126 0.935 1
1 76 . 39 1 1 A 8 8 GLY C C 8 175.143 174.910 0.233 1
1 77 . 39 1 1 A 8 8 GLY CA C 8 46.553 46.980 -0.427 1
1 78 . 39 1 1 A 9 9 GLN H H 9 8.408 7.980 0.428 1
1 79 . 39 1 1 A 9 9 GLN HA H 9 4.541 4.229 0.312 1
1 86 . 39 1 1 A 9 9 GLN C C 9 176.463 176.610 -0.147 1
1 87 . 39 1 1 A 9 9 GLN CA C 9 55.167 55.340 -0.173 1
1 88 . 39 1 1 A 9 9 GLN CB C 9 29.376 27.853 1.523 1
1 90 . 39 1 1 A 9 9 GLN N N 9 118.300 116.748 1.552 1
1 92 . 39 1 1 A 10 10 GLY H H 10 8.162 8.442 -0.280 1
1 93 . 39 1 1 A 10 10 GLY HA2 H 10 4.174 3.897 0.277 1
1 94 . 39 1 1 A 10 10 GLY HA3 H 10 3.521 3.918 -0.397 1
1 95 . 39 1 1 A 10 10 GLY C C 10 174.092 174.179 -0.087 1
1 96 . 39 1 1 A 10 10 GLY CA C 10 45.558 45.841 -0.283 1
1 97 . 39 1 1 A 10 10 GLY N N 10 108.747 110.877 -2.130 1
1 98 . 39 1 1 A 11 11 GLN H H 11 8.507 7.899 0.608 1
1 99 . 39 1 1 A 11 11 GLN HA H 11 4.202 4.786 -0.584 1
1 106 . 39 1 1 A 11 11 GLN C C 11 173.992 174.627 -0.635 1
1 107 . 39 1 1 A 11 11 GLN CA C 11 55.098 54.822 0.276 1
1 108 . 39 1 1 A 11 11 GLN CB C 11 29.097 30.985 -1.888 1
1 110 . 39 1 1 A 11 11 GLN N N 11 122.979 116.968 6.011 1
1 112 . 39 1 1 A 12 12 ALA H H 12 8.259 8.757 -0.498 1
1 113 . 39 1 1 A 12 12 ALA HA H 12 5.156 5.803 -0.647 1
1 117 . 39 1 1 A 12 12 ALA C C 12 177.284 176.279 1.005 1
1 118 . 39 1 1 A 12 12 ALA CA C 12 51.087 50.539 0.548 1
1 119 . 39 1 1 A 12 12 ALA CB C 12 20.500 21.959 -1.459 1
1 120 . 39 1 1 A 12 12 ALA N N 12 127.100 123.894 3.206 1
1 121 . 39 1 1 A 13 13 TRP H H 13 9.245 8.892 0.353 1
1 122 . 39 1 1 A 13 13 TRP HA H 13 4.717 5.478 -0.761 1
1 131 . 39 1 1 A 13 13 TRP C C 13 175.108 174.470 0.638 1
1 132 . 39 1 1 A 13 13 TRP CA C 13 55.966 55.941 0.025 1
1 133 . 39 1 1 A 13 13 TRP CB C 13 31.912 31.534 0.378 1
1 139 . 39 1 1 A 13 13 TRP N N 13 123.088 118.901 4.187 1
1 141 . 39 1 1 A 14 14 ARG H H 14 8.575 8.096 0.479 1
1 142 . 39 1 1 A 14 14 ARG HA H 14 5.335 4.456 0.879 1
1 150 . 39 1 1 A 14 14 ARG C C 14 175.191 173.886 1.305 1
1 151 . 39 1 1 A 14 14 ARG CA C 14 53.106 55.095 -1.989 1
1 152 . 39 1 1 A 14 14 ARG CB C 14 32.749 31.665 1.084 1
1 154 . 39 1 1 A 14 14 ARG N N 14 121.163 121.636 -0.473 1
1 156 . 39 1 1 A 15 15 HIS H H 15 8.595 8.171 0.424 1
1 157 . 39 1 1 A 15 15 HIS HA H 15 4.790 5.172 -0.382 1
1 161 . 39 1 1 A 15 15 HIS C C 15 173.770 174.323 -0.553 1
1 162 . 39 1 1 A 15 15 HIS CA C 15 55.289 54.433 0.856 1
1 163 . 39 1 1 A 15 15 HIS CB C 15 33.208 31.002 2.206 1
1 165 . 39 1 1 A 15 15 HIS N N 15 117.643 120.043 -2.400 1
1 166 . 39 1 1 A 16 16 HIS H H 16 8.993 8.948 0.045 1
1 167 . 39 1 1 A 16 16 HIS HA H 16 5.158 4.994 0.164 1
1 171 . 39 1 1 A 16 16 HIS C C 16 173.608 174.287 -0.679 1
1 172 . 39 1 1 A 16 16 HIS CA C 16 56.450 55.562 0.888 1
1 173 . 39 1 1 A 16 16 HIS CB C 16 34.171 30.108 4.063 1
1 175 . 39 1 1 A 16 16 HIS N N 16 123.520 123.167 0.353 1
1 176 . 39 1 1 A 17 17 ASN H H 17 7.829 8.949 -1.120 1
1 177 . 39 1 1 A 17 17 ASN HA H 17 4.713 5.208 -0.495 1
1 182 . 39 1 1 A 17 17 ASN C C 17 173.682 175.001 -1.319 1
1 183 . 39 1 1 A 17 17 ASN CA C 17 51.822 51.062 0.760 1
1 184 . 39 1 1 A 17 17 ASN CB C 17 43.176 41.590 1.586 1
1 185 . 39 1 1 A 17 17 ASN N N 17 122.213 123.146 -0.933 1
1 187 . 39 1 1 A 18 18 GLY H H 18 8.423 8.336 0.087 1
1 188 . 39 1 1 A 18 18 GLY HA2 H 18 3.931 3.486 0.445 1
1 189 . 39 1 1 A 18 18 GLY HA3 H 18 3.707 3.836 -0.129 1
1 190 . 39 1 1 A 18 18 GLY C C 18 173.985 172.716 1.269 1
1 191 . 39 1 1 A 18 18 GLY CA C 18 43.949 44.174 -0.225 1
1 192 . 39 1 1 A 18 18 GLY N N 18 106.991 110.563 -3.572 1
1 193 . 39 1 1 A 19 19 PHE H H 19 8.338 7.988 0.350 1
1 194 . 39 1 1 A 19 19 PHE HA H 19 4.068 4.918 -0.850 1
1 197 . 39 1 1 A 19 19 PHE C C 19 176.568 175.020 1.548 1
1 198 . 39 1 1 A 19 19 PHE CA C 19 59.338 58.195 1.143 1
1 199 . 39 1 1 A 19 19 PHE CB C 19 40.201 40.278 -0.077 1
1 200 . 39 1 1 A 19 19 PHE N N 19 116.857 118.651 -1.794 1
1 201 . 39 1 1 A 20 20 ASP H H 20 8.794 8.632 0.162 1
1 202 . 39 1 1 A 20 20 ASP HA H 20 4.485 4.854 -0.369 1
1 205 . 39 1 1 A 20 20 ASP C C 20 177.379 177.334 0.045 1
1 206 . 39 1 1 A 20 20 ASP CA C 20 54.140 54.265 -0.125 1
1 207 . 39 1 1 A 20 20 ASP CB C 20 41.915 41.945 -0.030 1
1 208 . 39 1 1 A 20 20 ASP N N 20 123.025 124.314 -1.289 1
1 209 . 39 1 1 A 21 21 PHE H H 21 8.862 9.179 -0.317 1
1 210 . 39 1 1 A 21 21 PHE HA H 21 4.087 4.137 -0.050 1
1 218 . 39 1 1 A 21 21 PHE C C 21 176.952 177.165 -0.213 1
1 219 . 39 1 1 A 21 21 PHE CA C 21 61.095 62.197 -1.102 1
1 220 . 39 1 1 A 21 21 PHE CB C 21 38.678 39.154 -0.476 1
1 226 . 39 1 1 A 21 21 PHE N N 21 127.163 127.427 -0.264 1
1 227 . 39 1 1 A 22 22 ALA H H 22 8.561 8.393 0.168 1
1 228 . 39 1 1 A 22 22 ALA HA H 22 3.878 3.906 -0.028 1
1 232 . 39 1 1 A 22 22 ALA C C 22 180.710 179.855 0.855 1
1 233 . 39 1 1 A 22 22 ALA CA C 22 55.211 55.136 0.075 1
1 234 . 39 1 1 A 22 22 ALA CB C 22 18.321 18.108 0.213 1
1 235 . 39 1 1 A 22 22 ALA N N 22 120.293 121.187 -0.894 1
1 236 . 39 1 1 A 23 23 VAL H H 23 7.241 8.315 -1.074 1
1 237 . 39 1 1 A 23 23 VAL HA H 23 3.684 3.482 0.202 1
1 245 . 39 1 1 A 23 23 VAL C C 23 177.101 178.196 -1.095 1
1 246 . 39 1 1 A 23 23 VAL CA C 23 65.237 66.945 -1.708 1
1 247 . 39 1 1 A 23 23 VAL CB C 23 31.780 31.592 0.188 1
1 250 . 39 1 1 A 23 23 VAL N N 23 118.775 117.813 0.962 1
1 251 . 39 1 1 A 24 24 ILE H H 24 6.761 8.084 -1.323 1
1 252 . 39 1 1 A 24 24 ILE HA H 24 3.196 3.495 -0.299 1
1 262 . 39 1 1 A 24 24 ILE C C 24 177.287 178.306 -1.019 1
1 263 . 39 1 1 A 24 24 ILE CA C 24 63.404 65.701 -2.297 1
1 264 . 39 1 1 A 24 24 ILE CB C 24 36.294 37.760 -1.466 1
1 268 . 39 1 1 A 24 24 ILE N N 24 119.036 119.390 -0.354 1
1 269 . 39 1 1 A 25 25 LYS H H 25 8.032 8.216 -0.184 1
1 270 . 39 1 1 A 25 25 LYS HA H 25 3.809 3.712 0.097 1
1 279 . 39 1 1 A 25 25 LYS C C 25 179.450 178.647 0.803 1
1 280 . 39 1 1 A 25 25 LYS CA C 25 59.621 59.471 0.150 1
1 281 . 39 1 1 A 25 25 LYS CB C 25 32.259 32.035 0.224 1
1 285 . 39 1 1 A 25 25 LYS N N 25 118.368 119.908 -1.540 1
1 286 . 39 1 1 A 26 26 GLU H H 26 7.845 8.111 -0.266 1
1 287 . 39 1 1 A 26 26 GLU HA H 26 4.021 4.058 -0.037 1
1 292 . 39 1 1 A 26 26 GLU C C 26 179.191 178.824 0.367 1
1 293 . 39 1 1 A 26 26 GLU CA C 26 59.530 59.072 0.458 1
1 294 . 39 1 1 A 26 26 GLU CB C 26 29.449 29.474 -0.025 1
1 296 . 39 1 1 A 26 26 GLU N N 26 120.522 119.148 1.374 1
1 297 . 39 1 1 A 27 27 LEU H H 27 8.165 8.161 0.004 1
1 298 . 39 1 1 A 27 27 LEU HA H 27 4.163 4.114 0.049 1
1 308 . 39 1 1 A 27 27 LEU C C 27 177.256 178.362 -1.106 1
1 309 . 39 1 1 A 27 27 LEU CA C 27 58.049 57.533 0.516 1
1 310 . 39 1 1 A 27 27 LEU CB C 27 41.365 41.126 0.239 1
1 314 . 39 1 1 A 27 27 LEU N N 27 120.879 121.100 -0.221 1
1 315 . 39 1 1 A 28 28 LYS H H 28 8.902 8.084 0.818 1
1 316 . 39 1 1 A 28 28 LYS HA H 28 4.199 4.317 -0.118 1
1 317 . 39 1 1 A 28 28 LYS C C 28 179.707 179.329 0.378 1
1 318 . 39 1 1 A 28 28 LYS CA C 28 60.097 58.900 1.197 1
1 319 . 39 1 1 A 28 28 LYS CB C 28 33.420 31.526 1.894 1
1 320 . 39 1 1 A 28 28 LYS N N 28 120.050 119.535 0.515 1
1 321 . 39 1 1 A 29 29 THR H H 29 8.294 8.100 0.194 1
1 322 . 39 1 1 A 29 29 THR HA H 29 3.892 3.939 -0.047 1
1 327 . 39 1 1 A 29 29 THR C C 29 175.711 176.651 -0.940 1
1 328 . 39 1 1 A 29 29 THR CA C 29 66.846 66.684 0.162 1
1 329 . 39 1 1 A 29 29 THR CB C 29 68.794 68.586 0.208 1
1 331 . 39 1 1 A 29 29 THR N N 29 115.933 116.898 -0.965 1
1 332 . 39 1 1 A 30 30 ALA H H 30 8.244 8.417 -0.173 1
1 333 . 39 1 1 A 30 30 ALA HA H 30 4.241 4.300 -0.059 1
1 337 . 39 1 1 A 30 30 ALA C C 30 179.128 179.407 -0.279 1
1 338 . 39 1 1 A 30 30 ALA CA C 30 55.714 55.775 -0.061 1
1 339 . 39 1 1 A 30 30 ALA CB C 30 18.955 18.075 0.880 1
1 340 . 39 1 1 A 30 30 ALA N N 30 124.617 123.243 1.374 1
1 341 . 39 1 1 A 31 31 ALA H H 31 8.968 8.694 0.274 1
1 342 . 39 1 1 A 31 31 ALA HA H 31 3.890 4.046 -0.156 1
1 346 . 39 1 1 A 31 31 ALA C C 31 180.352 179.744 0.608 1
1 347 . 39 1 1 A 31 31 ALA CA C 31 55.454 55.587 -0.133 1
1 348 . 39 1 1 A 31 31 ALA CB C 31 17.124 18.431 -1.307 1
1 349 . 39 1 1 A 31 31 ALA N N 31 119.327 120.417 -1.090 1
1 350 . 39 1 1 A 32 32 SER H H 32 7.995 7.987 0.008 1
1 351 . 39 1 1 A 32 32 SER HA H 32 4.238 4.328 -0.090 1
1 354 . 39 1 1 A 32 32 SER C C 32 175.612 176.527 -0.915 1
1 355 . 39 1 1 A 32 32 SER CA C 32 61.203 61.160 0.043 1
1 356 . 39 1 1 A 32 32 SER CB C 32 63.406 63.295 0.111 1
1 357 . 39 1 1 A 32 32 SER N N 32 111.962 112.301 -0.339 1
1 358 . 39 1 1 A 33 33 GLN H H 33 8.333 7.812 0.521 1
1 359 . 39 1 1 A 33 33 GLN HA H 33 3.992 4.218 -0.226 1
1 366 . 39 1 1 A 33 33 GLN C C 33 177.486 177.076 0.410 1
1 367 . 39 1 1 A 33 33 GLN CA C 33 58.277 57.770 0.507 1
1 368 . 39 1 1 A 33 33 GLN CB C 33 29.140 29.305 -0.165 1
1 370 . 39 1 1 A 33 33 GLN N N 33 119.527 121.041 -1.514 1
1 372 . 39 1 1 A 34 34 TYR H H 34 8.587 8.328 0.259 1
1 373 . 39 1 1 A 34 34 TYR HA H 34 4.792 4.634 0.158 1
1 380 . 39 1 1 A 34 34 TYR C C 34 176.499 176.816 -0.317 1
1 381 . 39 1 1 A 34 34 TYR CA C 34 57.711 58.586 -0.875 1
1 382 . 39 1 1 A 34 34 TYR CB C 34 39.561 39.633 -0.072 1
1 387 . 39 1 1 A 34 34 TYR N N 34 114.610 115.601 -0.991 1
1 388 . 39 1 1 A 35 35 GLY H H 35 7.346 8.257 -0.911 1
1 389 . 39 1 1 A 35 35 GLY HA2 H 35 4.785 4.102 0.683 1
1 390 . 39 1 1 A 35 35 GLY HA3 H 35 4.007 4.109 -0.102 1
1 391 . 39 1 1 A 35 35 GLY C C 35 175.796 173.263 2.533 1
1 392 . 39 1 1 A 35 35 GLY CA C 35 44.355 44.746 -0.391 1
1 393 . 39 1 1 A 35 35 GLY N N 35 108.501 106.506 1.995 1
1 394 . 39 1 1 A 36 36 ALA H H 36 9.363 8.253 1.110 1
1 395 . 39 1 1 A 36 36 ALA HA H 36 4.217 4.630 -0.413 1
1 399 . 39 1 1 A 36 36 ALA C C 36 178.039 177.151 0.888 1
1 400 . 39 1 1 A 36 36 ALA CA C 36 56.114 51.623 4.491 1
1 401 . 39 1 1 A 36 36 ALA CB C 36 19.179 18.789 0.390 1
1 402 . 39 1 1 A 36 36 ALA N N 36 125.811 123.124 2.687 1
1 403 . 39 1 1 A 37 37 THR H H 37 8.070 8.365 -0.295 1
1 404 . 39 1 1 A 37 37 THR HA H 37 4.570 4.537 0.033 1
1 409 . 39 1 1 A 37 37 THR C C 37 173.685 174.049 -0.364 1
1 410 . 39 1 1 A 37 37 THR CA C 37 59.822 62.943 -3.121 1
1 411 . 39 1 1 A 37 37 THR CB C 37 68.267 71.740 -3.473 1
1 413 . 39 1 1 A 37 37 THR N N 37 129.410 118.291 11.119 1
1 414 . 39 1 1 A 38 38 ALA H H 38 6.853 7.340 -0.487 1
1 415 . 39 1 1 A 38 38 ALA HA H 38 4.601 4.598 0.003 1
1 419 . 39 1 1 A 38 38 ALA CA C 38 50.758 50.728 0.030 1
1 420 . 39 1 1 A 38 38 ALA CB C 38 18.325 19.566 -1.241 1
1 421 . 39 1 1 A 38 38 ALA N N 38 124.674 124.541 0.133 1
1 422 . 39 1 1 A 40 40 TYR HA H 40 4.032 4.008 0.024 1
1 429 . 39 1 1 A 40 40 TYR C C 40 176.456 177.277 -0.821 1
1 430 . 39 1 1 A 40 40 TYR CA C 40 61.010 61.738 -0.728 1
1 431 . 39 1 1 A 40 40 TYR CB C 40 39.286 38.746 0.540 1
1 436 . 39 1 1 A 41 41 THR H H 41 6.874 7.862 -0.988 1
1 437 . 39 1 1 A 41 41 THR HA H 41 3.616 3.722 -0.106 1
1 442 . 39 1 1 A 41 41 THR C C 41 176.930 176.483 0.447 1
1 443 . 39 1 1 A 41 41 THR CA C 41 65.557 65.498 0.059 1
1 444 . 39 1 1 A 41 41 THR CB C 41 68.228 69.080 -0.852 1
1 446 . 39 1 1 A 41 41 THR N N 41 115.143 113.923 1.220 1
1 447 . 39 1 1 A 42 42 LEU H H 42 8.623 7.353 1.270 1
1 448 . 39 1 1 A 42 42 LEU HA H 42 3.708 3.979 -0.271 1
1 458 . 39 1 1 A 42 42 LEU C C 42 178.206 178.899 -0.693 1
1 459 . 39 1 1 A 42 42 LEU CA C 42 57.417 57.808 -0.391 1
1 460 . 39 1 1 A 42 42 LEU CB C 42 41.342 41.153 0.189 1
1 464 . 39 1 1 A 42 42 LEU N N 42 120.418 118.611 1.807 1
1 465 . 39 1 1 A 43 43 ALA H H 43 7.735 7.640 0.095 1
1 466 . 39 1 1 A 43 43 ALA HA H 43 4.020 3.966 0.054 1
1 470 . 39 1 1 A 43 43 ALA C C 43 180.826 180.748 0.078 1
1 471 . 39 1 1 A 43 43 ALA CA C 43 54.925 55.021 -0.096 1
1 472 . 39 1 1 A 43 43 ALA CB C 43 17.506 18.412 -0.906 1
1 473 . 39 1 1 A 43 43 ALA N N 43 120.203 121.733 -1.530 1
1 474 . 39 1 1 A 44 44 ILE H H 44 7.149 7.356 -0.207 1
1 475 . 39 1 1 A 44 44 ILE HA H 44 3.603 3.570 0.033 1
1 485 . 39 1 1 A 44 44 ILE C C 44 178.594 178.280 0.314 1
1 486 . 39 1 1 A 44 44 ILE CA C 44 64.782 64.487 0.295 1
1 487 . 39 1 1 A 44 44 ILE CB C 44 37.472 37.355 0.117 1
1 491 . 39 1 1 A 44 44 ILE N N 44 118.881 119.557 -0.676 1
1 492 . 39 1 1 A 45 45 VAL H H 45 7.968 7.886 0.082 1
1 493 . 39 1 1 A 45 45 VAL HA H 45 2.925 3.400 -0.475 1
1 501 . 39 1 1 A 45 45 VAL C C 45 177.023 177.037 -0.014 1
1 502 . 39 1 1 A 45 45 VAL CA C 45 67.081 66.899 0.182 1
1 503 . 39 1 1 A 45 45 VAL CB C 45 30.854 30.911 -0.057 1
1 506 . 39 1 1 A 45 45 VAL N N 45 120.764 119.917 0.847 1
1 507 . 39 1 1 A 46 46 GLU H H 46 8.399 8.282 0.117 1
1 508 . 39 1 1 A 46 46 GLU HA H 46 3.848 3.869 -0.021 1
1 513 . 39 1 1 A 46 46 GLU C C 46 178.656 179.052 -0.396 1
1 514 . 39 1 1 A 46 46 GLU CA C 46 59.491 59.429 0.062 1
1 515 . 39 1 1 A 46 46 GLU CB C 46 28.991 29.148 -0.157 1
1 517 . 39 1 1 A 46 46 GLU N N 46 116.599 119.821 -3.222 1
1 518 . 39 1 1 A 47 47 SER H H 47 7.273 7.712 -0.439 1
1 519 . 39 1 1 A 47 47 SER HA H 47 4.287 4.197 0.090 1
1 521 . 39 1 1 A 47 47 SER CA C 47 61.047 61.385 -0.338 1
1 522 . 39 1 1 A 47 47 SER CB C 47 63.016 62.646 0.370 1
1 523 . 39 1 1 A 47 47 SER N N 47 113.609 115.909 -2.300 1
1 524 . 39 1 1 A 48 48 VAL H H 48 8.006 8.196 -0.190 1
1 525 . 39 1 1 A 48 48 VAL HA H 48 3.556 3.580 -0.024 1
1 533 . 39 1 1 A 48 48 VAL C C 48 177.257 177.646 -0.389 1
1 534 . 39 1 1 A 48 48 VAL CA C 48 65.025 66.584 -1.559 1
1 535 . 39 1 1 A 48 48 VAL CB C 48 31.841 31.525 0.316 1
1 538 . 39 1 1 A 48 48 VAL N N 48 122.327 121.401 0.926 1
1 539 . 39 1 1 A 49 49 ALA H H 49 8.369 7.791 0.578 1
1 540 . 39 1 1 A 49 49 ALA HA H 49 4.115 4.404 -0.289 1
1 544 . 39 1 1 A 49 49 ALA C C 49 177.307 177.788 -0.481 1
1 545 . 39 1 1 A 49 49 ALA CA C 49 53.253 53.394 -0.141 1
1 546 . 39 1 1 A 49 49 ALA CB C 49 20.131 18.335 1.796 1
1 547 . 39 1 1 A 49 49 ALA N N 49 118.050 121.003 -2.953 1
1 548 . 39 1 1 A 50 50 ASP H H 50 7.052 7.661 -0.609 1
1 549 . 39 1 1 A 50 50 ASP HA H 50 4.788 4.570 0.218 1
1 552 . 39 1 1 A 50 50 ASP C C 50 175.481 176.048 -0.567 1
1 553 . 39 1 1 A 50 50 ASP CA C 50 53.681 54.597 -0.916 1
1 554 . 39 1 1 A 50 50 ASP CB C 50 39.333 41.075 -1.742 1
1 555 . 39 1 1 A 50 50 ASP N N 50 116.997 117.571 -0.574 1
1 556 . 39 1 1 A 51 51 ASN H H 51 8.535 7.442 1.093 1
1 557 . 39 1 1 A 51 51 ASN HA H 51 4.628 5.077 -0.449 1
1 562 . 39 1 1 A 51 51 ASN C C 51 174.077 175.167 -1.090 1
1 563 . 39 1 1 A 51 51 ASN CA C 51 52.315 51.837 0.478 1
1 564 . 39 1 1 A 51 51 ASN CB C 51 41.928 40.821 1.107 1
1 565 . 39 1 1 A 51 51 ASN N N 51 118.626 117.454 1.172 1
1 567 . 39 1 1 A 52 52 TRP H H 52 8.555 8.350 0.205 1
1 574 . 39 1 1 A 52 52 TRP C C 52 173.269 176.366 -3.097 1
1 575 . 39 1 1 A 52 52 TRP CA C 52 55.031 57.605 -2.574 1
1 576 . 39 1 1 A 52 52 TRP CB C 52 26.801 29.825 -3.024 1
1 582 . 39 1 1 A 52 52 TRP N N 52 120.693 120.590 0.103 1
1 584 . 39 1 1 A 53 53 LEU H H 53 7.847 8.745 -0.898 1
1 585 . 39 1 1 A 53 53 LEU HA H 53 4.859 5.041 -0.182 1
1 595 . 39 1 1 A 53 53 LEU C C 53 177.397 175.207 2.190 1
1 596 . 39 1 1 A 53 53 LEU CA C 53 53.619 53.700 -0.081 1
1 597 . 39 1 1 A 53 53 LEU CB C 53 41.812 45.659 -3.847 1
1 601 . 39 1 1 A 53 53 LEU N N 53 124.741 120.687 4.054 1
1 602 . 39 1 1 A 54 54 THR H H 54 8.850 8.763 0.087 1
1 603 . 39 1 1 A 54 54 THR HA H 54 4.598 4.380 0.218 1
1 608 . 39 1 1 A 54 54 THR CA C 54 60.531 60.999 -0.468 1
1 609 . 39 1 1 A 54 54 THR CB C 54 67.183 68.494 -1.311 1
1 611 . 39 1 1 A 54 54 THR N N 54 113.407 116.695 -3.288 1
1 612 . 39 1 1 A 55 55 PRO HA H 55 4.511 4.217 0.294 1
1 619 . 39 1 1 A 55 55 PRO C C 55 179.383 178.998 0.385 1
1 620 . 39 1 1 A 55 55 PRO CA C 55 67.159 65.371 1.788 1
1 621 . 39 1 1 A 55 55 PRO CB C 55 32.095 31.754 0.341 1
1 622 . 39 1 1 A 56 56 THR H H 56 8.575 7.984 0.591 1
1 623 . 39 1 1 A 56 56 THR HA H 56 4.229 4.107 0.122 1
1 628 . 39 1 1 A 56 56 THR C C 56 176.668 176.127 0.541 1
1 629 . 39 1 1 A 56 56 THR CA C 56 66.943 65.791 1.152 1
1 630 . 39 1 1 A 56 56 THR CB C 56 68.129 68.206 -0.077 1
1 632 . 39 1 1 A 56 56 THR N N 56 114.855 113.489 1.366 1
1 633 . 39 1 1 A 57 57 ASP H H 57 8.730 8.122 0.608 1
1 634 . 39 1 1 A 57 57 ASP HA H 57 4.425 4.814 -0.389 1
1 637 . 39 1 1 A 57 57 ASP C C 57 178.351 178.683 -0.332 1
1 638 . 39 1 1 A 57 57 ASP CA C 57 57.963 57.593 0.370 1
1 639 . 39 1 1 A 57 57 ASP CB C 57 40.134 41.379 -1.245 1
1 640 . 39 1 1 A 57 57 ASP N N 57 126.239 120.988 5.251 1
1 641 . 39 1 1 A 58 58 TRP H H 58 8.244 8.456 -0.212 1
1 642 . 39 1 1 A 58 58 TRP HA H 58 4.030 4.536 -0.506 1
1 650 . 39 1 1 A 58 58 TRP C C 58 177.432 178.942 -1.510 1
1 651 . 39 1 1 A 58 58 TRP CA C 58 62.731 59.993 2.738 1
1 652 . 39 1 1 A 58 58 TRP CB C 58 29.122 29.394 -0.272 1
1 657 . 39 1 1 A 58 58 TRP N N 58 119.241 120.932 -1.691 1
1 659 . 39 1 1 A 59 59 ASN H H 59 8.098 8.863 -0.765 1
1 660 . 39 1 1 A 59 59 ASN HA H 59 4.424 4.409 0.015 1
1 663 . 39 1 1 A 59 59 ASN C C 59 176.952 178.046 -1.094 1
1 664 . 39 1 1 A 59 59 ASN CA C 59 58.135 56.520 1.615 1
1 665 . 39 1 1 A 59 59 ASN CB C 59 40.168 39.574 0.594 1
1 666 . 39 1 1 A 59 59 ASN N N 59 115.747 117.612 -1.865 1
1 667 . 39 1 1 A 60 60 THR H H 60 8.712 7.810 0.902 1
1 668 . 39 1 1 A 60 60 THR HA H 60 3.717 3.890 -0.173 1
1 673 . 39 1 1 A 60 60 THR C C 60 176.044 176.540 -0.496 1
1 674 . 39 1 1 A 60 60 THR CA C 60 66.576 66.761 -0.185 1
1 675 . 39 1 1 A 60 60 THR CB C 60 69.251 67.453 1.798 1
1 677 . 39 1 1 A 60 60 THR N N 60 114.896 115.964 -1.068 1
1 678 . 39 1 1 A 61 61 LEU H H 61 8.485 8.451 0.034 1
1 679 . 39 1 1 A 61 61 LEU HA H 61 3.391 4.042 -0.651 1
1 689 . 39 1 1 A 61 61 LEU C C 61 177.433 178.638 -1.205 1
1 690 . 39 1 1 A 61 61 LEU CA C 61 58.354 58.733 -0.379 1
1 691 . 39 1 1 A 61 61 LEU CB C 61 41.761 42.350 -0.589 1
1 695 . 39 1 1 A 61 61 LEU N N 61 123.433 122.026 1.407 1
1 696 . 39 1 1 A 62 62 VAL H H 62 8.073 8.260 -0.187 1
1 697 . 39 1 1 A 62 62 VAL HA H 62 3.207 3.757 -0.550 1
1 705 . 39 1 1 A 62 62 VAL C C 62 177.585 177.343 0.242 1
1 706 . 39 1 1 A 62 62 VAL CA C 62 67.345 65.266 2.079 1
1 707 . 39 1 1 A 62 62 VAL CB C 62 30.905 30.547 0.358 1
1 710 . 39 1 1 A 62 62 VAL N N 62 116.018 118.431 -2.413 1
1 711 . 39 1 1 A 63 63 ARG H H 63 7.765 8.007 -0.242 1
1 712 . 39 1 1 A 63 63 ARG HA H 63 3.602 3.934 -0.332 1
1 719 . 39 1 1 A 63 63 ARG C C 63 177.818 178.157 -0.339 1
1 720 . 39 1 1 A 63 63 ARG CA C 63 58.049 58.188 -0.139 1
1 721 . 39 1 1 A 63 63 ARG CB C 63 29.955 29.596 0.359 1
1 724 . 39 1 1 A 63 63 ARG N N 63 116.700 120.447 -3.747 1
1 725 . 39 1 1 A 64 64 ALA H H 64 7.574 7.450 0.124 1
1 726 . 39 1 1 A 64 64 ALA HA H 64 4.158 4.392 -0.234 1
1 730 . 39 1 1 A 64 64 ALA C C 64 179.886 179.153 0.733 1
1 731 . 39 1 1 A 64 64 ALA CA C 64 54.007 53.936 0.071 1
1 732 . 39 1 1 A 64 64 ALA CB C 64 19.147 19.843 -0.696 1
1 733 . 39 1 1 A 64 64 ALA N N 64 117.555 121.526 -3.971 1
1 734 . 39 1 1 A 65 65 VAL H H 65 7.554 7.875 -0.321 1
1 735 . 39 1 1 A 65 65 VAL HA H 65 4.253 3.853 0.400 1
1 743 . 39 1 1 A 65 65 VAL C C 65 174.180 176.163 -1.983 1
1 744 . 39 1 1 A 65 65 VAL CA C 65 62.683 65.421 -2.738 1
1 745 . 39 1 1 A 65 65 VAL CB C 65 33.458 31.295 2.163 1
1 748 . 39 1 1 A 65 65 VAL N N 65 110.013 115.812 -5.799 1
1 749 . 39 1 1 A 66 66 LEU H H 66 7.792 7.267 0.525 1
1 750 . 39 1 1 A 66 66 LEU HA H 66 4.790 4.787 0.003 1
1 760 . 39 1 1 A 66 66 LEU C C 66 177.537 175.592 1.945 1
1 761 . 39 1 1 A 66 66 LEU CA C 66 52.823 52.690 0.133 1
1 762 . 39 1 1 A 66 66 LEU CB C 66 44.071 45.692 -1.621 1
1 766 . 39 1 1 A 66 66 LEU N N 66 118.967 120.595 -1.628 1
1 767 . 39 1 1 A 67 67 SER H H 67 9.208 8.346 0.862 1
1 768 . 39 1 1 A 67 67 SER HA H 67 4.414 4.944 -0.530 1
1 771 . 39 1 1 A 67 67 SER CA C 67 57.943 56.244 1.699 1
1 772 . 39 1 1 A 67 67 SER CB C 67 64.743 66.215 -1.472 1
1 773 . 39 1 1 A 67 67 SER N N 67 116.378 113.102 3.276 1
1 774 . 39 1 1 A 69 69 GLY HA2 H 69 3.916 3.762 0.154 1
1 775 . 39 1 1 A 69 69 GLY HA3 H 69 3.867 3.790 0.077 1
1 776 . 39 1 1 A 69 69 GLY C C 69 176.783 175.468 1.315 1
1 777 . 39 1 1 A 69 69 GLY CA C 69 46.977 46.895 0.082 1
1 778 . 39 1 1 A 70 70 ASP H H 70 7.674 8.140 -0.466 1
1 779 . 39 1 1 A 70 70 ASP HA H 70 4.511 3.656 0.855 1
1 782 . 39 1 1 A 70 70 ASP C C 70 178.096 178.439 -0.343 1
1 783 . 39 1 1 A 70 70 ASP CA C 70 57.262 56.436 0.826 1
1 784 . 39 1 1 A 70 70 ASP CB C 70 40.594 39.700 0.894 1
1 785 . 39 1 1 A 70 70 ASP N N 70 123.930 121.906 2.024 1
1 786 . 39 1 1 A 71 71 HIS H H 71 8.729 7.716 1.013 1
1 787 . 39 1 1 A 71 71 HIS HA H 71 4.235 4.211 0.024 1
1 790 . 39 1 1 A 71 71 HIS C C 71 176.769 176.617 0.152 1
1 791 . 39 1 1 A 71 71 HIS CA C 71 60.041 59.995 0.046 1
1 792 . 39 1 1 A 71 71 HIS CB C 71 30.682 30.257 0.425 1
1 793 . 39 1 1 A 71 71 HIS N N 71 121.003 119.512 1.491 1
1 794 . 39 1 1 A 72 72 LEU H H 72 7.620 7.881 -0.261 1
1 795 . 39 1 1 A 72 72 LEU HA H 72 3.769 3.737 0.032 1
1 805 . 39 1 1 A 72 72 LEU C C 72 180.275 179.144 1.131 1
1 806 . 39 1 1 A 72 72 LEU CA C 72 58.192 58.026 0.166 1
1 807 . 39 1 1 A 72 72 LEU CB C 72 41.381 41.064 0.317 1
1 811 . 39 1 1 A 72 72 LEU N N 72 118.569 118.284 0.285 1
1 812 . 39 1 1 A 73 73 LEU H H 73 7.542 7.628 -0.086 1
1 813 . 39 1 1 A 73 73 LEU HA H 73 4.107 4.263 -0.156 1
1 823 . 39 1 1 A 73 73 LEU C C 73 179.436 179.171 0.265 1
1 824 . 39 1 1 A 73 73 LEU CA C 73 58.026 57.272 0.754 1
1 825 . 39 1 1 A 73 73 LEU CB C 73 41.638 42.234 -0.596 1
1 829 . 39 1 1 A 73 73 LEU N N 73 121.418 120.774 0.644 1
1 830 . 39 1 1 A 74 74 TRP H H 74 8.786 7.968 0.818 1
1 831 . 39 1 1 A 74 74 TRP HA H 74 3.589 5.397 -1.808 1
1 840 . 39 1 1 A 74 74 TRP C C 74 176.816 178.825 -2.009 1
1 841 . 39 1 1 A 74 74 TRP CA C 74 63.046 59.767 3.279 1
1 842 . 39 1 1 A 74 74 TRP CB C 74 28.065 29.046 -0.981 1
1 848 . 39 1 1 A 74 74 TRP N N 74 121.111 118.607 2.504 1
1 850 . 39 1 1 A 75 75 LYS H H 75 8.939 7.643 1.296 1
1 851 . 39 1 1 A 75 75 LYS HA H 75 3.055 4.272 -1.217 1
1 860 . 39 1 1 A 75 75 LYS C C 75 177.967 179.456 -1.489 1
1 861 . 39 1 1 A 75 75 LYS CA C 75 60.029 58.781 1.248 1
1 862 . 39 1 1 A 75 75 LYS CB C 75 32.533 33.167 -0.634 1
1 866 . 39 1 1 A 75 75 LYS N N 75 119.783 118.736 1.047 1
1 867 . 39 1 1 A 76 76 SER H H 76 7.832 8.006 -0.174 1
1 868 . 39 1 1 A 76 76 SER HA H 76 4.040 4.409 -0.369 1
1 871 . 39 1 1 A 76 76 SER C C 76 177.816 176.991 0.825 1
1 872 . 39 1 1 A 76 76 SER CA C 76 62.105 61.962 0.143 1
1 873 . 39 1 1 A 76 76 SER CB C 76 62.679 62.923 -0.244 1
1 874 . 39 1 1 A 76 76 SER N N 76 113.395 116.982 -3.587 1
1 875 . 39 1 1 A 77 77 GLU H H 77 7.590 7.595 -0.005 1
1 876 . 39 1 1 A 77 77 GLU HA H 77 4.042 4.311 -0.269 1
1 881 . 39 1 1 A 77 77 GLU C C 77 177.809 178.574 -0.765 1
1 882 . 39 1 1 A 77 77 GLU CA C 77 58.270 58.625 -0.355 1
1 883 . 39 1 1 A 77 77 GLU CB C 77 29.208 29.412 -0.204 1
1 885 . 39 1 1 A 77 77 GLU N N 77 121.574 122.693 -1.119 1
1 886 . 39 1 1 A 78 78 PHE H H 78 9.081 7.870 1.211 1
1 887 . 39 1 1 A 78 78 PHE HA H 78 3.778 4.289 -0.511 1
1 895 . 39 1 1 A 78 78 PHE C C 78 178.114 177.532 0.582 1
1 896 . 39 1 1 A 78 78 PHE CA C 78 60.629 61.288 -0.659 1
1 897 . 39 1 1 A 78 78 PHE CB C 78 38.295 38.819 -0.524 1
1 902 . 39 1 1 A 78 78 PHE N N 78 122.682 122.050 0.632 1
1 903 . 39 1 1 A 79 79 PHE H H 79 8.890 8.118 0.772 1
1 904 . 39 1 1 A 79 79 PHE HA H 79 3.800 4.011 -0.211 1
1 912 . 39 1 1 A 79 79 PHE C C 79 178.354 178.276 0.078 1
1 913 . 39 1 1 A 79 79 PHE CA C 79 60.704 62.225 -1.521 1
1 914 . 39 1 1 A 79 79 PHE CB C 79 37.184 38.532 -1.348 1
1 920 . 39 1 1 A 79 79 PHE N N 79 121.056 117.880 3.176 1
1 921 . 39 1 1 A 80 80 GLU H H 80 7.793 8.166 -0.373 1
1 922 . 39 1 1 A 80 80 GLU HA H 80 4.082 3.990 0.092 1
1 927 . 39 1 1 A 80 80 GLU C C 80 179.068 179.418 -0.350 1
1 928 . 39 1 1 A 80 80 GLU CA C 80 59.735 59.565 0.170 1
1 929 . 39 1 1 A 80 80 GLU CB C 80 28.722 29.148 -0.426 1
1 931 . 39 1 1 A 80 80 GLU N N 80 120.312 118.696 1.616 1
1 932 . 39 1 1 A 81 81 ASN H H 81 8.624 8.682 -0.058 1
1 933 . 39 1 1 A 81 81 ASN HA H 81 4.521 4.500 0.021 1
1 938 . 39 1 1 A 81 81 ASN C C 81 179.262 177.932 1.330 1
1 939 . 39 1 1 A 81 81 ASN CA C 81 55.504 56.527 -1.023 1
1 940 . 39 1 1 A 81 81 ASN CB C 81 37.517 38.055 -0.538 1
1 941 . 39 1 1 A 81 81 ASN N N 81 119.338 118.559 0.779 1
1 943 . 39 1 1 A 82 82 CYS H H 82 8.554 8.353 0.201 1
1 944 . 39 1 1 A 82 82 CYS HA H 82 3.792 4.022 -0.230 1
1 947 . 39 1 1 A 82 82 CYS C C 82 176.478 176.493 -0.015 1
1 948 . 39 1 1 A 82 82 CYS CA C 82 65.232 61.798 3.434 1
1 949 . 39 1 1 A 82 82 CYS CB C 82 26.762 26.990 -0.228 1
1 950 . 39 1 1 A 82 82 CYS N N 82 120.576 118.627 1.949 1
1 951 . 39 1 1 A 83 83 ARG H H 83 8.522 7.803 0.719 1
1 952 . 39 1 1 A 83 83 ARG HA H 83 3.932 4.238 -0.306 1
1 960 . 39 1 1 A 83 83 ARG C C 83 179.138 178.622 0.516 1
1 961 . 39 1 1 A 83 83 ARG CA C 83 60.443 58.912 1.531 1
1 962 . 39 1 1 A 83 83 ARG CB C 83 29.550 29.660 -0.110 1
1 965 . 39 1 1 A 83 83 ARG N N 83 123.035 120.508 2.527 1
1 967 . 39 1 1 A 84 84 ASP H H 84 7.791 8.303 -0.512 1
1 968 . 39 1 1 A 84 84 ASP HA H 84 4.353 4.436 -0.083 1
1 971 . 39 1 1 A 84 84 ASP C C 84 178.649 178.610 0.039 1
1 972 . 39 1 1 A 84 84 ASP CA C 84 57.767 57.525 0.242 1
1 973 . 39 1 1 A 84 84 ASP CB C 84 41.305 41.432 -0.127 1
1 974 . 39 1 1 A 84 84 ASP N N 84 120.332 119.687 0.645 1
1 975 . 39 1 1 A 85 85 THR H H 85 8.370 8.254 0.116 1
1 976 . 39 1 1 A 85 85 THR HA H 85 3.730 3.885 -0.155 1
1 981 . 39 1 1 A 85 85 THR C C 85 175.198 176.117 -0.919 1
1 982 . 39 1 1 A 85 85 THR CA C 85 66.830 66.278 0.552 1
1 983 . 39 1 1 A 85 85 THR CB C 85 68.533 68.199 0.334 1
1 985 . 39 1 1 A 85 85 THR N N 85 117.360 115.631 1.729 1
1 986 . 39 1 1 A 86 86 ALA H H 86 8.845 8.105 0.740 1
1 987 . 39 1 1 A 86 86 ALA HA H 86 3.991 4.026 -0.035 1
1 991 . 39 1 1 A 86 86 ALA C C 86 179.980 179.394 0.586 1
1 992 . 39 1 1 A 86 86 ALA CA C 86 55.769 55.506 0.263 1
1 993 . 39 1 1 A 86 86 ALA CB C 86 17.881 18.306 -0.425 1
1 994 . 39 1 1 A 86 86 ALA N N 86 123.613 123.616 -0.003 1
1 995 . 39 1 1 A 87 87 LYS H H 87 7.686 8.339 -0.653 1
1 996 . 39 1 1 A 87 87 LYS HA H 87 4.099 3.938 0.161 1
1 1005 . 39 1 1 A 87 87 LYS C C 87 179.592 179.718 -0.126 1
1 1006 . 39 1 1 A 87 87 LYS CA C 87 59.708 59.678 0.030 1
1 1007 . 39 1 1 A 87 87 LYS CB C 87 32.054 32.297 -0.243 1
1 1011 . 39 1 1 A 87 87 LYS N N 87 119.623 117.435 2.188 1
1 1012 . 39 1 1 A 88 88 ARG H H 88 7.683 8.065 -0.382 1
1 1013 . 39 1 1 A 88 88 ARG HA H 88 4.051 4.109 -0.058 1
1 1020 . 39 1 1 A 88 88 ARG C C 88 180.053 178.825 1.228 1
1 1021 . 39 1 1 A 88 88 ARG CA C 88 59.558 59.340 0.218 1
1 1022 . 39 1 1 A 88 88 ARG CB C 88 29.684 29.879 -0.195 1
1 1025 . 39 1 1 A 88 88 ARG N N 88 120.788 119.436 1.352 1
1 1026 . 39 1 1 A 89 89 ASN H H 89 8.973 8.323 0.650 1
1 1027 . 39 1 1 A 89 89 ASN HA H 89 4.354 4.618 -0.264 1
1 1032 . 39 1 1 A 89 89 ASN C C 89 178.382 178.748 -0.366 1
1 1033 . 39 1 1 A 89 89 ASN CA C 89 55.334 55.979 -0.645 1
1 1034 . 39 1 1 A 89 89 ASN CB C 89 37.864 37.901 -0.037 1
1 1035 . 39 1 1 A 89 89 ASN N N 89 121.012 117.620 3.392 1
1 1037 . 39 1 1 A 90 90 GLN H H 90 8.152 7.891 0.261 1
1 1038 . 39 1 1 A 90 90 GLN HA H 90 4.020 4.147 -0.127 1
1 1045 . 39 1 1 A 90 90 GLN C C 90 179.075 178.854 0.221 1
1 1046 . 39 1 1 A 90 90 GLN CA C 90 59.318 58.945 0.373 1
1 1047 . 39 1 1 A 90 90 GLN CB C 90 28.049 28.034 0.015 1
1 1049 . 39 1 1 A 90 90 GLN N N 90 122.122 120.713 1.409 1
1 1051 . 39 1 1 A 91 91 GLN H H 91 7.514 8.497 -0.983 1
1 1052 . 39 1 1 A 91 91 GLN HA H 91 4.053 4.077 -0.024 1
1 1059 . 39 1 1 A 91 91 GLN C C 91 177.081 178.395 -1.314 1
1 1060 . 39 1 1 A 91 91 GLN CA C 91 58.031 58.910 -0.879 1
1 1061 . 39 1 1 A 91 91 GLN CB C 91 28.365 28.389 -0.024 1
1 1063 . 39 1 1 A 91 91 GLN N N 91 118.124 118.954 -0.830 1
1 1065 . 39 1 1 A 92 92 ALA H H 92 7.704 7.016 0.688 1
1 1066 . 39 1 1 A 92 92 ALA HA H 92 4.246 4.362 -0.116 1
1 1070 . 39 1 1 A 92 92 ALA C C 92 178.450 177.910 0.540 1
1 1071 . 39 1 1 A 92 92 ALA CA C 92 52.671 52.121 0.550 1
1 1072 . 39 1 1 A 92 92 ALA CB C 92 19.316 19.510 -0.194 1
1 1073 . 39 1 1 A 92 92 ALA N N 92 119.880 118.735 1.145 1
1 1074 . 39 1 1 A 93 93 GLY H H 93 7.693 8.014 -0.321 1
1 1075 . 39 1 1 A 93 93 GLY HA2 H 93 3.941 3.961 -0.020 1
1 1076 . 39 1 1 A 93 93 GLY HA3 H 93 3.744 3.970 -0.226 1
1 1077 . 39 1 1 A 93 93 GLY C C 93 174.344 174.814 -0.470 1
1 1078 . 39 1 1 A 93 93 GLY CA C 93 45.949 46.611 -0.662 1
1 1079 . 39 1 1 A 93 93 GLY N N 93 105.347 107.365 -2.018 1
1 1080 . 39 1 1 A 94 94 ASN H H 94 7.076 8.523 -1.447 1
1 1081 . 39 1 1 A 94 94 ASN HA H 94 4.115 4.876 -0.761 1
1 1085 . 39 1 1 A 94 94 ASN C C 94 175.410 175.532 -0.122 1
1 1086 . 39 1 1 A 94 94 ASN CA C 94 52.651 52.690 -0.039 1
1 1087 . 39 1 1 A 94 94 ASN CB C 94 38.330 39.961 -1.631 1
1 1088 . 39 1 1 A 94 94 ASN N N 94 115.747 117.828 -2.081 1
1 1090 . 39 1 1 A 95 95 GLY H H 95 8.236 8.512 -0.276 1
1 1091 . 39 1 1 A 95 95 GLY HA2 H 95 3.633 3.487 0.146 1
1 1092 . 39 1 1 A 95 95 GLY HA3 H 95 3.633 3.679 -0.046 1
1 1093 . 39 1 1 A 95 95 GLY C C 95 174.450 172.937 1.513 1
1 1094 . 39 1 1 A 95 95 GLY CA C 95 45.522 46.632 -1.110 1
1 1095 . 39 1 1 A 95 95 GLY N N 95 109.166 108.473 0.693 1
1 1096 . 39 1 1 A 96 96 TRP H H 96 7.899 7.518 0.381 1
1 1097 . 39 1 1 A 96 96 TRP HA H 96 5.241 5.213 0.028 1
1 1106 . 39 1 1 A 96 96 TRP C C 96 175.661 174.744 0.917 1
1 1107 . 39 1 1 A 96 96 TRP CA C 96 55.090 55.907 -0.817 1
1 1108 . 39 1 1 A 96 96 TRP CB C 96 27.138 33.742 -6.604 1
1 1114 . 39 1 1 A 96 96 TRP N N 96 122.840 119.254 3.586 1
1 1116 . 39 1 1 A 97 97 ASP H H 97 7.344 9.029 -1.685 1
1 1117 . 39 1 1 A 97 97 ASP HA H 97 4.829 5.332 -0.503 1
1 1120 . 39 1 1 A 97 97 ASP C C 97 175.019 177.179 -2.160 1
1 1121 . 39 1 1 A 97 97 ASP CA C 97 52.149 53.059 -0.910 1
1 1122 . 39 1 1 A 97 97 ASP CB C 97 42.697 43.888 -1.191 1
1 1123 . 39 1 1 A 97 97 ASP N N 97 126.861 122.798 4.063 1
1 1124 . 39 1 1 A 98 98 PHE H H 98 8.566 9.287 -0.721 1
1 1125 . 39 1 1 A 98 98 PHE HA H 98 3.727 4.368 -0.641 1
1 1133 . 39 1 1 A 98 98 PHE C C 98 177.443 176.575 0.868 1
1 1134 . 39 1 1 A 98 98 PHE CA C 98 62.471 60.116 2.355 1
1 1135 . 39 1 1 A 98 98 PHE CB C 98 39.919 38.128 1.791 1
1 1141 . 39 1 1 A 98 98 PHE N N 98 117.781 120.837 -3.056 1
1 1142 . 39 1 1 A 99 99 ASP H H 99 8.259 8.000 0.259 1
1 1143 . 39 1 1 A 99 99 ASP HA H 99 3.960 4.334 -0.374 1
1 1146 . 39 1 1 A 99 99 ASP C C 99 178.132 178.290 -0.158 1
1 1147 . 39 1 1 A 99 99 ASP CA C 99 57.658 56.291 1.367 1
1 1148 . 39 1 1 A 99 99 ASP CB C 99 38.572 40.303 -1.731 1
1 1149 . 39 1 1 A 99 99 ASP N N 99 121.709 119.835 1.874 1
1 1150 . 39 1 1 A 100 100 MET H H 100 8.008 7.917 0.091 1
1 1151 . 39 1 1 A 100 100 MET HA H 100 3.644 4.338 -0.694 1
1 1156 . 39 1 1 A 100 100 MET C C 100 180.008 177.180 2.828 1
1 1157 . 39 1 1 A 100 100 MET CA C 100 58.598 57.719 0.879 1
1 1158 . 39 1 1 A 100 100 MET CB C 100 33.423 32.702 0.721 1
1 1160 . 39 1 1 A 100 100 MET N N 100 119.668 117.674 1.994 1
1 1161 . 39 1 1 A 101 101 LEU H H 101 7.961 8.310 -0.349 1
1 1162 . 39 1 1 A 101 101 LEU HA H 101 3.523 4.302 -0.779 1
1 1172 . 39 1 1 A 101 101 LEU C C 101 173.873 176.891 -3.018 1
1 1173 . 39 1 1 A 101 101 LEU CA C 101 58.743 54.293 4.450 1
1 1174 . 39 1 1 A 101 101 LEU CB C 101 42.632 41.139 1.493 1
1 1178 . 39 1 1 A 101 101 LEU N N 101 119.752 119.855 -0.103 1
1 1179 . 39 1 1 A 102 102 THR H H 102 6.955 8.189 -1.234 1
1 1180 . 39 1 1 A 102 102 THR HA H 102 4.134 4.517 -0.383 1
1 1185 . 39 1 1 A 102 102 THR C C 102 176.513 175.394 1.119 1
1 1186 . 39 1 1 A 102 102 THR CA C 102 61.125 62.782 -1.657 1
1 1187 . 39 1 1 A 102 102 THR CB C 102 71.415 71.475 -0.060 1
1 1189 . 39 1 1 A 102 102 THR N N 102 124.665 118.155 6.510 1
1 1190 . 39 1 1 A 103 103 GLY H H 103 7.816 7.806 0.010 1
1 1191 . 39 1 1 A 103 103 GLY HA2 H 103 3.824 3.959 -0.135 1
1 1192 . 39 1 1 A 103 103 GLY HA3 H 103 3.824 4.025 -0.201 1
1 1193 . 39 1 1 A 103 103 GLY C C 103 174.126 173.673 0.453 1
1 1194 . 39 1 1 A 103 103 GLY CA C 103 47.805 46.568 1.237 1
1 1195 . 39 1 1 A 103 103 GLY N N 103 114.191 110.314 3.877 1
1 1196 . 39 1 1 A 104 104 SER H H 104 8.860 7.941 0.919 1
1 1197 . 39 1 1 A 104 104 SER HA H 104 4.758 5.050 -0.292 1
1 1200 . 39 1 1 A 104 104 SER C C 104 174.591 173.154 1.437 1
1 1201 . 39 1 1 A 104 104 SER CA C 104 56.755 57.820 -1.065 1
1 1202 . 39 1 1 A 104 104 SER CB C 104 65.050 66.528 -1.478 1
1 1203 . 39 1 1 A 104 104 SER N N 104 114.771 114.506 0.265 1
1 1204 . 39 1 1 A 105 105 GLY H H 105 8.788 7.967 0.821 1
1 1205 . 39 1 1 A 105 105 GLY HA2 H 105 3.733 3.897 -0.164 1
1 1206 . 39 1 1 A 105 105 GLY HA3 H 105 3.733 4.106 -0.373 1
1 1207 . 39 1 1 A 105 105 GLY CA C 105 47.247 45.941 1.306 1
1 1208 . 39 1 1 A 105 105 GLY N N 105 110.394 110.537 -0.143 1
1 1209 . 39 1 1 A 106 106 ASN HA H 106 4.454 4.808 -0.354 1
1 1212 . 39 1 1 A 106 106 ASN C C 106 175.180 175.993 -0.813 1
1 1213 . 39 1 1 A 106 106 ASN CA C 106 54.492 54.551 -0.059 1
1 1214 . 39 1 1 A 106 106 ASN CB C 106 37.282 40.449 -3.167 1
1 1215 . 39 1 1 A 107 107 TYR H H 107 8.241 7.795 0.446 1
1 1216 . 39 1 1 A 107 107 TYR HA H 107 4.335 4.799 -0.464 1
1 1223 . 39 1 1 A 107 107 TYR C C 107 173.954 175.770 -1.816 1
1 1224 . 39 1 1 A 107 107 TYR CA C 107 57.727 57.008 0.719 1
1 1225 . 39 1 1 A 107 107 TYR CB C 107 37.063 38.864 -1.801 1
1 1230 . 39 1 1 A 107 107 TYR N N 107 120.708 111.501 9.207 1
1 1231 . 39 1 1 A 108 108 SER H H 108 7.117 7.579 -0.462 1
1 1232 . 39 1 1 A 108 108 SER HA H 108 4.221 4.610 -0.389 1
1 1235 . 39 1 1 A 108 108 SER C C 108 174.834 173.582 1.252 1
1 1236 . 39 1 1 A 108 108 SER CA C 108 59.859 57.859 2.000 1
1 1237 . 39 1 1 A 108 108 SER CB C 108 63.846 64.894 -1.048 1
1 1238 . 39 1 1 A 108 108 SER N N 108 113.362 116.207 -2.845 1
1 1239 . 39 1 1 A 109 109 SER H H 109 8.053 8.598 -0.545 1
1 1240 . 39 1 1 A 109 109 SER HA H 109 4.560 4.803 -0.243 1
1 1243 . 39 1 1 A 109 109 SER CA C 109 57.141 57.216 -0.075 1
1 1244 . 39 1 1 A 109 109 SER CB C 109 64.874 65.601 -0.727 1
1 1245 . 39 1 1 A 109 109 SER N N 109 116.657 113.536 3.121 1
1 1246 . 39 1 1 A 110 110 THR HA H 110 3.541 3.882 -0.341 1
1 1251 . 39 1 1 A 110 110 THR C C 110 175.477 175.878 -0.401 1
1 1252 . 39 1 1 A 110 110 THR CA C 110 66.443 65.646 0.797 1
1 1253 . 39 1 1 A 110 110 THR CB C 110 68.091 68.691 -0.600 1
1 1255 . 39 1 1 A 111 111 ASP H H 111 8.224 8.153 0.071 1
1 1256 . 39 1 1 A 111 111 ASP HA H 111 4.237 4.100 0.137 1
1 1259 . 39 1 1 A 111 111 ASP C C 111 177.520 178.031 -0.511 1
1 1260 . 39 1 1 A 111 111 ASP CA C 111 57.559 57.329 0.230 1
1 1261 . 39 1 1 A 111 111 ASP CB C 111 40.292 41.160 -0.868 1
1 1262 . 39 1 1 A 111 111 ASP N N 111 119.490 121.353 -1.863 1
1 1263 . 39 1 1 A 112 112 ALA H H 112 7.431 8.091 -0.660 1
1 1264 . 39 1 1 A 112 112 ALA HA H 112 4.191 4.011 0.180 1
1 1268 . 39 1 1 A 112 112 ALA C C 112 180.646 179.724 0.922 1
1 1269 . 39 1 1 A 112 112 ALA CA C 112 54.534 55.425 -0.891 1
1 1270 . 39 1 1 A 112 112 ALA CB C 112 18.992 18.129 0.863 1
1 1271 . 39 1 1 A 112 112 ALA N N 112 119.710 121.410 -1.700 1
1 1272 . 39 1 1 A 113 113 GLN H H 113 7.576 7.964 -0.388 1
1 1273 . 39 1 1 A 113 113 GLN HA H 113 3.562 3.933 -0.371 1
1 1278 . 39 1 1 A 113 113 GLN C C 113 176.756 177.851 -1.095 1
1 1279 . 39 1 1 A 113 113 GLN CA C 113 57.736 58.058 -0.322 1
1 1280 . 39 1 1 A 113 113 GLN CB C 113 29.110 27.737 1.373 1
1 1281 . 39 1 1 A 113 113 GLN N N 113 117.518 117.080 0.438 1
1 1283 . 39 1 1 A 114 114 MET H H 114 8.192 7.678 0.514 1
1 1284 . 39 1 1 A 114 114 MET HA H 114 4.231 3.599 0.632 1
1 1289 . 39 1 1 A 114 114 MET C C 114 175.648 177.944 -2.296 1
1 1290 . 39 1 1 A 114 114 MET CA C 114 57.446 57.819 -0.373 1
1 1291 . 39 1 1 A 114 114 MET CB C 114 33.570 31.738 1.832 1
1 1293 . 39 1 1 A 114 114 MET N N 114 111.509 119.553 -8.044 1
1 1294 . 39 1 1 A 115 115 GLN H H 115 6.940 7.120 -0.180 1
1 1295 . 39 1 1 A 115 115 GLN HA H 115 4.307 4.150 0.157 1
1 1302 . 39 1 1 A 115 115 GLN C C 115 176.270 175.200 1.070 1
1 1303 . 39 1 1 A 115 115 GLN CA C 115 54.680 56.911 -2.231 1
1 1304 . 39 1 1 A 115 115 GLN CB C 115 28.233 28.755 -0.522 1
1 1306 . 39 1 1 A 115 115 GLN N N 115 114.300 116.234 -1.934 1
1 1308 . 39 1 1 A 116 116 TYR H H 116 6.677 7.804 -1.127 1
1 1309 . 39 1 1 A 116 116 TYR HA H 116 4.193 3.995 0.198 1
1 1312 . 39 1 1 A 116 116 TYR C C 116 175.268 174.594 0.674 1
1 1313 . 39 1 1 A 116 116 TYR CA C 116 54.357 58.264 -3.907 1
1 1314 . 39 1 1 A 116 116 TYR CB C 116 35.498 35.103 0.395 1
1 1315 . 39 1 1 A 116 116 TYR N N 116 117.919 116.025 1.894 1
1 1316 . 39 1 1 A 117 117 ASP H H 117 8.081 8.101 -0.020 1
1 1317 . 39 1 1 A 117 117 ASP HA H 117 4.665 4.835 -0.170 1
1 1320 . 39 1 1 A 117 117 ASP CA C 117 52.422 52.997 -0.575 1
1 1321 . 39 1 1 A 117 117 ASP CB C 117 42.416 40.721 1.695 1
1 1322 . 39 1 1 A 117 117 ASP N N 117 120.887 120.014 0.873 1
1 1323 . 39 1 1 A 118 118 PRO C C 118 179.180 178.376 0.804 1
1 1324 . 39 1 1 A 118 118 PRO CA C 118 65.942 65.324 0.618 1
1 1325 . 39 1 1 A 118 118 PRO CB C 118 32.197 31.899 0.298 1
1 1326 . 39 1 1 A 119 119 GLY H H 119 9.742 8.334 1.408 1
1 1327 . 39 1 1 A 119 119 GLY C C 119 175.622 174.992 0.630 1
1 1328 . 39 1 1 A 119 119 GLY CA C 119 46.785 45.777 1.008 1
1 1329 . 39 1 1 A 119 119 GLY N N 119 106.412 105.630 0.782 1
1 1330 . 39 1 1 A 120 120 LEU H H 120 6.666 7.426 -0.760 1
1 1331 . 39 1 1 A 120 120 LEU HA H 120 3.365 3.700 -0.335 1
1 1341 . 39 1 1 A 120 120 LEU C C 120 179.262 178.205 1.057 1
1 1342 . 39 1 1 A 120 120 LEU CA C 120 56.605 56.968 -0.363 1
1 1343 . 39 1 1 A 120 120 LEU CB C 120 39.262 41.565 -2.303 1
1 1347 . 39 1 1 A 120 120 LEU N N 120 126.226 123.022 3.204 1
1 1348 . 39 1 1 A 121 121 PHE H H 121 7.356 8.989 -1.633 1
1 1349 . 39 1 1 A 121 121 PHE HA H 121 4.459 4.090 0.369 1
1 1352 . 39 1 1 A 121 121 PHE C C 121 179.716 178.035 1.681 1
1 1353 . 39 1 1 A 121 121 PHE CA C 121 62.838 62.312 0.526 1
1 1354 . 39 1 1 A 121 121 PHE CB C 121 37.603 39.023 -1.420 1
1 1355 . 39 1 1 A 121 121 PHE N N 121 117.437 119.426 -1.989 1
1 1356 . 39 1 1 A 122 122 ALA H H 122 7.926 7.989 -0.063 1
1 1357 . 39 1 1 A 122 122 ALA HA H 122 4.523 3.781 0.742 1
1 1361 . 39 1 1 A 122 122 ALA C C 122 180.435 179.594 0.841 1
1 1362 . 39 1 1 A 122 122 ALA CA C 122 55.527 55.163 0.364 1
1 1363 . 39 1 1 A 122 122 ALA CB C 122 17.814 18.174 -0.360 1
1 1364 . 39 1 1 A 122 122 ALA N N 122 121.068 121.334 -0.266 1
1 1365 . 39 1 1 A 123 123 GLN H H 123 7.507 7.555 -0.048 1
1 1366 . 39 1 1 A 123 123 GLN HA H 123 4.153 3.983 0.170 1
1 1371 . 39 1 1 A 123 123 GLN C C 123 180.561 178.958 1.603 1
1 1372 . 39 1 1 A 123 123 GLN CA C 123 59.948 58.761 1.187 1
1 1373 . 39 1 1 A 123 123 GLN CB C 123 29.135 28.331 0.804 1
1 1375 . 39 1 1 A 123 123 GLN N N 123 120.324 117.520 2.804 1
1 1376 . 39 1 1 A 124 124 ILE H H 124 8.318 8.034 0.284 1
1 1377 . 39 1 1 A 124 124 ILE HA H 124 3.635 3.895 -0.260 1
1 1387 . 39 1 1 A 124 124 ILE C C 124 176.481 178.181 -1.700 1
1 1388 . 39 1 1 A 124 124 ILE CA C 124 66.432 64.149 2.283 1
1 1389 . 39 1 1 A 124 124 ILE CB C 124 39.168 37.738 1.430 1
1 1393 . 39 1 1 A 124 124 ILE N N 124 123.747 118.086 5.661 1
1 1394 . 39 1 1 A 125 125 GLN H H 125 8.474 7.918 0.556 1
1 1395 . 39 1 1 A 125 125 GLN HA H 125 4.264 4.072 0.192 1
1 1402 . 39 1 1 A 125 125 GLN C C 125 178.947 177.823 1.124 1
1 1403 . 39 1 1 A 125 125 GLN CA C 125 59.651 58.613 1.038 1
1 1404 . 39 1 1 A 125 125 GLN CB C 125 28.880 28.561 0.319 1
1 1406 . 39 1 1 A 125 125 GLN N N 125 120.368 121.194 -0.826 1
1 1408 . 39 1 1 A 126 126 ALA H H 126 8.002 7.878 0.124 1
1 1409 . 39 1 1 A 126 126 ALA HA H 126 4.144 4.003 0.141 1
1 1413 . 39 1 1 A 126 126 ALA C C 126 179.316 179.841 -0.525 1
1 1414 . 39 1 1 A 126 126 ALA CA C 126 55.036 55.062 -0.026 1
1 1415 . 39 1 1 A 126 126 ALA CB C 126 18.087 18.158 -0.071 1
1 1416 . 39 1 1 A 126 126 ALA N N 126 121.661 121.126 0.535 1
1 1417 . 39 1 1 A 127 127 ALA H H 127 7.823 8.031 -0.208 1
1 1418 . 39 1 1 A 127 127 ALA HA H 127 4.162 3.975 0.187 1
1 1422 . 39 1 1 A 127 127 ALA C C 127 180.707 179.582 1.125 1
1 1423 . 39 1 1 A 127 127 ALA CA C 127 55.080 54.895 0.185 1
1 1424 . 39 1 1 A 127 127 ALA CB C 127 19.354 18.190 1.164 1
1 1425 . 39 1 1 A 127 127 ALA N N 127 119.853 120.003 -0.150 1
1 1426 . 39 1 1 A 128 128 ALA H H 128 8.936 7.833 1.103 1
1 1427 . 39 1 1 A 128 128 ALA HA H 128 3.928 3.823 0.105 1
1 1431 . 39 1 1 A 128 128 ALA C C 128 181.031 179.347 1.684 1
1 1432 . 39 1 1 A 128 128 ALA CA C 128 55.502 54.698 0.804 1
1 1433 . 39 1 1 A 128 128 ALA CB C 128 16.609 17.892 -1.283 1
1 1434 . 39 1 1 A 128 128 ALA N N 128 121.355 120.456 0.899 1
1 1435 . 39 1 1 A 129 129 THR H H 129 8.543 7.735 0.808 1
1 1436 . 39 1 1 A 129 129 THR HA H 129 4.015 3.741 0.274 1
1 1441 . 39 1 1 A 129 129 THR C C 129 177.332 176.450 0.882 1
1 1442 . 39 1 1 A 129 129 THR CA C 129 65.893 65.603 0.290 1
1 1443 . 39 1 1 A 129 129 THR CB C 129 68.566 68.171 0.395 1
1 1445 . 39 1 1 A 129 129 THR N N 129 112.709 111.286 1.423 1
1 1446 . 39 1 1 A 130 130 LYS H H 130 8.126 7.323 0.803 1
1 1447 . 39 1 1 A 130 130 LYS HA H 130 4.000 4.043 -0.043 1
1 1456 . 39 1 1 A 130 130 LYS C C 130 179.082 178.627 0.455 1
1 1457 . 39 1 1 A 130 130 LYS CA C 130 60.299 58.490 1.809 1
1 1458 . 39 1 1 A 130 130 LYS CB C 130 32.767 31.767 1.000 1
1 1462 . 39 1 1 A 130 130 LYS N N 130 123.879 121.997 1.882 1
1 1463 . 39 1 1 A 131 131 ALA H H 131 7.184 7.729 -0.545 1
1 1464 . 39 1 1 A 131 131 ALA HA H 131 4.005 4.331 -0.326 1
1 1468 . 39 1 1 A 131 131 ALA C C 131 178.482 179.556 -1.074 1
1 1469 . 39 1 1 A 131 131 ALA CA C 131 55.027 55.100 -0.073 1
1 1470 . 39 1 1 A 131 131 ALA CB C 131 18.669 19.645 -0.976 1
1 1471 . 39 1 1 A 131 131 ALA N N 131 118.590 121.214 -2.624 1
1 1472 . 39 1 1 A 132 132 TRP H H 132 7.977 8.678 -0.701 1
1 1473 . 39 1 1 A 132 132 TRP HA H 132 4.001 4.330 -0.329 1
1 1480 . 39 1 1 A 132 132 TRP C C 132 177.332 175.778 1.554 1
1 1481 . 39 1 1 A 132 132 TRP CA C 132 60.431 57.447 2.984 1
1 1482 . 39 1 1 A 132 132 TRP CB C 132 27.786 27.747 0.039 1
1 1486 . 39 1 1 A 132 132 TRP N N 132 119.168 117.068 2.100 1
1 1488 . 39 1 1 A 133 133 ARG H H 133 8.006 8.068 -0.062 1
1 1489 . 39 1 1 A 133 133 ARG HA H 133 4.027 4.342 -0.315 1
1 1497 . 39 1 1 A 133 133 ARG C C 133 176.664 177.717 -1.053 1
1 1498 . 39 1 1 A 133 133 ARG CA C 133 59.355 57.289 2.066 1
1 1499 . 39 1 1 A 133 133 ARG CB C 133 30.451 32.206 -1.755 1
1 1502 . 39 1 1 A 133 133 ARG N N 133 113.062 120.676 -7.614 1
1 1504 . 39 1 1 A 134 134 LYS H H 134 7.322 7.757 -0.435 1
1 1505 . 39 1 1 A 134 134 LYS HA H 134 4.313 4.450 -0.137 1
1 1514 . 39 1 1 A 134 134 LYS C C 134 176.282 175.863 0.419 1
1 1515 . 39 1 1 A 134 134 LYS CA C 134 54.922 56.514 -1.592 1
1 1516 . 39 1 1 A 134 134 LYS CB C 134 32.633 31.434 1.199 1
1 1520 . 39 1 1 A 134 134 LYS N N 134 118.170 119.429 -1.259 1
1 1521 . 39 1 1 A 135 135 LEU H H 135 7.440 8.063 -0.623 1
1 1522 . 39 1 1 A 135 135 LEU HA H 135 4.174 4.588 -0.414 1
1 1532 . 39 1 1 A 135 135 LEU CA C 135 54.408 51.839 2.569 1
1 1533 . 39 1 1 A 135 135 LEU CB C 135 40.407 41.616 -1.209 1
1 1537 . 39 1 1 A 135 135 LEU N N 135 123.358 121.330 2.028 1
1 1538 . 39 1 1 A 136 136 PRO HA H 136 4.437 4.502 -0.065 1
1 1545 . 39 1 1 A 136 136 PRO C C 136 177.106 175.820 1.286 1
1 1546 . 39 1 1 A 136 136 PRO CA C 136 62.889 65.142 -2.253 1
1 1547 . 39 1 1 A 136 136 PRO CB C 136 32.192 32.031 0.161 1
1 1550 . 39 1 1 A 137 137 VAL H H 137 8.219 7.373 0.846 1
1 1551 . 39 1 1 A 137 137 VAL HA H 137 4.077 4.426 -0.349 1
1 1559 . 39 1 1 A 137 137 VAL C C 137 176.305 175.986 0.319 1
1 1560 . 39 1 1 A 137 137 VAL CA C 137 61.958 59.331 2.627 1
1 1561 . 39 1 1 A 137 137 VAL CB C 137 32.755 35.290 -2.535 1
1 1564 . 39 1 1 A 137 137 VAL N N 137 120.079 111.214 8.865 1
1 1565 . 39 1 1 A 138 138 LYS H H 138 8.444 8.716 -0.272 1
1 1566 . 39 1 1 A 138 138 LYS HA H 138 4.316 4.122 0.194 1
1 1575 . 39 1 1 A 138 138 LYS C C 138 176.790 177.810 -1.020 1
1 1576 . 39 1 1 A 138 138 LYS CA C 138 56.792 59.218 -2.426 1
1 1577 . 39 1 1 A 138 138 LYS CB C 138 33.205 33.464 -0.259 1
1 1581 . 39 1 1 A 138 138 LYS N N 138 126.449 122.696 3.753 1
1 1582 . 39 1 1 A 139 139 GLY H H 139 8.518 7.765 0.753 1
1 1583 . 39 1 1 A 139 139 GLY HA2 H 139 4.070 4.142 -0.072 1
1 1584 . 39 1 1 A 139 139 GLY HA3 H 139 3.897 4.143 -0.246 1
1 1585 . 39 1 1 A 139 139 GLY C C 139 172.874 173.862 -0.988 1
1 1586 . 39 1 1 A 139 139 GLY CA C 139 45.157 46.018 -0.861 1
1 1587 . 39 1 1 A 139 139 GLY N N 139 112.617 106.418 6.199 1
1 6 . 40 1 1 A 2 2 VAL H H 2 8.992 8.728 0.264 1
1 7 . 40 1 1 A 2 2 VAL HA H 2 5.370 4.608 0.762 1
1 15 . 40 1 1 A 2 2 VAL C C 2 174.325 174.760 -0.435 1
1 16 . 40 1 1 A 2 2 VAL CA C 2 61.267 60.692 0.575 1
1 17 . 40 1 1 A 2 2 VAL CB C 2 33.890 33.973 -0.083 1
1 20 . 40 1 1 A 2 2 VAL N N 2 126.939 119.590 7.349 1
1 21 . 40 1 1 A 3 3 THR H H 3 8.912 9.200 -0.288 1
1 22 . 40 1 1 A 3 3 THR HA H 3 4.505 5.104 -0.599 1
1 27 . 40 1 1 A 3 3 THR C C 3 172.710 173.472 -0.762 1
1 28 . 40 1 1 A 3 3 THR CA C 3 59.689 59.758 -0.069 1
1 29 . 40 1 1 A 3 3 THR CB C 3 72.398 71.841 0.557 1
1 31 . 40 1 1 A 3 3 THR N N 3 118.091 122.936 -4.845 1
1 32 . 40 1 1 A 4 4 GLU H H 4 8.631 8.923 -0.292 1
1 33 . 40 1 1 A 4 4 GLU HA H 4 5.788 5.343 0.445 1
1 38 . 40 1 1 A 4 4 GLU C C 4 175.758 174.820 0.938 1
1 39 . 40 1 1 A 4 4 GLU CA C 4 54.902 54.266 0.636 1
1 40 . 40 1 1 A 4 4 GLU CB C 4 35.097 33.237 1.860 1
1 42 . 40 1 1 A 4 4 GLU N N 4 120.966 123.440 -2.474 1
1 43 . 40 1 1 A 5 5 THR H H 5 9.188 8.695 0.493 1
1 44 . 40 1 1 A 5 5 THR HA H 5 4.739 4.748 -0.009 1
1 49 . 40 1 1 A 5 5 THR C C 5 172.757 172.185 0.572 1
1 50 . 40 1 1 A 5 5 THR CA C 5 60.382 60.889 -0.507 1
1 51 . 40 1 1 A 5 5 THR CB C 5 71.558 71.362 0.196 1
1 53 . 40 1 1 A 5 5 THR N N 5 119.366 114.408 4.958 1
1 54 . 40 1 1 A 6 6 VAL H H 6 8.476 8.628 -0.152 1
1 55 . 40 1 1 A 6 6 VAL HA H 6 5.026 5.092 -0.066 1
1 63 . 40 1 1 A 6 6 VAL C C 6 176.674 174.960 1.714 1
1 64 . 40 1 1 A 6 6 VAL CA C 6 61.008 60.994 0.014 1
1 65 . 40 1 1 A 6 6 VAL CB C 6 33.861 34.257 -0.396 1
1 68 . 40 1 1 A 6 6 VAL N N 6 121.384 127.405 -6.021 1
1 69 . 40 1 1 A 7 7 ASP H H 7 8.848 8.943 -0.095 1
1 70 . 40 1 1 A 7 7 ASP HA H 7 4.797 4.724 0.073 1
1 73 . 40 1 1 A 7 7 ASP CA C 7 52.834 54.517 -1.683 1
1 74 . 40 1 1 A 7 7 ASP CB C 7 42.219 42.086 0.133 1
1 75 . 40 1 1 A 7 7 ASP N N 7 127.061 126.988 0.073 1
1 76 . 40 1 1 A 8 8 GLY C C 8 175.143 175.032 0.111 1
1 77 . 40 1 1 A 8 8 GLY CA C 8 46.553 46.657 -0.104 1
1 78 . 40 1 1 A 9 9 GLN H H 9 8.408 7.369 1.039 1
1 79 . 40 1 1 A 9 9 GLN HA H 9 4.541 4.412 0.129 1
1 86 . 40 1 1 A 9 9 GLN C C 9 176.463 176.296 0.167 1
1 87 . 40 1 1 A 9 9 GLN CA C 9 55.167 55.343 -0.176 1
1 88 . 40 1 1 A 9 9 GLN CB C 9 29.376 29.479 -0.103 1
1 90 . 40 1 1 A 9 9 GLN N N 9 118.300 117.818 0.482 1
1 92 . 40 1 1 A 10 10 GLY H H 10 8.162 8.381 -0.219 1
1 93 . 40 1 1 A 10 10 GLY HA2 H 10 4.174 3.981 0.193 1
1 94 . 40 1 1 A 10 10 GLY HA3 H 10 3.521 3.994 -0.473 1
1 95 . 40 1 1 A 10 10 GLY C C 10 174.092 174.002 0.090 1
1 96 . 40 1 1 A 10 10 GLY CA C 10 45.558 46.509 -0.951 1
1 97 . 40 1 1 A 10 10 GLY N N 10 108.747 109.410 -0.663 1
1 98 . 40 1 1 A 11 11 GLN H H 11 8.507 7.838 0.669 1
1 99 . 40 1 1 A 11 11 GLN HA H 11 4.202 4.958 -0.756 1
1 106 . 40 1 1 A 11 11 GLN C C 11 173.992 174.517 -0.525 1
1 107 . 40 1 1 A 11 11 GLN CA C 11 55.098 54.306 0.792 1
1 108 . 40 1 1 A 11 11 GLN CB C 11 29.097 31.842 -2.745 1
1 110 . 40 1 1 A 11 11 GLN N N 11 122.979 116.185 6.794 1
1 112 . 40 1 1 A 12 12 ALA H H 12 8.259 8.737 -0.478 1
1 113 . 40 1 1 A 12 12 ALA HA H 12 5.156 5.601 -0.445 1
1 117 . 40 1 1 A 12 12 ALA C C 12 177.284 176.812 0.472 1
1 118 . 40 1 1 A 12 12 ALA CA C 12 51.087 50.412 0.675 1
1 119 . 40 1 1 A 12 12 ALA CB C 12 20.500 21.367 -0.867 1
1 120 . 40 1 1 A 12 12 ALA N N 12 127.100 123.845 3.255 1
1 121 . 40 1 1 A 13 13 TRP H H 13 9.245 9.805 -0.560 1
1 122 . 40 1 1 A 13 13 TRP HA H 13 4.717 5.361 -0.644 1
1 131 . 40 1 1 A 13 13 TRP C C 13 175.108 175.608 -0.500 1
1 132 . 40 1 1 A 13 13 TRP CA C 13 55.966 55.892 0.074 1
1 133 . 40 1 1 A 13 13 TRP CB C 13 31.912 33.896 -1.984 1
1 139 . 40 1 1 A 13 13 TRP N N 13 123.088 121.358 1.730 1
1 141 . 40 1 1 A 14 14 ARG H H 14 8.575 8.949 -0.374 1
1 142 . 40 1 1 A 14 14 ARG HA H 14 5.335 5.451 -0.116 1
1 150 . 40 1 1 A 14 14 ARG C C 14 175.191 175.252 -0.061 1
1 151 . 40 1 1 A 14 14 ARG CA C 14 53.106 54.520 -1.414 1
1 152 . 40 1 1 A 14 14 ARG CB C 14 32.749 34.777 -2.028 1
1 154 . 40 1 1 A 14 14 ARG N N 14 121.163 120.766 0.397 1
1 156 . 40 1 1 A 15 15 HIS H H 15 8.595 9.440 -0.845 1
1 157 . 40 1 1 A 15 15 HIS HA H 15 4.790 5.034 -0.244 1
1 161 . 40 1 1 A 15 15 HIS C C 15 173.770 174.380 -0.610 1
1 162 . 40 1 1 A 15 15 HIS CA C 15 55.289 54.852 0.437 1
1 163 . 40 1 1 A 15 15 HIS CB C 15 33.208 33.822 -0.614 1
1 165 . 40 1 1 A 15 15 HIS N N 15 117.643 119.504 -1.861 1
1 166 . 40 1 1 A 16 16 HIS H H 16 8.993 9.328 -0.335 1
1 167 . 40 1 1 A 16 16 HIS HA H 16 5.158 4.876 0.282 1
1 171 . 40 1 1 A 16 16 HIS C C 16 173.608 175.333 -1.725 1
1 172 . 40 1 1 A 16 16 HIS CA C 16 56.450 55.711 0.739 1
1 173 . 40 1 1 A 16 16 HIS CB C 16 34.171 31.148 3.023 1
1 175 . 40 1 1 A 16 16 HIS N N 16 123.520 119.858 3.662 1
1 176 . 40 1 1 A 17 17 ASN H H 17 7.829 8.992 -1.163 1
1 177 . 40 1 1 A 17 17 ASN HA H 17 4.713 5.305 -0.592 1
1 182 . 40 1 1 A 17 17 ASN C C 17 173.682 175.966 -2.284 1
1 183 . 40 1 1 A 17 17 ASN CA C 17 51.822 51.790 0.032 1
1 184 . 40 1 1 A 17 17 ASN CB C 17 43.176 41.504 1.672 1
1 185 . 40 1 1 A 17 17 ASN N N 17 122.213 120.568 1.645 1
1 187 . 40 1 1 A 18 18 GLY H H 18 8.423 8.478 -0.055 1
1 188 . 40 1 1 A 18 18 GLY HA2 H 18 3.931 3.768 0.163 1
1 189 . 40 1 1 A 18 18 GLY HA3 H 18 3.707 3.929 -0.222 1
1 190 . 40 1 1 A 18 18 GLY C C 18 173.985 173.168 0.817 1
1 191 . 40 1 1 A 18 18 GLY CA C 18 43.949 46.926 -2.977 1
1 192 . 40 1 1 A 18 18 GLY N N 18 106.991 109.760 -2.769 1
1 193 . 40 1 1 A 19 19 PHE H H 19 8.338 7.793 0.545 1
1 194 . 40 1 1 A 19 19 PHE HA H 19 4.068 5.334 -1.266 1
1 197 . 40 1 1 A 19 19 PHE C C 19 176.568 174.165 2.403 1
1 198 . 40 1 1 A 19 19 PHE CA C 19 59.338 56.668 2.670 1
1 199 . 40 1 1 A 19 19 PHE CB C 19 40.201 43.694 -3.493 1
1 200 . 40 1 1 A 19 19 PHE N N 19 116.857 114.600 2.257 1
1 201 . 40 1 1 A 20 20 ASP H H 20 8.794 8.721 0.073 1
1 202 . 40 1 1 A 20 20 ASP HA H 20 4.485 4.820 -0.335 1
1 205 . 40 1 1 A 20 20 ASP C C 20 177.379 176.215 1.164 1
1 206 . 40 1 1 A 20 20 ASP CA C 20 54.140 53.274 0.866 1
1 207 . 40 1 1 A 20 20 ASP CB C 20 41.915 41.046 0.869 1
1 208 . 40 1 1 A 20 20 ASP N N 20 123.025 124.160 -1.135 1
1 209 . 40 1 1 A 21 21 PHE H H 21 8.862 9.048 -0.186 1
1 210 . 40 1 1 A 21 21 PHE HA H 21 4.087 4.050 0.037 1
1 218 . 40 1 1 A 21 21 PHE C C 21 176.952 177.172 -0.220 1
1 219 . 40 1 1 A 21 21 PHE CA C 21 61.095 62.417 -1.322 1
1 220 . 40 1 1 A 21 21 PHE CB C 21 38.678 39.516 -0.838 1
1 226 . 40 1 1 A 21 21 PHE N N 21 127.163 127.290 -0.127 1
1 227 . 40 1 1 A 22 22 ALA H H 22 8.561 8.358 0.203 1
1 228 . 40 1 1 A 22 22 ALA HA H 22 3.878 3.958 -0.080 1
1 232 . 40 1 1 A 22 22 ALA C C 22 180.710 180.184 0.526 1
1 233 . 40 1 1 A 22 22 ALA CA C 22 55.211 55.169 0.042 1
1 234 . 40 1 1 A 22 22 ALA CB C 22 18.321 18.348 -0.027 1
1 235 . 40 1 1 A 22 22 ALA N N 22 120.293 121.207 -0.914 1
1 236 . 40 1 1 A 23 23 VAL H H 23 7.241 7.615 -0.374 1
1 237 . 40 1 1 A 23 23 VAL HA H 23 3.684 3.493 0.191 1
1 245 . 40 1 1 A 23 23 VAL C C 23 177.101 178.063 -0.962 1
1 246 . 40 1 1 A 23 23 VAL CA C 23 65.237 66.922 -1.685 1
1 247 . 40 1 1 A 23 23 VAL CB C 23 31.780 31.592 0.188 1
1 250 . 40 1 1 A 23 23 VAL N N 23 118.775 117.948 0.827 1
1 251 . 40 1 1 A 24 24 ILE H H 24 6.761 7.918 -1.157 1
1 252 . 40 1 1 A 24 24 ILE HA H 24 3.196 3.564 -0.368 1
1 262 . 40 1 1 A 24 24 ILE C C 24 177.287 178.265 -0.978 1
1 263 . 40 1 1 A 24 24 ILE CA C 24 63.404 65.527 -2.123 1
1 264 . 40 1 1 A 24 24 ILE CB C 24 36.294 37.480 -1.186 1
1 268 . 40 1 1 A 24 24 ILE N N 24 119.036 119.272 -0.236 1
1 269 . 40 1 1 A 25 25 LYS H H 25 8.032 8.104 -0.072 1
1 270 . 40 1 1 A 25 25 LYS HA H 25 3.809 3.612 0.197 1
1 279 . 40 1 1 A 25 25 LYS C C 25 179.450 177.648 1.802 1
1 280 . 40 1 1 A 25 25 LYS CA C 25 59.621 58.726 0.895 1
1 281 . 40 1 1 A 25 25 LYS CB C 25 32.259 31.552 0.707 1
1 285 . 40 1 1 A 25 25 LYS N N 25 118.368 120.835 -2.467 1
1 286 . 40 1 1 A 26 26 GLU H H 26 7.845 7.748 0.097 1
1 287 . 40 1 1 A 26 26 GLU HA H 26 4.021 4.165 -0.144 1
1 292 . 40 1 1 A 26 26 GLU C C 26 179.191 178.898 0.293 1
1 293 . 40 1 1 A 26 26 GLU CA C 26 59.530 58.785 0.745 1
1 294 . 40 1 1 A 26 26 GLU CB C 26 29.449 29.362 0.087 1
1 296 . 40 1 1 A 26 26 GLU N N 26 120.522 118.728 1.794 1
1 297 . 40 1 1 A 27 27 LEU H H 27 8.165 8.104 0.061 1
1 298 . 40 1 1 A 27 27 LEU HA H 27 4.163 4.072 0.091 1
1 308 . 40 1 1 A 27 27 LEU C C 27 177.256 178.340 -1.084 1
1 309 . 40 1 1 A 27 27 LEU CA C 27 58.049 57.597 0.452 1
1 310 . 40 1 1 A 27 27 LEU CB C 27 41.365 41.441 -0.076 1
1 314 . 40 1 1 A 27 27 LEU N N 27 120.879 121.257 -0.378 1
1 315 . 40 1 1 A 28 28 LYS H H 28 8.902 8.092 0.810 1
1 316 . 40 1 1 A 28 28 LYS HA H 28 4.199 4.209 -0.010 1
1 317 . 40 1 1 A 28 28 LYS C C 28 179.707 179.382 0.325 1
1 318 . 40 1 1 A 28 28 LYS CA C 28 60.097 59.237 0.860 1
1 319 . 40 1 1 A 28 28 LYS CB C 28 33.420 31.801 1.619 1
1 320 . 40 1 1 A 28 28 LYS N N 28 120.050 119.406 0.644 1
1 321 . 40 1 1 A 29 29 THR H H 29 8.294 8.125 0.169 1
1 322 . 40 1 1 A 29 29 THR HA H 29 3.892 3.952 -0.060 1
1 327 . 40 1 1 A 29 29 THR C C 29 175.711 176.459 -0.748 1
1 328 . 40 1 1 A 29 29 THR CA C 29 66.846 66.450 0.396 1
1 329 . 40 1 1 A 29 29 THR CB C 29 68.794 68.739 0.055 1
1 331 . 40 1 1 A 29 29 THR N N 29 115.933 116.287 -0.354 1
1 332 . 40 1 1 A 30 30 ALA H H 30 8.244 8.553 -0.309 1
1 333 . 40 1 1 A 30 30 ALA HA H 30 4.241 4.259 -0.018 1
1 337 . 40 1 1 A 30 30 ALA C C 30 179.128 179.344 -0.216 1
1 338 . 40 1 1 A 30 30 ALA CA C 30 55.714 55.615 0.099 1
1 339 . 40 1 1 A 30 30 ALA CB C 30 18.955 18.173 0.782 1
1 340 . 40 1 1 A 30 30 ALA N N 30 124.617 123.172 1.445 1
1 341 . 40 1 1 A 31 31 ALA H H 31 8.968 8.540 0.428 1
1 342 . 40 1 1 A 31 31 ALA HA H 31 3.890 4.051 -0.161 1
1 346 . 40 1 1 A 31 31 ALA C C 31 180.352 179.803 0.549 1
1 347 . 40 1 1 A 31 31 ALA CA C 31 55.454 55.486 -0.032 1
1 348 . 40 1 1 A 31 31 ALA CB C 31 17.124 18.302 -1.178 1
1 349 . 40 1 1 A 31 31 ALA N N 31 119.327 120.353 -1.026 1
1 350 . 40 1 1 A 32 32 SER H H 32 7.995 7.983 0.012 1
1 351 . 40 1 1 A 32 32 SER HA H 32 4.238 4.362 -0.124 1
1 354 . 40 1 1 A 32 32 SER C C 32 175.612 175.400 0.212 1
1 355 . 40 1 1 A 32 32 SER CA C 32 61.203 61.127 0.076 1
1 356 . 40 1 1 A 32 32 SER CB C 32 63.406 63.274 0.132 1
1 357 . 40 1 1 A 32 32 SER N N 32 111.962 113.829 -1.867 1
1 358 . 40 1 1 A 33 33 GLN H H 33 8.333 8.031 0.302 1
1 359 . 40 1 1 A 33 33 GLN HA H 33 3.992 4.357 -0.365 1
1 366 . 40 1 1 A 33 33 GLN C C 33 177.486 177.258 0.228 1
1 367 . 40 1 1 A 33 33 GLN CA C 33 58.277 57.790 0.487 1
1 368 . 40 1 1 A 33 33 GLN CB C 33 29.140 30.091 -0.951 1
1 370 . 40 1 1 A 33 33 GLN N N 33 119.527 118.728 0.799 1
1 372 . 40 1 1 A 34 34 TYR H H 34 8.587 8.262 0.325 1
1 373 . 40 1 1 A 34 34 TYR HA H 34 4.792 4.562 0.230 1
1 380 . 40 1 1 A 34 34 TYR C C 34 176.499 176.693 -0.194 1
1 381 . 40 1 1 A 34 34 TYR CA C 34 57.711 59.173 -1.462 1
1 382 . 40 1 1 A 34 34 TYR CB C 34 39.561 39.135 0.426 1
1 387 . 40 1 1 A 34 34 TYR N N 34 114.610 115.099 -0.489 1
1 388 . 40 1 1 A 35 35 GLY H H 35 7.346 8.356 -1.010 1
1 389 . 40 1 1 A 35 35 GLY HA2 H 35 4.785 4.098 0.687 1
1 390 . 40 1 1 A 35 35 GLY HA3 H 35 4.007 4.105 -0.098 1
1 391 . 40 1 1 A 35 35 GLY C C 35 175.796 173.261 2.535 1
1 392 . 40 1 1 A 35 35 GLY CA C 35 44.355 44.789 -0.434 1
1 393 . 40 1 1 A 35 35 GLY N N 35 108.501 106.432 2.069 1
1 394 . 40 1 1 A 36 36 ALA H H 36 9.363 8.263 1.100 1
1 395 . 40 1 1 A 36 36 ALA HA H 36 4.217 4.752 -0.535 1
1 399 . 40 1 1 A 36 36 ALA C C 36 178.039 177.551 0.488 1
1 400 . 40 1 1 A 36 36 ALA CA C 36 56.114 51.793 4.321 1
1 401 . 40 1 1 A 36 36 ALA CB C 36 19.179 19.500 -0.321 1
1 402 . 40 1 1 A 36 36 ALA N N 36 125.811 123.044 2.767 1
1 403 . 40 1 1 A 37 37 THR H H 37 8.070 8.914 -0.844 1
1 404 . 40 1 1 A 37 37 THR HA H 37 4.570 4.542 0.028 1
1 409 . 40 1 1 A 37 37 THR C C 37 173.685 174.182 -0.497 1
1 410 . 40 1 1 A 37 37 THR CA C 37 59.822 62.598 -2.776 1
1 411 . 40 1 1 A 37 37 THR CB C 37 68.267 71.394 -3.127 1
1 413 . 40 1 1 A 37 37 THR N N 37 129.410 118.211 11.199 1
1 414 . 40 1 1 A 38 38 ALA H H 38 6.853 7.548 -0.695 1
1 415 . 40 1 1 A 38 38 ALA HA H 38 4.601 4.522 0.079 1
1 419 . 40 1 1 A 38 38 ALA CA C 38 50.758 50.659 0.099 1
1 420 . 40 1 1 A 38 38 ALA CB C 38 18.325 19.989 -1.664 1
1 421 . 40 1 1 A 38 38 ALA N N 38 124.674 124.321 0.353 1
1 422 . 40 1 1 A 40 40 TYR HA H 40 4.032 4.046 -0.014 1
1 429 . 40 1 1 A 40 40 TYR C C 40 176.456 177.281 -0.825 1
1 430 . 40 1 1 A 40 40 TYR CA C 40 61.010 61.896 -0.886 1
1 431 . 40 1 1 A 40 40 TYR CB C 40 39.286 38.724 0.562 1
1 436 . 40 1 1 A 41 41 THR H H 41 6.874 7.897 -1.023 1
1 437 . 40 1 1 A 41 41 THR HA H 41 3.616 3.655 -0.039 1
1 442 . 40 1 1 A 41 41 THR C C 41 176.930 176.527 0.403 1
1 443 . 40 1 1 A 41 41 THR CA C 41 65.557 65.348 0.209 1
1 444 . 40 1 1 A 41 41 THR CB C 41 68.228 69.159 -0.931 1
1 446 . 40 1 1 A 41 41 THR N N 41 115.143 113.942 1.201 1
1 447 . 40 1 1 A 42 42 LEU H H 42 8.623 7.356 1.267 1
1 448 . 40 1 1 A 42 42 LEU HA H 42 3.708 4.040 -0.332 1
1 458 . 40 1 1 A 42 42 LEU C C 42 178.206 179.040 -0.834 1
1 459 . 40 1 1 A 42 42 LEU CA C 42 57.417 57.797 -0.380 1
1 460 . 40 1 1 A 42 42 LEU CB C 42 41.342 41.203 0.139 1
1 464 . 40 1 1 A 42 42 LEU N N 42 120.418 118.161 2.257 1
1 465 . 40 1 1 A 43 43 ALA H H 43 7.735 7.829 -0.094 1
1 466 . 40 1 1 A 43 43 ALA HA H 43 4.020 4.008 0.012 1
1 470 . 40 1 1 A 43 43 ALA C C 43 180.826 180.086 0.740 1
1 471 . 40 1 1 A 43 43 ALA CA C 43 54.925 54.749 0.176 1
1 472 . 40 1 1 A 43 43 ALA CB C 43 17.506 18.038 -0.532 1
1 473 . 40 1 1 A 43 43 ALA N N 43 120.203 121.804 -1.601 1
1 474 . 40 1 1 A 44 44 ILE H H 44 7.149 7.393 -0.244 1
1 475 . 40 1 1 A 44 44 ILE HA H 44 3.603 3.631 -0.028 1
1 485 . 40 1 1 A 44 44 ILE C C 44 178.594 178.428 0.166 1
1 486 . 40 1 1 A 44 44 ILE CA C 44 64.782 63.819 0.963 1
1 487 . 40 1 1 A 44 44 ILE CB C 44 37.472 36.934 0.538 1
1 491 . 40 1 1 A 44 44 ILE N N 44 118.881 119.121 -0.240 1
1 492 . 40 1 1 A 45 45 VAL H H 45 7.968 7.904 0.064 1
1 493 . 40 1 1 A 45 45 VAL HA H 45 2.925 3.377 -0.452 1
1 501 . 40 1 1 A 45 45 VAL C C 45 177.023 177.160 -0.137 1
1 502 . 40 1 1 A 45 45 VAL CA C 45 67.081 66.793 0.288 1
1 503 . 40 1 1 A 45 45 VAL CB C 45 30.854 30.953 -0.099 1
1 506 . 40 1 1 A 45 45 VAL N N 45 120.764 120.116 0.648 1
1 507 . 40 1 1 A 46 46 GLU H H 46 8.399 8.187 0.212 1
1 508 . 40 1 1 A 46 46 GLU HA H 46 3.848 3.868 -0.020 1
1 513 . 40 1 1 A 46 46 GLU C C 46 178.656 179.344 -0.688 1
1 514 . 40 1 1 A 46 46 GLU CA C 46 59.491 59.494 -0.003 1
1 515 . 40 1 1 A 46 46 GLU CB C 46 28.991 29.335 -0.344 1
1 517 . 40 1 1 A 46 46 GLU N N 46 116.599 119.839 -3.240 1
1 518 . 40 1 1 A 47 47 SER H H 47 7.273 7.665 -0.392 1
1 519 . 40 1 1 A 47 47 SER HA H 47 4.287 4.171 0.116 1
1 521 . 40 1 1 A 47 47 SER CA C 47 61.047 61.157 -0.110 1
1 522 . 40 1 1 A 47 47 SER CB C 47 63.016 63.098 -0.082 1
1 523 . 40 1 1 A 47 47 SER N N 47 113.609 115.550 -1.941 1
1 524 . 40 1 1 A 48 48 VAL H H 48 8.006 7.771 0.235 1
1 525 . 40 1 1 A 48 48 VAL HA H 48 3.556 3.647 -0.091 1
1 533 . 40 1 1 A 48 48 VAL C C 48 177.257 178.000 -0.743 1
1 534 . 40 1 1 A 48 48 VAL CA C 48 65.025 66.244 -1.219 1
1 535 . 40 1 1 A 48 48 VAL CB C 48 31.841 31.497 0.344 1
1 538 . 40 1 1 A 48 48 VAL N N 48 122.327 121.024 1.303 1
1 539 . 40 1 1 A 49 49 ALA H H 49 8.369 7.834 0.535 1
1 540 . 40 1 1 A 49 49 ALA HA H 49 4.115 4.296 -0.181 1
1 544 . 40 1 1 A 49 49 ALA C C 49 177.307 178.360 -1.053 1
1 545 . 40 1 1 A 49 49 ALA CA C 49 53.253 53.584 -0.331 1
1 546 . 40 1 1 A 49 49 ALA CB C 49 20.131 18.266 1.865 1
1 547 . 40 1 1 A 49 49 ALA N N 49 118.050 121.050 -3.000 1
1 548 . 40 1 1 A 50 50 ASP H H 50 7.052 7.585 -0.533 1
1 549 . 40 1 1 A 50 50 ASP HA H 50 4.788 4.637 0.151 1
1 552 . 40 1 1 A 50 50 ASP C C 50 175.481 176.282 -0.801 1
1 553 . 40 1 1 A 50 50 ASP CA C 50 53.681 55.541 -1.860 1
1 554 . 40 1 1 A 50 50 ASP CB C 50 39.333 41.046 -1.713 1
1 555 . 40 1 1 A 50 50 ASP N N 50 116.997 117.884 -0.887 1
1 556 . 40 1 1 A 51 51 ASN H H 51 8.535 7.583 0.952 1
1 557 . 40 1 1 A 51 51 ASN HA H 51 4.628 4.787 -0.159 1
1 562 . 40 1 1 A 51 51 ASN C C 51 174.077 174.549 -0.472 1
1 563 . 40 1 1 A 51 51 ASN CA C 51 52.315 51.914 0.401 1
1 564 . 40 1 1 A 51 51 ASN CB C 51 41.928 40.577 1.351 1
1 565 . 40 1 1 A 51 51 ASN N N 51 118.626 117.239 1.387 1
1 567 . 40 1 1 A 52 52 TRP H H 52 8.555 8.576 -0.021 1
1 574 . 40 1 1 A 52 52 TRP C C 52 173.269 176.230 -2.961 1
1 575 . 40 1 1 A 52 52 TRP CA C 52 55.031 55.644 -0.613 1
1 576 . 40 1 1 A 52 52 TRP CB C 52 26.801 30.820 -4.019 1
1 582 . 40 1 1 A 52 52 TRP N N 52 120.693 119.356 1.337 1
1 584 . 40 1 1 A 53 53 LEU H H 53 7.847 8.766 -0.919 1
1 585 . 40 1 1 A 53 53 LEU HA H 53 4.859 4.832 0.027 1
1 595 . 40 1 1 A 53 53 LEU C C 53 177.397 175.282 2.115 1
1 596 . 40 1 1 A 53 53 LEU CA C 53 53.619 53.457 0.162 1
1 597 . 40 1 1 A 53 53 LEU CB C 53 41.812 45.564 -3.752 1
1 601 . 40 1 1 A 53 53 LEU N N 53 124.741 120.330 4.411 1
1 602 . 40 1 1 A 54 54 THR H H 54 8.850 8.892 -0.042 1
1 603 . 40 1 1 A 54 54 THR HA H 54 4.598 4.669 -0.071 1
1 608 . 40 1 1 A 54 54 THR CA C 54 60.531 59.181 1.350 1
1 609 . 40 1 1 A 54 54 THR CB C 54 67.183 69.243 -2.060 1
1 611 . 40 1 1 A 54 54 THR N N 54 113.407 111.000 2.407 1
1 612 . 40 1 1 A 55 55 PRO HA H 55 4.511 4.181 0.330 1
1 619 . 40 1 1 A 55 55 PRO C C 55 179.383 178.757 0.626 1
1 620 . 40 1 1 A 55 55 PRO CA C 55 67.159 64.674 2.485 1
1 621 . 40 1 1 A 55 55 PRO CB C 55 32.095 31.696 0.399 1
1 622 . 40 1 1 A 56 56 THR H H 56 8.575 7.732 0.843 1
1 623 . 40 1 1 A 56 56 THR HA H 56 4.229 4.073 0.156 1
1 628 . 40 1 1 A 56 56 THR C C 56 176.668 176.003 0.665 1
1 629 . 40 1 1 A 56 56 THR CA C 56 66.943 65.874 1.069 1
1 630 . 40 1 1 A 56 56 THR CB C 56 68.129 68.185 -0.056 1
1 632 . 40 1 1 A 56 56 THR N N 56 114.855 112.177 2.678 1
1 633 . 40 1 1 A 57 57 ASP H H 57 8.730 8.036 0.694 1
1 634 . 40 1 1 A 57 57 ASP HA H 57 4.425 4.694 -0.269 1
1 637 . 40 1 1 A 57 57 ASP C C 57 178.351 179.256 -0.905 1
1 638 . 40 1 1 A 57 57 ASP CA C 57 57.963 57.678 0.285 1
1 639 . 40 1 1 A 57 57 ASP CB C 57 40.134 40.710 -0.576 1
1 640 . 40 1 1 A 57 57 ASP N N 57 126.239 120.171 6.068 1
1 641 . 40 1 1 A 58 58 TRP H H 58 8.244 8.422 -0.178 1
1 642 . 40 1 1 A 58 58 TRP HA H 58 4.030 4.554 -0.524 1
1 650 . 40 1 1 A 58 58 TRP C C 58 177.432 179.244 -1.812 1
1 651 . 40 1 1 A 58 58 TRP CA C 58 62.731 60.249 2.482 1
1 652 . 40 1 1 A 58 58 TRP CB C 58 29.122 29.416 -0.294 1
1 657 . 40 1 1 A 58 58 TRP N N 58 119.241 120.490 -1.249 1
1 659 . 40 1 1 A 59 59 ASN H H 59 8.098 8.851 -0.753 1
1 660 . 40 1 1 A 59 59 ASN HA H 59 4.424 4.390 0.034 1
1 663 . 40 1 1 A 59 59 ASN C C 59 176.952 177.868 -0.916 1
1 664 . 40 1 1 A 59 59 ASN CA C 59 58.135 56.497 1.638 1
1 665 . 40 1 1 A 59 59 ASN CB C 59 40.168 38.173 1.995 1
1 666 . 40 1 1 A 59 59 ASN N N 59 115.747 117.866 -2.119 1
1 667 . 40 1 1 A 60 60 THR H H 60 8.712 7.941 0.771 1
1 668 . 40 1 1 A 60 60 THR HA H 60 3.717 4.037 -0.320 1
1 673 . 40 1 1 A 60 60 THR C C 60 176.044 176.475 -0.431 1
1 674 . 40 1 1 A 60 60 THR CA C 60 66.576 67.190 -0.614 1
1 675 . 40 1 1 A 60 60 THR CB C 60 69.251 67.742 1.509 1
1 677 . 40 1 1 A 60 60 THR N N 60 114.896 118.227 -3.331 1
1 678 . 40 1 1 A 61 61 LEU H H 61 8.485 8.472 0.013 1
1 679 . 40 1 1 A 61 61 LEU HA H 61 3.391 3.930 -0.539 1
1 689 . 40 1 1 A 61 61 LEU C C 61 177.433 178.641 -1.208 1
1 690 . 40 1 1 A 61 61 LEU CA C 61 58.354 58.605 -0.251 1
1 691 . 40 1 1 A 61 61 LEU CB C 61 41.761 42.295 -0.534 1
1 695 . 40 1 1 A 61 61 LEU N N 61 123.433 121.922 1.511 1
1 696 . 40 1 1 A 62 62 VAL H H 62 8.073 8.334 -0.261 1
1 697 . 40 1 1 A 62 62 VAL HA H 62 3.207 3.725 -0.518 1
1 705 . 40 1 1 A 62 62 VAL C C 62 177.585 177.322 0.263 1
1 706 . 40 1 1 A 62 62 VAL CA C 62 67.345 65.131 2.214 1
1 707 . 40 1 1 A 62 62 VAL CB C 62 30.905 30.530 0.375 1
1 710 . 40 1 1 A 62 62 VAL N N 62 116.018 118.245 -2.227 1
1 711 . 40 1 1 A 63 63 ARG H H 63 7.765 8.088 -0.323 1
1 712 . 40 1 1 A 63 63 ARG HA H 63 3.602 4.054 -0.452 1
1 719 . 40 1 1 A 63 63 ARG C C 63 177.818 178.022 -0.204 1
1 720 . 40 1 1 A 63 63 ARG CA C 63 58.049 58.001 0.048 1
1 721 . 40 1 1 A 63 63 ARG CB C 63 29.955 29.113 0.842 1
1 724 . 40 1 1 A 63 63 ARG N N 63 116.700 120.353 -3.653 1
1 725 . 40 1 1 A 64 64 ALA H H 64 7.574 7.490 0.084 1
1 726 . 40 1 1 A 64 64 ALA HA H 64 4.158 4.378 -0.220 1
1 730 . 40 1 1 A 64 64 ALA C C 64 179.886 179.224 0.662 1
1 731 . 40 1 1 A 64 64 ALA CA C 64 54.007 53.532 0.475 1
1 732 . 40 1 1 A 64 64 ALA CB C 64 19.147 19.926 -0.779 1
1 733 . 40 1 1 A 64 64 ALA N N 64 117.555 121.684 -4.129 1
1 734 . 40 1 1 A 65 65 VAL H H 65 7.554 8.120 -0.566 1
1 735 . 40 1 1 A 65 65 VAL HA H 65 4.253 3.719 0.534 1
1 743 . 40 1 1 A 65 65 VAL C C 65 174.180 175.108 -0.928 1
1 744 . 40 1 1 A 65 65 VAL CA C 65 62.683 65.204 -2.521 1
1 745 . 40 1 1 A 65 65 VAL CB C 65 33.458 31.641 1.817 1
1 748 . 40 1 1 A 65 65 VAL N N 65 110.013 117.529 -7.516 1
1 749 . 40 1 1 A 66 66 LEU H H 66 7.792 7.429 0.363 1
1 750 . 40 1 1 A 66 66 LEU HA H 66 4.790 4.767 0.023 1
1 760 . 40 1 1 A 66 66 LEU C C 66 177.537 174.308 3.229 1
1 761 . 40 1 1 A 66 66 LEU CA C 66 52.823 53.646 -0.823 1
1 762 . 40 1 1 A 66 66 LEU CB C 66 44.071 45.763 -1.692 1
1 766 . 40 1 1 A 66 66 LEU N N 66 118.967 121.757 -2.790 1
1 767 . 40 1 1 A 67 67 SER H H 67 9.208 8.635 0.573 1
1 768 . 40 1 1 A 67 67 SER HA H 67 4.414 4.976 -0.562 1
1 771 . 40 1 1 A 67 67 SER CA C 67 57.943 56.328 1.615 1
1 772 . 40 1 1 A 67 67 SER CB C 67 64.743 66.581 -1.838 1
1 773 . 40 1 1 A 67 67 SER N N 67 116.378 119.083 -2.705 1
1 774 . 40 1 1 A 69 69 GLY HA2 H 69 3.916 3.784 0.132 1
1 775 . 40 1 1 A 69 69 GLY HA3 H 69 3.867 3.808 0.059 1
1 776 . 40 1 1 A 69 69 GLY C C 69 176.783 175.540 1.243 1
1 777 . 40 1 1 A 69 69 GLY CA C 69 46.977 46.534 0.443 1
1 778 . 40 1 1 A 70 70 ASP H H 70 7.674 8.135 -0.461 1
1 779 . 40 1 1 A 70 70 ASP HA H 70 4.511 3.707 0.804 1
1 782 . 40 1 1 A 70 70 ASP C C 70 178.096 178.439 -0.343 1
1 783 . 40 1 1 A 70 70 ASP CA C 70 57.262 56.505 0.757 1
1 784 . 40 1 1 A 70 70 ASP CB C 70 40.594 39.707 0.887 1
1 785 . 40 1 1 A 70 70 ASP N N 70 123.930 122.008 1.922 1
1 786 . 40 1 1 A 71 71 HIS H H 71 8.729 7.793 0.936 1
1 787 . 40 1 1 A 71 71 HIS HA H 71 4.235 4.171 0.064 1
1 790 . 40 1 1 A 71 71 HIS C C 71 176.769 176.667 0.102 1
1 791 . 40 1 1 A 71 71 HIS CA C 71 60.041 59.962 0.079 1
1 792 . 40 1 1 A 71 71 HIS CB C 71 30.682 30.321 0.361 1
1 793 . 40 1 1 A 71 71 HIS N N 71 121.003 119.528 1.475 1
1 794 . 40 1 1 A 72 72 LEU H H 72 7.620 7.994 -0.374 1
1 795 . 40 1 1 A 72 72 LEU HA H 72 3.769 3.997 -0.228 1
1 805 . 40 1 1 A 72 72 LEU C C 72 180.275 179.203 1.072 1
1 806 . 40 1 1 A 72 72 LEU CA C 72 58.192 57.999 0.193 1
1 807 . 40 1 1 A 72 72 LEU CB C 72 41.381 41.291 0.090 1
1 811 . 40 1 1 A 72 72 LEU N N 72 118.569 118.576 -0.007 1
1 812 . 40 1 1 A 73 73 LEU H H 73 7.542 7.447 0.095 1
1 813 . 40 1 1 A 73 73 LEU HA H 73 4.107 4.288 -0.181 1
1 823 . 40 1 1 A 73 73 LEU C C 73 179.436 179.183 0.253 1
1 824 . 40 1 1 A 73 73 LEU CA C 73 58.026 57.318 0.708 1
1 825 . 40 1 1 A 73 73 LEU CB C 73 41.638 42.162 -0.524 1
1 829 . 40 1 1 A 73 73 LEU N N 73 121.418 120.317 1.101 1
1 830 . 40 1 1 A 74 74 TRP H H 74 8.786 8.000 0.786 1
1 831 . 40 1 1 A 74 74 TRP HA H 74 3.589 5.311 -1.722 1
1 840 . 40 1 1 A 74 74 TRP C C 74 176.816 178.676 -1.860 1
1 841 . 40 1 1 A 74 74 TRP CA C 74 63.046 59.810 3.236 1
1 842 . 40 1 1 A 74 74 TRP CB C 74 28.065 28.935 -0.870 1
1 848 . 40 1 1 A 74 74 TRP N N 74 121.111 118.207 2.904 1
1 850 . 40 1 1 A 75 75 LYS H H 75 8.939 7.530 1.409 1
1 851 . 40 1 1 A 75 75 LYS HA H 75 3.055 4.112 -1.057 1
1 860 . 40 1 1 A 75 75 LYS C C 75 177.967 179.130 -1.163 1
1 861 . 40 1 1 A 75 75 LYS CA C 75 60.029 58.506 1.523 1
1 862 . 40 1 1 A 75 75 LYS CB C 75 32.533 32.788 -0.255 1
1 866 . 40 1 1 A 75 75 LYS N N 75 119.783 118.750 1.033 1
1 867 . 40 1 1 A 76 76 SER H H 76 7.832 7.952 -0.120 1
1 868 . 40 1 1 A 76 76 SER HA H 76 4.040 4.489 -0.449 1
1 871 . 40 1 1 A 76 76 SER C C 76 177.816 177.141 0.675 1
1 872 . 40 1 1 A 76 76 SER CA C 76 62.105 61.545 0.560 1
1 873 . 40 1 1 A 76 76 SER CB C 76 62.679 63.142 -0.463 1
1 874 . 40 1 1 A 76 76 SER N N 76 113.395 114.870 -1.475 1
1 875 . 40 1 1 A 77 77 GLU H H 77 7.590 7.758 -0.168 1
1 876 . 40 1 1 A 77 77 GLU HA H 77 4.042 4.350 -0.308 1
1 881 . 40 1 1 A 77 77 GLU C C 77 177.809 178.533 -0.724 1
1 882 . 40 1 1 A 77 77 GLU CA C 77 58.270 58.619 -0.349 1
1 883 . 40 1 1 A 77 77 GLU CB C 77 29.208 29.370 -0.162 1
1 885 . 40 1 1 A 77 77 GLU N N 77 121.574 122.126 -0.552 1
1 886 . 40 1 1 A 78 78 PHE H H 78 9.081 7.902 1.179 1
1 887 . 40 1 1 A 78 78 PHE HA H 78 3.778 4.220 -0.442 1
1 895 . 40 1 1 A 78 78 PHE C C 78 178.114 177.467 0.647 1
1 896 . 40 1 1 A 78 78 PHE CA C 78 60.629 61.391 -0.762 1
1 897 . 40 1 1 A 78 78 PHE CB C 78 38.295 38.830 -0.535 1
1 902 . 40 1 1 A 78 78 PHE N N 78 122.682 122.610 0.072 1
1 903 . 40 1 1 A 79 79 PHE H H 79 8.890 8.088 0.802 1
1 904 . 40 1 1 A 79 79 PHE HA H 79 3.800 4.083 -0.283 1
1 912 . 40 1 1 A 79 79 PHE C C 79 178.354 178.343 0.011 1
1 913 . 40 1 1 A 79 79 PHE CA C 79 60.704 61.865 -1.161 1
1 914 . 40 1 1 A 79 79 PHE CB C 79 37.184 38.529 -1.345 1
1 920 . 40 1 1 A 79 79 PHE N N 79 121.056 118.476 2.580 1
1 921 . 40 1 1 A 80 80 GLU H H 80 7.793 8.402 -0.609 1
1 922 . 40 1 1 A 80 80 GLU HA H 80 4.082 3.989 0.093 1
1 927 . 40 1 1 A 80 80 GLU C C 80 179.068 179.502 -0.434 1
1 928 . 40 1 1 A 80 80 GLU CA C 80 59.735 59.893 -0.158 1
1 929 . 40 1 1 A 80 80 GLU CB C 80 28.722 29.366 -0.644 1
1 931 . 40 1 1 A 80 80 GLU N N 80 120.312 118.660 1.652 1
1 932 . 40 1 1 A 81 81 ASN H H 81 8.624 8.602 0.022 1
1 933 . 40 1 1 A 81 81 ASN HA H 81 4.521 4.526 -0.005 1
1 938 . 40 1 1 A 81 81 ASN C C 81 179.262 178.083 1.179 1
1 939 . 40 1 1 A 81 81 ASN CA C 81 55.504 56.365 -0.861 1
1 940 . 40 1 1 A 81 81 ASN CB C 81 37.517 37.960 -0.443 1
1 941 . 40 1 1 A 81 81 ASN N N 81 119.338 118.661 0.677 1
1 943 . 40 1 1 A 82 82 CYS H H 82 8.554 8.041 0.513 1
1 944 . 40 1 1 A 82 82 CYS HA H 82 3.792 3.999 -0.207 1
1 947 . 40 1 1 A 82 82 CYS C C 82 176.478 177.251 -0.773 1
1 948 . 40 1 1 A 82 82 CYS CA C 82 65.232 63.845 1.387 1
1 949 . 40 1 1 A 82 82 CYS CB C 82 26.762 26.816 -0.054 1
1 950 . 40 1 1 A 82 82 CYS N N 82 120.576 117.510 3.066 1
1 951 . 40 1 1 A 83 83 ARG H H 83 8.522 7.902 0.620 1
1 952 . 40 1 1 A 83 83 ARG HA H 83 3.932 4.225 -0.293 1
1 960 . 40 1 1 A 83 83 ARG C C 83 179.138 178.674 0.464 1
1 961 . 40 1 1 A 83 83 ARG CA C 83 60.443 58.921 1.522 1
1 962 . 40 1 1 A 83 83 ARG CB C 83 29.550 29.661 -0.111 1
1 965 . 40 1 1 A 83 83 ARG N N 83 123.035 119.812 3.223 1
1 967 . 40 1 1 A 84 84 ASP H H 84 7.791 8.033 -0.242 1
1 968 . 40 1 1 A 84 84 ASP HA H 84 4.353 4.409 -0.056 1
1 971 . 40 1 1 A 84 84 ASP C C 84 178.649 178.357 0.292 1
1 972 . 40 1 1 A 84 84 ASP CA C 84 57.767 57.630 0.137 1
1 973 . 40 1 1 A 84 84 ASP CB C 84 41.305 41.642 -0.337 1
1 974 . 40 1 1 A 84 84 ASP N N 84 120.332 119.659 0.673 1
1 975 . 40 1 1 A 85 85 THR H H 85 8.370 7.837 0.533 1
1 976 . 40 1 1 A 85 85 THR HA H 85 3.730 3.989 -0.259 1
1 981 . 40 1 1 A 85 85 THR C C 85 175.198 176.766 -1.568 1
1 982 . 40 1 1 A 85 85 THR CA C 85 66.830 65.156 1.674 1
1 983 . 40 1 1 A 85 85 THR CB C 85 68.533 68.847 -0.314 1
1 985 . 40 1 1 A 85 85 THR N N 85 117.360 113.348 4.012 1
1 986 . 40 1 1 A 86 86 ALA H H 86 8.845 8.392 0.453 1
1 987 . 40 1 1 A 86 86 ALA HA H 86 3.991 4.141 -0.150 1
1 991 . 40 1 1 A 86 86 ALA C C 86 179.980 179.562 0.418 1
1 992 . 40 1 1 A 86 86 ALA CA C 86 55.769 55.731 0.038 1
1 993 . 40 1 1 A 86 86 ALA CB C 86 17.881 18.346 -0.465 1
1 994 . 40 1 1 A 86 86 ALA N N 86 123.613 123.253 0.360 1
1 995 . 40 1 1 A 87 87 LYS H H 87 7.686 8.174 -0.488 1
1 996 . 40 1 1 A 87 87 LYS HA H 87 4.099 3.985 0.114 1
1 1005 . 40 1 1 A 87 87 LYS C C 87 179.592 178.476 1.116 1
1 1006 . 40 1 1 A 87 87 LYS CA C 87 59.708 59.283 0.425 1
1 1007 . 40 1 1 A 87 87 LYS CB C 87 32.054 31.989 0.065 1
1 1011 . 40 1 1 A 87 87 LYS N N 87 119.623 117.016 2.607 1
1 1012 . 40 1 1 A 88 88 ARG H H 88 7.683 7.550 0.133 1
1 1013 . 40 1 1 A 88 88 ARG HA H 88 4.051 4.139 -0.088 1
1 1020 . 40 1 1 A 88 88 ARG C C 88 180.053 178.770 1.283 1
1 1021 . 40 1 1 A 88 88 ARG CA C 88 59.558 58.983 0.575 1
1 1022 . 40 1 1 A 88 88 ARG CB C 88 29.684 29.895 -0.211 1
1 1025 . 40 1 1 A 88 88 ARG N N 88 120.788 119.377 1.411 1
1 1026 . 40 1 1 A 89 89 ASN H H 89 8.973 8.310 0.663 1
1 1027 . 40 1 1 A 89 89 ASN HA H 89 4.354 4.549 -0.195 1
1 1032 . 40 1 1 A 89 89 ASN C C 89 178.382 178.029 0.353 1
1 1033 . 40 1 1 A 89 89 ASN CA C 89 55.334 55.863 -0.529 1
1 1034 . 40 1 1 A 89 89 ASN CB C 89 37.864 38.519 -0.655 1
1 1035 . 40 1 1 A 89 89 ASN N N 89 121.012 117.760 3.252 1
1 1037 . 40 1 1 A 90 90 GLN H H 90 8.152 8.051 0.101 1
1 1038 . 40 1 1 A 90 90 GLN HA H 90 4.020 4.072 -0.052 1
1 1045 . 40 1 1 A 90 90 GLN C C 90 179.075 178.650 0.425 1
1 1046 . 40 1 1 A 90 90 GLN CA C 90 59.318 58.796 0.522 1
1 1047 . 40 1 1 A 90 90 GLN CB C 90 28.049 28.170 -0.121 1
1 1049 . 40 1 1 A 90 90 GLN N N 90 122.122 118.618 3.504 1
1 1051 . 40 1 1 A 91 91 GLN H H 91 7.514 8.132 -0.618 1
1 1052 . 40 1 1 A 91 91 GLN HA H 91 4.053 4.043 0.010 1
1 1059 . 40 1 1 A 91 91 GLN C C 91 177.081 177.626 -0.545 1
1 1060 . 40 1 1 A 91 91 GLN CA C 91 58.031 58.544 -0.513 1
1 1061 . 40 1 1 A 91 91 GLN CB C 91 28.365 27.718 0.647 1
1 1063 . 40 1 1 A 91 91 GLN N N 91 118.124 118.099 0.025 1
1 1065 . 40 1 1 A 92 92 ALA H H 92 7.704 7.347 0.357 1
1 1066 . 40 1 1 A 92 92 ALA HA H 92 4.246 4.291 -0.045 1
1 1070 . 40 1 1 A 92 92 ALA C C 92 178.450 177.965 0.485 1
1 1071 . 40 1 1 A 92 92 ALA CA C 92 52.671 52.241 0.430 1
1 1072 . 40 1 1 A 92 92 ALA CB C 92 19.316 19.442 -0.126 1
1 1073 . 40 1 1 A 92 92 ALA N N 92 119.880 120.059 -0.179 1
1 1074 . 40 1 1 A 93 93 GLY H H 93 7.693 7.527 0.166 1
1 1075 . 40 1 1 A 93 93 GLY HA2 H 93 3.941 3.912 0.029 1
1 1076 . 40 1 1 A 93 93 GLY HA3 H 93 3.744 3.915 -0.171 1
1 1077 . 40 1 1 A 93 93 GLY C C 93 174.344 174.675 -0.331 1
1 1078 . 40 1 1 A 93 93 GLY CA C 93 45.949 46.262 -0.313 1
1 1079 . 40 1 1 A 93 93 GLY N N 93 105.347 106.360 -1.013 1
1 1080 . 40 1 1 A 94 94 ASN H H 94 7.076 8.176 -1.100 1
1 1081 . 40 1 1 A 94 94 ASN HA H 94 4.115 4.401 -0.286 1
1 1085 . 40 1 1 A 94 94 ASN C C 94 175.410 175.496 -0.086 1
1 1086 . 40 1 1 A 94 94 ASN CA C 94 52.651 52.739 -0.088 1
1 1087 . 40 1 1 A 94 94 ASN CB C 94 38.330 38.709 -0.379 1
1 1088 . 40 1 1 A 94 94 ASN N N 94 115.747 116.985 -1.238 1
1 1090 . 40 1 1 A 95 95 GLY H H 95 8.236 7.975 0.261 1
1 1091 . 40 1 1 A 95 95 GLY HA2 H 95 3.633 3.777 -0.144 1
1 1092 . 40 1 1 A 95 95 GLY HA3 H 95 3.633 3.863 -0.230 1
1 1093 . 40 1 1 A 95 95 GLY C C 95 174.450 174.269 0.181 1
1 1094 . 40 1 1 A 95 95 GLY CA C 95 45.522 45.799 -0.277 1
1 1095 . 40 1 1 A 95 95 GLY N N 95 109.166 106.069 3.097 1
1 1096 . 40 1 1 A 96 96 TRP H H 96 7.899 7.657 0.242 1
1 1097 . 40 1 1 A 96 96 TRP HA H 96 5.241 5.011 0.230 1
1 1106 . 40 1 1 A 96 96 TRP C C 96 175.661 176.272 -0.611 1
1 1107 . 40 1 1 A 96 96 TRP CA C 96 55.090 57.101 -2.011 1
1 1108 . 40 1 1 A 96 96 TRP CB C 96 27.138 31.580 -4.442 1
1 1114 . 40 1 1 A 96 96 TRP N N 96 122.840 120.536 2.304 1
1 1116 . 40 1 1 A 97 97 ASP H H 97 7.344 9.022 -1.678 1
1 1117 . 40 1 1 A 97 97 ASP HA H 97 4.829 4.360 0.469 1
1 1120 . 40 1 1 A 97 97 ASP C C 97 175.019 176.183 -1.164 1
1 1121 . 40 1 1 A 97 97 ASP CA C 97 52.149 56.339 -4.190 1
1 1122 . 40 1 1 A 97 97 ASP CB C 97 42.697 38.609 4.088 1
1 1123 . 40 1 1 A 97 97 ASP N N 97 126.861 117.214 9.647 1
1 1124 . 40 1 1 A 98 98 PHE H H 98 8.566 8.460 0.106 1
1 1125 . 40 1 1 A 98 98 PHE HA H 98 3.727 4.213 -0.486 1
1 1133 . 40 1 1 A 98 98 PHE C C 98 177.443 176.797 0.646 1
1 1134 . 40 1 1 A 98 98 PHE CA C 98 62.471 61.091 1.380 1
1 1135 . 40 1 1 A 98 98 PHE CB C 98 39.919 39.870 0.049 1
1 1141 . 40 1 1 A 98 98 PHE N N 98 117.781 121.278 -3.497 1
1 1142 . 40 1 1 A 99 99 ASP H H 99 8.259 8.348 -0.089 1
1 1143 . 40 1 1 A 99 99 ASP HA H 99 3.960 4.222 -0.262 1
1 1146 . 40 1 1 A 99 99 ASP C C 99 178.132 178.392 -0.260 1
1 1147 . 40 1 1 A 99 99 ASP CA C 99 57.658 56.839 0.819 1
1 1148 . 40 1 1 A 99 99 ASP CB C 99 38.572 40.727 -2.155 1
1 1149 . 40 1 1 A 99 99 ASP N N 99 121.709 118.887 2.822 1
1 1150 . 40 1 1 A 100 100 MET H H 100 8.008 8.217 -0.209 1
1 1151 . 40 1 1 A 100 100 MET HA H 100 3.644 4.158 -0.514 1
1 1156 . 40 1 1 A 100 100 MET C C 100 180.008 176.970 3.038 1
1 1157 . 40 1 1 A 100 100 MET CA C 100 58.598 58.398 0.200 1
1 1158 . 40 1 1 A 100 100 MET CB C 100 33.423 32.957 0.466 1
1 1160 . 40 1 1 A 100 100 MET N N 100 119.668 118.251 1.417 1
1 1161 . 40 1 1 A 101 101 LEU H H 101 7.961 7.882 0.079 1
1 1162 . 40 1 1 A 101 101 LEU HA H 101 3.523 4.201 -0.678 1
1 1172 . 40 1 1 A 101 101 LEU C C 101 173.873 176.158 -2.285 1
1 1173 . 40 1 1 A 101 101 LEU CA C 101 58.743 55.601 3.142 1
1 1174 . 40 1 1 A 101 101 LEU CB C 101 42.632 42.558 0.074 1
1 1178 . 40 1 1 A 101 101 LEU N N 101 119.752 119.517 0.235 1
1 1179 . 40 1 1 A 102 102 THR H H 102 6.955 8.491 -1.536 1
1 1180 . 40 1 1 A 102 102 THR HA H 102 4.134 4.755 -0.621 1
1 1185 . 40 1 1 A 102 102 THR C C 102 176.513 173.907 2.606 1
1 1186 . 40 1 1 A 102 102 THR CA C 102 61.125 63.849 -2.724 1
1 1187 . 40 1 1 A 102 102 THR CB C 102 71.415 67.703 3.712 1
1 1189 . 40 1 1 A 102 102 THR N N 102 124.665 118.665 6.000 1
1 1190 . 40 1 1 A 103 103 GLY H H 103 7.816 8.917 -1.101 1
1 1191 . 40 1 1 A 103 103 GLY HA2 H 103 3.824 3.932 -0.108 1
1 1192 . 40 1 1 A 103 103 GLY HA3 H 103 3.824 4.000 -0.176 1
1 1193 . 40 1 1 A 103 103 GLY C C 103 174.126 173.157 0.969 1
1 1194 . 40 1 1 A 103 103 GLY CA C 103 47.805 47.227 0.578 1
1 1195 . 40 1 1 A 103 103 GLY N N 103 114.191 111.795 2.396 1
1 1196 . 40 1 1 A 104 104 SER H H 104 8.860 8.201 0.659 1
1 1197 . 40 1 1 A 104 104 SER HA H 104 4.758 4.667 0.091 1
1 1200 . 40 1 1 A 104 104 SER C C 104 174.591 173.009 1.582 1
1 1201 . 40 1 1 A 104 104 SER CA C 104 56.755 56.781 -0.026 1
1 1202 . 40 1 1 A 104 104 SER CB C 104 65.050 63.635 1.415 1
1 1203 . 40 1 1 A 104 104 SER N N 104 114.771 119.276 -4.505 1
1 1204 . 40 1 1 A 105 105 GLY H H 105 8.788 7.500 1.288 1
1 1205 . 40 1 1 A 105 105 GLY HA2 H 105 3.733 3.866 -0.133 1
1 1206 . 40 1 1 A 105 105 GLY HA3 H 105 3.733 3.991 -0.258 1
1 1207 . 40 1 1 A 105 105 GLY CA C 105 47.247 45.564 1.683 1
1 1208 . 40 1 1 A 105 105 GLY N N 105 110.394 109.605 0.789 1
1 1209 . 40 1 1 A 106 106 ASN HA H 106 4.454 4.790 -0.336 1
1 1212 . 40 1 1 A 106 106 ASN C C 106 175.180 176.403 -1.223 1
1 1213 . 40 1 1 A 106 106 ASN CA C 106 54.492 54.148 0.344 1
1 1214 . 40 1 1 A 106 106 ASN CB C 106 37.282 40.396 -3.114 1
1 1215 . 40 1 1 A 107 107 TYR H H 107 8.241 7.664 0.577 1
1 1216 . 40 1 1 A 107 107 TYR HA H 107 4.335 4.528 -0.193 1
1 1223 . 40 1 1 A 107 107 TYR C C 107 173.954 177.396 -3.442 1
1 1224 . 40 1 1 A 107 107 TYR CA C 107 57.727 57.983 -0.256 1
1 1225 . 40 1 1 A 107 107 TYR CB C 107 37.063 38.749 -1.686 1
1 1230 . 40 1 1 A 107 107 TYR N N 107 120.708 118.036 2.672 1
1 1231 . 40 1 1 A 108 108 SER H H 108 7.117 7.699 -0.582 1
1 1232 . 40 1 1 A 108 108 SER HA H 108 4.221 4.066 0.155 1
1 1235 . 40 1 1 A 108 108 SER C C 108 174.834 174.118 0.716 1
1 1236 . 40 1 1 A 108 108 SER CA C 108 59.859 61.591 -1.732 1
1 1237 . 40 1 1 A 108 108 SER CB C 108 63.846 63.077 0.769 1
1 1238 . 40 1 1 A 108 108 SER N N 108 113.362 117.528 -4.166 1
1 1239 . 40 1 1 A 109 109 SER H H 109 8.053 7.827 0.226 1
1 1240 . 40 1 1 A 109 109 SER HA H 109 4.560 4.187 0.373 1
1 1243 . 40 1 1 A 109 109 SER CA C 109 57.141 60.553 -3.412 1
1 1244 . 40 1 1 A 109 109 SER CB C 109 64.874 61.820 3.054 1
1 1245 . 40 1 1 A 109 109 SER N N 109 116.657 115.980 0.677 1
1 1246 . 40 1 1 A 110 110 THR HA H 110 3.541 3.935 -0.394 1
1 1251 . 40 1 1 A 110 110 THR C C 110 175.477 176.212 -0.735 1
1 1252 . 40 1 1 A 110 110 THR CA C 110 66.443 65.526 0.917 1
1 1253 . 40 1 1 A 110 110 THR CB C 110 68.091 68.534 -0.443 1
1 1255 . 40 1 1 A 111 111 ASP H H 111 8.224 8.151 0.073 1
1 1256 . 40 1 1 A 111 111 ASP HA H 111 4.237 4.230 0.007 1
1 1259 . 40 1 1 A 111 111 ASP C C 111 177.520 178.103 -0.583 1
1 1260 . 40 1 1 A 111 111 ASP CA C 111 57.559 57.513 0.046 1
1 1261 . 40 1 1 A 111 111 ASP CB C 111 40.292 41.460 -1.168 1
1 1262 . 40 1 1 A 111 111 ASP N N 111 119.490 122.056 -2.566 1
1 1263 . 40 1 1 A 112 112 ALA H H 112 7.431 8.607 -1.176 1
1 1264 . 40 1 1 A 112 112 ALA HA H 112 4.191 4.045 0.146 1
1 1268 . 40 1 1 A 112 112 ALA C C 112 180.646 179.504 1.142 1
1 1269 . 40 1 1 A 112 112 ALA CA C 112 54.534 54.928 -0.394 1
1 1270 . 40 1 1 A 112 112 ALA CB C 112 18.992 18.047 0.945 1
1 1271 . 40 1 1 A 112 112 ALA N N 112 119.710 121.990 -2.280 1
1 1272 . 40 1 1 A 113 113 GLN H H 113 7.576 7.460 0.116 1
1 1273 . 40 1 1 A 113 113 GLN HA H 113 3.562 4.153 -0.591 1
1 1278 . 40 1 1 A 113 113 GLN C C 113 176.756 178.191 -1.435 1
1 1279 . 40 1 1 A 113 113 GLN CA C 113 57.736 58.366 -0.630 1
1 1280 . 40 1 1 A 113 113 GLN CB C 113 29.110 28.258 0.852 1
1 1281 . 40 1 1 A 113 113 GLN N N 113 117.518 117.509 0.009 1
1 1283 . 40 1 1 A 114 114 MET H H 114 8.192 8.250 -0.058 1
1 1284 . 40 1 1 A 114 114 MET HA H 114 4.231 3.957 0.274 1
1 1289 . 40 1 1 A 114 114 MET C C 114 175.648 177.266 -1.618 1
1 1290 . 40 1 1 A 114 114 MET CA C 114 57.446 58.588 -1.142 1
1 1291 . 40 1 1 A 114 114 MET CB C 114 33.570 31.822 1.748 1
1 1293 . 40 1 1 A 114 114 MET N N 114 111.509 119.698 -8.189 1
1 1294 . 40 1 1 A 115 115 GLN H H 115 6.940 7.822 -0.882 1
1 1295 . 40 1 1 A 115 115 GLN HA H 115 4.307 4.183 0.124 1
1 1302 . 40 1 1 A 115 115 GLN C C 115 176.270 175.295 0.975 1
1 1303 . 40 1 1 A 115 115 GLN CA C 115 54.680 54.610 0.070 1
1 1304 . 40 1 1 A 115 115 GLN CB C 115 28.233 27.740 0.493 1
1 1306 . 40 1 1 A 115 115 GLN N N 115 114.300 114.821 -0.521 1
1 1308 . 40 1 1 A 116 116 TYR H H 116 6.677 7.297 -0.620 1
1 1309 . 40 1 1 A 116 116 TYR HA H 116 4.193 4.362 -0.169 1
1 1312 . 40 1 1 A 116 116 TYR C C 116 175.268 175.301 -0.033 1
1 1313 . 40 1 1 A 116 116 TYR CA C 116 54.357 57.908 -3.551 1
1 1314 . 40 1 1 A 116 116 TYR CB C 116 35.498 38.285 -2.787 1
1 1315 . 40 1 1 A 116 116 TYR N N 116 117.919 119.903 -1.984 1
1 1316 . 40 1 1 A 117 117 ASP H H 117 8.081 8.611 -0.530 1
1 1317 . 40 1 1 A 117 117 ASP HA H 117 4.665 4.507 0.158 1
1 1320 . 40 1 1 A 117 117 ASP CA C 117 52.422 52.485 -0.063 1
1 1321 . 40 1 1 A 117 117 ASP CB C 117 42.416 40.068 2.348 1
1 1322 . 40 1 1 A 117 117 ASP N N 117 120.887 124.101 -3.214 1
1 1323 . 40 1 1 A 118 118 PRO C C 118 179.180 178.977 0.203 1
1 1324 . 40 1 1 A 118 118 PRO CA C 118 65.942 65.621 0.321 1
1 1325 . 40 1 1 A 118 118 PRO CB C 118 32.197 31.799 0.398 1
1 1326 . 40 1 1 A 119 119 GLY H H 119 9.742 8.082 1.660 1
1 1327 . 40 1 1 A 119 119 GLY C C 119 175.622 175.373 0.249 1
1 1328 . 40 1 1 A 119 119 GLY CA C 119 46.785 46.654 0.131 1
1 1329 . 40 1 1 A 119 119 GLY N N 119 106.412 105.597 0.815 1
1 1330 . 40 1 1 A 120 120 LEU H H 120 6.666 7.529 -0.863 1
1 1331 . 40 1 1 A 120 120 LEU HA H 120 3.365 3.627 -0.262 1
1 1341 . 40 1 1 A 120 120 LEU C C 120 179.262 178.616 0.646 1
1 1342 . 40 1 1 A 120 120 LEU CA C 120 56.605 57.793 -1.188 1
1 1343 . 40 1 1 A 120 120 LEU CB C 120 39.262 41.246 -1.984 1
1 1347 . 40 1 1 A 120 120 LEU N N 120 126.226 122.359 3.867 1
1 1348 . 40 1 1 A 121 121 PHE H H 121 7.356 8.748 -1.392 1
1 1349 . 40 1 1 A 121 121 PHE HA H 121 4.459 3.916 0.543 1
1 1352 . 40 1 1 A 121 121 PHE C C 121 179.716 177.378 2.338 1
1 1353 . 40 1 1 A 121 121 PHE CA C 121 62.838 62.087 0.751 1
1 1354 . 40 1 1 A 121 121 PHE CB C 121 37.603 39.160 -1.557 1
1 1355 . 40 1 1 A 121 121 PHE N N 121 117.437 119.521 -2.084 1
1 1356 . 40 1 1 A 122 122 ALA H H 122 7.926 8.014 -0.088 1
1 1357 . 40 1 1 A 122 122 ALA HA H 122 4.523 3.786 0.737 1
1 1361 . 40 1 1 A 122 122 ALA C C 122 180.435 179.851 0.584 1
1 1362 . 40 1 1 A 122 122 ALA CA C 122 55.527 55.274 0.253 1
1 1363 . 40 1 1 A 122 122 ALA CB C 122 17.814 18.159 -0.345 1
1 1364 . 40 1 1 A 122 122 ALA N N 122 121.068 121.466 -0.398 1
1 1365 . 40 1 1 A 123 123 GLN H H 123 7.507 7.716 -0.209 1
1 1366 . 40 1 1 A 123 123 GLN HA H 123 4.153 4.031 0.122 1
1 1371 . 40 1 1 A 123 123 GLN C C 123 180.561 178.012 2.549 1
1 1372 . 40 1 1 A 123 123 GLN CA C 123 59.948 58.621 1.327 1
1 1373 . 40 1 1 A 123 123 GLN CB C 123 29.135 28.531 0.604 1
1 1375 . 40 1 1 A 123 123 GLN N N 123 120.324 117.441 2.883 1
1 1376 . 40 1 1 A 124 124 ILE H H 124 8.318 8.026 0.292 1
1 1377 . 40 1 1 A 124 124 ILE HA H 124 3.635 3.889 -0.254 1
1 1387 . 40 1 1 A 124 124 ILE C C 124 176.481 178.145 -1.664 1
1 1388 . 40 1 1 A 124 124 ILE CA C 124 66.432 64.528 1.904 1
1 1389 . 40 1 1 A 124 124 ILE CB C 124 39.168 37.832 1.336 1
1 1393 . 40 1 1 A 124 124 ILE N N 124 123.747 119.247 4.500 1
1 1394 . 40 1 1 A 125 125 GLN H H 125 8.474 7.981 0.493 1
1 1395 . 40 1 1 A 125 125 GLN HA H 125 4.264 3.908 0.356 1
1 1402 . 40 1 1 A 125 125 GLN C C 125 178.947 177.743 1.204 1
1 1403 . 40 1 1 A 125 125 GLN CA C 125 59.651 58.527 1.124 1
1 1404 . 40 1 1 A 125 125 GLN CB C 125 28.880 28.476 0.404 1
1 1406 . 40 1 1 A 125 125 GLN N N 125 120.368 121.038 -0.670 1
1 1408 . 40 1 1 A 126 126 ALA H H 126 8.002 7.901 0.101 1
1 1409 . 40 1 1 A 126 126 ALA HA H 126 4.144 4.013 0.131 1
1 1413 . 40 1 1 A 126 126 ALA C C 126 179.316 179.567 -0.251 1
1 1414 . 40 1 1 A 126 126 ALA CA C 126 55.036 54.998 0.038 1
1 1415 . 40 1 1 A 126 126 ALA CB C 126 18.087 18.145 -0.058 1
1 1416 . 40 1 1 A 126 126 ALA N N 126 121.661 121.198 0.463 1
1 1417 . 40 1 1 A 127 127 ALA H H 127 7.823 8.382 -0.559 1
1 1418 . 40 1 1 A 127 127 ALA HA H 127 4.162 4.002 0.160 1
1 1422 . 40 1 1 A 127 127 ALA C C 127 180.707 179.338 1.369 1
1 1423 . 40 1 1 A 127 127 ALA CA C 127 55.080 54.818 0.262 1
1 1424 . 40 1 1 A 127 127 ALA CB C 127 19.354 18.317 1.037 1
1 1425 . 40 1 1 A 127 127 ALA N N 127 119.853 119.940 -0.087 1
1 1426 . 40 1 1 A 128 128 ALA H H 128 8.936 7.634 1.302 1
1 1427 . 40 1 1 A 128 128 ALA HA H 128 3.928 3.726 0.202 1
1 1431 . 40 1 1 A 128 128 ALA C C 128 181.031 179.008 2.023 1
1 1432 . 40 1 1 A 128 128 ALA CA C 128 55.502 54.627 0.875 1
1 1433 . 40 1 1 A 128 128 ALA CB C 128 16.609 17.702 -1.093 1
1 1434 . 40 1 1 A 128 128 ALA N N 128 121.355 120.265 1.090 1
1 1435 . 40 1 1 A 129 129 THR H H 129 8.543 7.317 1.226 1
1 1436 . 40 1 1 A 129 129 THR HA H 129 4.015 3.667 0.348 1
1 1441 . 40 1 1 A 129 129 THR C C 129 177.332 175.874 1.458 1
1 1442 . 40 1 1 A 129 129 THR CA C 129 65.893 64.865 1.028 1
1 1443 . 40 1 1 A 129 129 THR CB C 129 68.566 68.488 0.078 1
1 1445 . 40 1 1 A 129 129 THR N N 129 112.709 112.168 0.541 1
1 1446 . 40 1 1 A 130 130 LYS H H 130 8.126 7.771 0.355 1
1 1447 . 40 1 1 A 130 130 LYS HA H 130 4.000 3.986 0.014 1
1 1456 . 40 1 1 A 130 130 LYS C C 130 179.082 178.551 0.531 1
1 1457 . 40 1 1 A 130 130 LYS CA C 130 60.299 58.829 1.470 1
1 1458 . 40 1 1 A 130 130 LYS CB C 130 32.767 32.132 0.635 1
1 1462 . 40 1 1 A 130 130 LYS N N 130 123.879 120.656 3.223 1
1 1463 . 40 1 1 A 131 131 ALA H H 131 7.184 7.840 -0.656 1
1 1464 . 40 1 1 A 131 131 ALA HA H 131 4.005 4.256 -0.251 1
1 1468 . 40 1 1 A 131 131 ALA C C 131 178.482 179.544 -1.062 1
1 1469 . 40 1 1 A 131 131 ALA CA C 131 55.027 55.210 -0.183 1
1 1470 . 40 1 1 A 131 131 ALA CB C 131 18.669 19.553 -0.884 1
1 1471 . 40 1 1 A 131 131 ALA N N 131 118.590 120.691 -2.101 1
1 1472 . 40 1 1 A 132 132 TRP H H 132 7.977 8.664 -0.687 1
1 1473 . 40 1 1 A 132 132 TRP HA H 132 4.001 4.275 -0.274 1
1 1480 . 40 1 1 A 132 132 TRP C C 132 177.332 175.831 1.501 1
1 1481 . 40 1 1 A 132 132 TRP CA C 132 60.431 57.430 3.001 1
1 1482 . 40 1 1 A 132 132 TRP CB C 132 27.786 27.590 0.196 1
1 1486 . 40 1 1 A 132 132 TRP N N 132 119.168 117.014 2.154 1
1 1488 . 40 1 1 A 133 133 ARG H H 133 8.006 8.152 -0.146 1
1 1489 . 40 1 1 A 133 133 ARG HA H 133 4.027 4.397 -0.370 1
1 1497 . 40 1 1 A 133 133 ARG C C 133 176.664 178.326 -1.662 1
1 1498 . 40 1 1 A 133 133 ARG CA C 133 59.355 57.048 2.307 1
1 1499 . 40 1 1 A 133 133 ARG CB C 133 30.451 32.225 -1.774 1
1 1502 . 40 1 1 A 133 133 ARG N N 133 113.062 120.573 -7.511 1
1 1504 . 40 1 1 A 134 134 LYS H H 134 7.322 7.758 -0.436 1
1 1505 . 40 1 1 A 134 134 LYS HA H 134 4.313 4.252 0.061 1
1 1514 . 40 1 1 A 134 134 LYS C C 134 176.282 176.311 -0.029 1
1 1515 . 40 1 1 A 134 134 LYS CA C 134 54.922 57.314 -2.392 1
1 1516 . 40 1 1 A 134 134 LYS CB C 134 32.633 31.743 0.890 1
1 1520 . 40 1 1 A 134 134 LYS N N 134 118.170 117.758 0.412 1
1 1521 . 40 1 1 A 135 135 LEU H H 135 7.440 7.842 -0.402 1
1 1522 . 40 1 1 A 135 135 LEU HA H 135 4.174 4.557 -0.383 1
1 1532 . 40 1 1 A 135 135 LEU CA C 135 54.408 53.102 1.306 1
1 1533 . 40 1 1 A 135 135 LEU CB C 135 40.407 41.102 -0.695 1
1 1537 . 40 1 1 A 135 135 LEU N N 135 123.358 122.079 1.279 1
1 1538 . 40 1 1 A 136 136 PRO HA H 136 4.437 4.591 -0.154 1
1 1545 . 40 1 1 A 136 136 PRO C C 136 177.106 175.057 2.049 1
1 1546 . 40 1 1 A 136 136 PRO CA C 136 62.889 62.404 0.485 1
1 1547 . 40 1 1 A 136 136 PRO CB C 136 32.192 33.114 -0.922 1
1 1550 . 40 1 1 A 137 137 VAL H H 137 8.219 8.220 -0.001 1
1 1551 . 40 1 1 A 137 137 VAL HA H 137 4.077 4.786 -0.709 1
1 1559 . 40 1 1 A 137 137 VAL C C 137 176.305 174.583 1.722 1
1 1560 . 40 1 1 A 137 137 VAL CA C 137 61.958 60.345 1.613 1
1 1561 . 40 1 1 A 137 137 VAL CB C 137 32.755 35.871 -3.116 1
1 1564 . 40 1 1 A 137 137 VAL N N 137 120.079 119.265 0.814 1
1 1565 . 40 1 1 A 138 138 LYS H H 138 8.444 8.306 0.138 1
1 1566 . 40 1 1 A 138 138 LYS HA H 138 4.316 4.123 0.193 1
1 1575 . 40 1 1 A 138 138 LYS C C 138 176.790 176.933 -0.143 1
1 1576 . 40 1 1 A 138 138 LYS CA C 138 56.792 58.086 -1.294 1
1 1577 . 40 1 1 A 138 138 LYS CB C 138 33.205 32.778 0.427 1
1 1581 . 40 1 1 A 138 138 LYS N N 138 126.449 126.268 0.181 1
1 1582 . 40 1 1 A 139 139 GLY H H 139 8.518 8.441 0.077 1
1 1583 . 40 1 1 A 139 139 GLY HA2 H 139 4.070 3.975 0.095 1
1 1584 . 40 1 1 A 139 139 GLY HA3 H 139 3.897 3.981 -0.084 1
1 1585 . 40 1 1 A 139 139 GLY C C 139 172.874 173.987 -1.113 1
1 1586 . 40 1 1 A 139 139 GLY CA C 139 45.157 45.445 -0.288 1
1 1587 . 40 1 1 A 139 139 GLY N N 139 112.617 113.837 -1.220 1
1 6 . 41 1 1 A 2 2 VAL H H 2 8.992 8.445 0.547 1
1 7 . 41 1 1 A 2 2 VAL HA H 2 5.370 4.510 0.860 1
1 15 . 41 1 1 A 2 2 VAL C C 2 174.325 174.616 -0.291 1
1 16 . 41 1 1 A 2 2 VAL CA C 2 61.267 61.379 -0.112 1
1 17 . 41 1 1 A 2 2 VAL CB C 2 33.890 33.387 0.503 1
1 20 . 41 1 1 A 2 2 VAL N N 2 126.939 117.248 9.691 1
1 21 . 41 1 1 A 3 3 THR H H 3 8.912 8.800 0.112 1
1 22 . 41 1 1 A 3 3 THR HA H 3 4.505 5.375 -0.870 1
1 27 . 41 1 1 A 3 3 THR C C 3 172.710 172.808 -0.098 1
1 28 . 41 1 1 A 3 3 THR CA C 3 59.689 60.019 -0.330 1
1 29 . 41 1 1 A 3 3 THR CB C 3 72.398 72.077 0.321 1
1 31 . 41 1 1 A 3 3 THR N N 3 118.091 122.086 -3.995 1
1 32 . 41 1 1 A 4 4 GLU H H 4 8.631 9.119 -0.488 1
1 33 . 41 1 1 A 4 4 GLU HA H 4 5.788 5.031 0.757 1
1 38 . 41 1 1 A 4 4 GLU C C 4 175.758 174.373 1.385 1
1 39 . 41 1 1 A 4 4 GLU CA C 4 54.902 54.538 0.364 1
1 40 . 41 1 1 A 4 4 GLU CB C 4 35.097 32.862 2.235 1
1 42 . 41 1 1 A 4 4 GLU N N 4 120.966 125.640 -4.674 1
1 43 . 41 1 1 A 5 5 THR H H 5 9.188 9.073 0.115 1
1 44 . 41 1 1 A 5 5 THR HA H 5 4.739 4.743 -0.004 1
1 49 . 41 1 1 A 5 5 THR C C 5 172.757 173.050 -0.293 1
1 50 . 41 1 1 A 5 5 THR CA C 5 60.382 59.585 0.797 1
1 51 . 41 1 1 A 5 5 THR CB C 5 71.558 70.545 1.013 1
1 53 . 41 1 1 A 5 5 THR N N 5 119.366 119.499 -0.133 1
1 54 . 41 1 1 A 6 6 VAL H H 6 8.476 8.644 -0.168 1
1 55 . 41 1 1 A 6 6 VAL HA H 6 5.026 5.606 -0.580 1
1 63 . 41 1 1 A 6 6 VAL C C 6 176.674 173.886 2.788 1
1 64 . 41 1 1 A 6 6 VAL CA C 6 61.008 59.474 1.534 1
1 65 . 41 1 1 A 6 6 VAL CB C 6 33.861 35.884 -2.023 1
1 68 . 41 1 1 A 6 6 VAL N N 6 121.384 119.706 1.678 1
1 69 . 41 1 1 A 7 7 ASP H H 7 8.848 8.664 0.184 1
1 70 . 41 1 1 A 7 7 ASP HA H 7 4.797 4.830 -0.033 1
1 73 . 41 1 1 A 7 7 ASP CA C 7 52.834 53.407 -0.573 1
1 74 . 41 1 1 A 7 7 ASP CB C 7 42.219 42.495 -0.276 1
1 75 . 41 1 1 A 7 7 ASP N N 7 127.061 125.064 1.997 1
1 76 . 41 1 1 A 8 8 GLY C C 8 175.143 175.482 -0.339 1
1 77 . 41 1 1 A 8 8 GLY CA C 8 46.553 46.633 -0.080 1
1 78 . 41 1 1 A 9 9 GLN H H 9 8.408 7.542 0.866 1
1 79 . 41 1 1 A 9 9 GLN HA H 9 4.541 4.595 -0.054 1
1 86 . 41 1 1 A 9 9 GLN C C 9 176.463 175.778 0.685 1
1 87 . 41 1 1 A 9 9 GLN CA C 9 55.167 55.359 -0.192 1
1 88 . 41 1 1 A 9 9 GLN CB C 9 29.376 29.355 0.021 1
1 90 . 41 1 1 A 9 9 GLN N N 9 118.300 119.688 -1.388 1
1 92 . 41 1 1 A 10 10 GLY H H 10 8.162 8.137 0.025 1
1 93 . 41 1 1 A 10 10 GLY HA2 H 10 4.174 4.104 0.070 1
1 94 . 41 1 1 A 10 10 GLY HA3 H 10 3.521 4.121 -0.600 1
1 95 . 41 1 1 A 10 10 GLY C C 10 174.092 174.102 -0.010 1
1 96 . 41 1 1 A 10 10 GLY CA C 10 45.558 45.582 -0.024 1
1 97 . 41 1 1 A 10 10 GLY N N 10 108.747 110.543 -1.796 1
1 98 . 41 1 1 A 11 11 GLN H H 11 8.507 7.733 0.774 1
1 99 . 41 1 1 A 11 11 GLN HA H 11 4.202 4.514 -0.312 1
1 106 . 41 1 1 A 11 11 GLN C C 11 173.992 175.173 -1.181 1
1 107 . 41 1 1 A 11 11 GLN CA C 11 55.098 55.153 -0.055 1
1 108 . 41 1 1 A 11 11 GLN CB C 11 29.097 29.476 -0.379 1
1 110 . 41 1 1 A 11 11 GLN N N 11 122.979 119.074 3.905 1
1 112 . 41 1 1 A 12 12 ALA H H 12 8.259 8.891 -0.632 1
1 113 . 41 1 1 A 12 12 ALA HA H 12 5.156 6.070 -0.914 1
1 117 . 41 1 1 A 12 12 ALA C C 12 177.284 176.298 0.986 1
1 118 . 41 1 1 A 12 12 ALA CA C 12 51.087 50.535 0.552 1
1 119 . 41 1 1 A 12 12 ALA CB C 12 20.500 21.209 -0.709 1
1 120 . 41 1 1 A 12 12 ALA N N 12 127.100 125.682 1.418 1
1 121 . 41 1 1 A 13 13 TRP H H 13 9.245 9.094 0.151 1
1 122 . 41 1 1 A 13 13 TRP HA H 13 4.717 5.439 -0.722 1
1 131 . 41 1 1 A 13 13 TRP C C 13 175.108 174.267 0.841 1
1 132 . 41 1 1 A 13 13 TRP CA C 13 55.966 55.407 0.559 1
1 133 . 41 1 1 A 13 13 TRP CB C 13 31.912 32.532 -0.620 1
1 139 . 41 1 1 A 13 13 TRP N N 13 123.088 119.681 3.407 1
1 141 . 41 1 1 A 14 14 ARG H H 14 8.575 8.701 -0.126 1
1 142 . 41 1 1 A 14 14 ARG HA H 14 5.335 4.401 0.934 1
1 150 . 41 1 1 A 14 14 ARG C C 14 175.191 174.067 1.124 1
1 151 . 41 1 1 A 14 14 ARG CA C 14 53.106 55.139 -2.033 1
1 152 . 41 1 1 A 14 14 ARG CB C 14 32.749 31.599 1.150 1
1 154 . 41 1 1 A 14 14 ARG N N 14 121.163 120.603 0.560 1
1 156 . 41 1 1 A 15 15 HIS H H 15 8.595 8.013 0.582 1
1 157 . 41 1 1 A 15 15 HIS HA H 15 4.790 5.060 -0.270 1
1 161 . 41 1 1 A 15 15 HIS C C 15 173.770 173.766 0.004 1
1 162 . 41 1 1 A 15 15 HIS CA C 15 55.289 54.582 0.707 1
1 163 . 41 1 1 A 15 15 HIS CB C 15 33.208 33.800 -0.592 1
1 165 . 41 1 1 A 15 15 HIS N N 15 117.643 118.469 -0.826 1
1 166 . 41 1 1 A 16 16 HIS H H 16 8.993 8.712 0.281 1
1 167 . 41 1 1 A 16 16 HIS HA H 16 5.158 5.254 -0.096 1
1 171 . 41 1 1 A 16 16 HIS C C 16 173.608 174.888 -1.280 1
1 172 . 41 1 1 A 16 16 HIS CA C 16 56.450 53.911 2.539 1
1 173 . 41 1 1 A 16 16 HIS CB C 16 34.171 31.424 2.747 1
1 175 . 41 1 1 A 16 16 HIS N N 16 123.520 117.767 5.753 1
1 176 . 41 1 1 A 17 17 ASN H H 17 7.829 9.207 -1.378 1
1 177 . 41 1 1 A 17 17 ASN HA H 17 4.713 5.127 -0.414 1
1 182 . 41 1 1 A 17 17 ASN C C 17 173.682 176.619 -2.937 1
1 183 . 41 1 1 A 17 17 ASN CA C 17 51.822 51.698 0.124 1
1 184 . 41 1 1 A 17 17 ASN CB C 17 43.176 41.531 1.645 1
1 185 . 41 1 1 A 17 17 ASN N N 17 122.213 123.014 -0.801 1
1 187 . 41 1 1 A 18 18 GLY H H 18 8.423 8.383 0.040 1
1 188 . 41 1 1 A 18 18 GLY HA2 H 18 3.931 3.712 0.219 1
1 189 . 41 1 1 A 18 18 GLY HA3 H 18 3.707 3.855 -0.148 1
1 190 . 41 1 1 A 18 18 GLY C C 18 173.985 173.146 0.839 1
1 191 . 41 1 1 A 18 18 GLY CA C 18 43.949 47.123 -3.174 1
1 192 . 41 1 1 A 18 18 GLY N N 18 106.991 109.176 -2.185 1
1 193 . 41 1 1 A 19 19 PHE H H 19 8.338 7.782 0.556 1
1 194 . 41 1 1 A 19 19 PHE HA H 19 4.068 5.288 -1.220 1
1 197 . 41 1 1 A 19 19 PHE C C 19 176.568 174.710 1.858 1
1 198 . 41 1 1 A 19 19 PHE CA C 19 59.338 56.521 2.817 1
1 199 . 41 1 1 A 19 19 PHE CB C 19 40.201 43.565 -3.364 1
1 200 . 41 1 1 A 19 19 PHE N N 19 116.857 114.134 2.723 1
1 201 . 41 1 1 A 20 20 ASP H H 20 8.794 9.066 -0.272 1
1 202 . 41 1 1 A 20 20 ASP HA H 20 4.485 4.922 -0.437 1
1 205 . 41 1 1 A 20 20 ASP C C 20 177.379 177.041 0.338 1
1 206 . 41 1 1 A 20 20 ASP CA C 20 54.140 54.757 -0.617 1
1 207 . 41 1 1 A 20 20 ASP CB C 20 41.915 41.181 0.734 1
1 208 . 41 1 1 A 20 20 ASP N N 20 123.025 123.079 -0.054 1
1 209 . 41 1 1 A 21 21 PHE H H 21 8.862 9.006 -0.144 1
1 210 . 41 1 1 A 21 21 PHE HA H 21 4.087 4.054 0.033 1
1 218 . 41 1 1 A 21 21 PHE C C 21 176.952 177.303 -0.351 1
1 219 . 41 1 1 A 21 21 PHE CA C 21 61.095 62.396 -1.301 1
1 220 . 41 1 1 A 21 21 PHE CB C 21 38.678 39.377 -0.699 1
1 226 . 41 1 1 A 21 21 PHE N N 21 127.163 125.807 1.356 1
1 227 . 41 1 1 A 22 22 ALA H H 22 8.561 8.377 0.184 1
1 228 . 41 1 1 A 22 22 ALA HA H 22 3.878 4.031 -0.153 1
1 232 . 41 1 1 A 22 22 ALA C C 22 180.710 180.099 0.611 1
1 233 . 41 1 1 A 22 22 ALA CA C 22 55.211 55.222 -0.011 1
1 234 . 41 1 1 A 22 22 ALA CB C 22 18.321 18.348 -0.027 1
1 235 . 41 1 1 A 22 22 ALA N N 22 120.293 121.161 -0.868 1
1 236 . 41 1 1 A 23 23 VAL H H 23 7.241 7.721 -0.480 1
1 237 . 41 1 1 A 23 23 VAL HA H 23 3.684 3.493 0.191 1
1 245 . 41 1 1 A 23 23 VAL C C 23 177.101 178.075 -0.974 1
1 246 . 41 1 1 A 23 23 VAL CA C 23 65.237 66.934 -1.697 1
1 247 . 41 1 1 A 23 23 VAL CB C 23 31.780 31.719 0.061 1
1 250 . 41 1 1 A 23 23 VAL N N 23 118.775 117.445 1.330 1
1 251 . 41 1 1 A 24 24 ILE H H 24 6.761 7.601 -0.840 1
1 252 . 41 1 1 A 24 24 ILE HA H 24 3.196 3.301 -0.105 1
1 262 . 41 1 1 A 24 24 ILE C C 24 177.287 177.750 -0.463 1
1 263 . 41 1 1 A 24 24 ILE CA C 24 63.404 65.325 -1.921 1
1 264 . 41 1 1 A 24 24 ILE CB C 24 36.294 37.481 -1.187 1
1 268 . 41 1 1 A 24 24 ILE N N 24 119.036 119.618 -0.582 1
1 269 . 41 1 1 A 25 25 LYS H H 25 8.032 8.103 -0.071 1
1 270 . 41 1 1 A 25 25 LYS HA H 25 3.809 3.691 0.118 1
1 279 . 41 1 1 A 25 25 LYS C C 25 179.450 178.560 0.890 1
1 280 . 41 1 1 A 25 25 LYS CA C 25 59.621 59.695 -0.074 1
1 281 . 41 1 1 A 25 25 LYS CB C 25 32.259 32.118 0.141 1
1 285 . 41 1 1 A 25 25 LYS N N 25 118.368 120.502 -2.134 1
1 286 . 41 1 1 A 26 26 GLU H H 26 7.845 7.723 0.122 1
1 287 . 41 1 1 A 26 26 GLU HA H 26 4.021 4.205 -0.184 1
1 292 . 41 1 1 A 26 26 GLU C C 26 179.191 178.787 0.404 1
1 293 . 41 1 1 A 26 26 GLU CA C 26 59.530 58.903 0.627 1
1 294 . 41 1 1 A 26 26 GLU CB C 26 29.449 29.636 -0.187 1
1 296 . 41 1 1 A 26 26 GLU N N 26 120.522 118.776 1.746 1
1 297 . 41 1 1 A 27 27 LEU H H 27 8.165 7.777 0.388 1
1 298 . 41 1 1 A 27 27 LEU HA H 27 4.163 4.159 0.004 1
1 308 . 41 1 1 A 27 27 LEU C C 27 177.256 178.268 -1.012 1
1 309 . 41 1 1 A 27 27 LEU CA C 27 58.049 57.384 0.665 1
1 310 . 41 1 1 A 27 27 LEU CB C 27 41.365 41.316 0.049 1
1 314 . 41 1 1 A 27 27 LEU N N 27 120.879 120.745 0.134 1
1 315 . 41 1 1 A 28 28 LYS H H 28 8.902 8.168 0.734 1
1 316 . 41 1 1 A 28 28 LYS HA H 28 4.199 4.070 0.129 1
1 317 . 41 1 1 A 28 28 LYS C C 28 179.707 179.180 0.527 1
1 318 . 41 1 1 A 28 28 LYS CA C 28 60.097 59.207 0.890 1
1 319 . 41 1 1 A 28 28 LYS CB C 28 33.420 31.969 1.451 1
1 320 . 41 1 1 A 28 28 LYS N N 28 120.050 119.818 0.232 1
1 321 . 41 1 1 A 29 29 THR H H 29 8.294 8.467 -0.173 1
1 322 . 41 1 1 A 29 29 THR HA H 29 3.892 3.937 -0.045 1
1 327 . 41 1 1 A 29 29 THR C C 29 175.711 176.675 -0.964 1
1 328 . 41 1 1 A 29 29 THR CA C 29 66.846 66.413 0.433 1
1 329 . 41 1 1 A 29 29 THR CB C 29 68.794 68.995 -0.201 1
1 331 . 41 1 1 A 29 29 THR N N 29 115.933 116.573 -0.640 1
1 332 . 41 1 1 A 30 30 ALA H H 30 8.244 8.603 -0.359 1
1 333 . 41 1 1 A 30 30 ALA HA H 30 4.241 4.115 0.126 1
1 337 . 41 1 1 A 30 30 ALA C C 30 179.128 179.448 -0.320 1
1 338 . 41 1 1 A 30 30 ALA CA C 30 55.714 55.703 0.011 1
1 339 . 41 1 1 A 30 30 ALA CB C 30 18.955 18.425 0.530 1
1 340 . 41 1 1 A 30 30 ALA N N 30 124.617 123.163 1.454 1
1 341 . 41 1 1 A 31 31 ALA H H 31 8.968 8.449 0.519 1
1 342 . 41 1 1 A 31 31 ALA HA H 31 3.890 4.041 -0.151 1
1 346 . 41 1 1 A 31 31 ALA C C 31 180.352 179.304 1.048 1
1 347 . 41 1 1 A 31 31 ALA CA C 31 55.454 55.503 -0.049 1
1 348 . 41 1 1 A 31 31 ALA CB C 31 17.124 18.089 -0.965 1
1 349 . 41 1 1 A 31 31 ALA N N 31 119.327 120.562 -1.235 1
1 350 . 41 1 1 A 32 32 SER H H 32 7.995 7.703 0.292 1
1 351 . 41 1 1 A 32 32 SER HA H 32 4.238 4.173 0.065 1
1 354 . 41 1 1 A 32 32 SER C C 32 175.612 176.563 -0.951 1
1 355 . 41 1 1 A 32 32 SER CA C 32 61.203 61.630 -0.427 1
1 356 . 41 1 1 A 32 32 SER CB C 32 63.406 63.545 -0.139 1
1 357 . 41 1 1 A 32 32 SER N N 32 111.962 113.795 -1.833 1
1 358 . 41 1 1 A 33 33 GLN H H 33 8.333 7.743 0.590 1
1 359 . 41 1 1 A 33 33 GLN HA H 33 3.992 3.897 0.095 1
1 366 . 41 1 1 A 33 33 GLN C C 33 177.486 177.302 0.184 1
1 367 . 41 1 1 A 33 33 GLN CA C 33 58.277 58.481 -0.204 1
1 368 . 41 1 1 A 33 33 GLN CB C 33 29.140 28.301 0.839 1
1 370 . 41 1 1 A 33 33 GLN N N 33 119.527 120.577 -1.050 1
1 372 . 41 1 1 A 34 34 TYR H H 34 8.587 7.930 0.657 1
1 373 . 41 1 1 A 34 34 TYR HA H 34 4.792 4.678 0.114 1
1 380 . 41 1 1 A 34 34 TYR C C 34 176.499 176.583 -0.084 1
1 381 . 41 1 1 A 34 34 TYR CA C 34 57.711 58.492 -0.781 1
1 382 . 41 1 1 A 34 34 TYR CB C 34 39.561 39.467 0.094 1
1 387 . 41 1 1 A 34 34 TYR N N 34 114.610 114.544 0.066 1
1 388 . 41 1 1 A 35 35 GLY H H 35 7.346 8.388 -1.042 1
1 389 . 41 1 1 A 35 35 GLY HA2 H 35 4.785 4.106 0.679 1
1 390 . 41 1 1 A 35 35 GLY HA3 H 35 4.007 4.128 -0.121 1
1 391 . 41 1 1 A 35 35 GLY C C 35 175.796 173.195 2.601 1
1 392 . 41 1 1 A 35 35 GLY CA C 35 44.355 44.664 -0.309 1
1 393 . 41 1 1 A 35 35 GLY N N 35 108.501 107.198 1.303 1
1 394 . 41 1 1 A 36 36 ALA H H 36 9.363 8.191 1.172 1
1 395 . 41 1 1 A 36 36 ALA HA H 36 4.217 4.788 -0.571 1
1 399 . 41 1 1 A 36 36 ALA C C 36 178.039 177.131 0.908 1
1 400 . 41 1 1 A 36 36 ALA CA C 36 56.114 51.431 4.683 1
1 401 . 41 1 1 A 36 36 ALA CB C 36 19.179 19.437 -0.258 1
1 402 . 41 1 1 A 36 36 ALA N N 36 125.811 123.325 2.486 1
1 403 . 41 1 1 A 37 37 THR H H 37 8.070 8.902 -0.832 1
1 404 . 41 1 1 A 37 37 THR HA H 37 4.570 4.544 0.026 1
1 409 . 41 1 1 A 37 37 THR C C 37 173.685 174.302 -0.617 1
1 410 . 41 1 1 A 37 37 THR CA C 37 59.822 63.180 -3.358 1
1 411 . 41 1 1 A 37 37 THR CB C 37 68.267 71.475 -3.208 1
1 413 . 41 1 1 A 37 37 THR N N 37 129.410 118.722 10.688 1
1 414 . 41 1 1 A 38 38 ALA H H 38 6.853 7.785 -0.932 1
1 415 . 41 1 1 A 38 38 ALA HA H 38 4.601 4.441 0.160 1
1 419 . 41 1 1 A 38 38 ALA CA C 38 50.758 50.747 0.011 1
1 420 . 41 1 1 A 38 38 ALA CB C 38 18.325 18.610 -0.285 1
1 421 . 41 1 1 A 38 38 ALA N N 38 124.674 124.412 0.262 1
1 422 . 41 1 1 A 40 40 TYR HA H 40 4.032 4.021 0.011 1
1 429 . 41 1 1 A 40 40 TYR C C 40 176.456 177.276 -0.820 1
1 430 . 41 1 1 A 40 40 TYR CA C 40 61.010 61.782 -0.772 1
1 431 . 41 1 1 A 40 40 TYR CB C 40 39.286 38.685 0.601 1
1 436 . 41 1 1 A 41 41 THR H H 41 6.874 8.330 -1.456 1
1 437 . 41 1 1 A 41 41 THR HA H 41 3.616 3.922 -0.306 1
1 442 . 41 1 1 A 41 41 THR C C 41 176.930 176.650 0.280 1
1 443 . 41 1 1 A 41 41 THR CA C 41 65.557 66.088 -0.531 1
1 444 . 41 1 1 A 41 41 THR CB C 41 68.228 69.311 -1.083 1
1 446 . 41 1 1 A 41 41 THR N N 41 115.143 113.872 1.271 1
1 447 . 41 1 1 A 42 42 LEU H H 42 8.623 7.505 1.118 1
1 448 . 41 1 1 A 42 42 LEU HA H 42 3.708 4.108 -0.400 1
1 458 . 41 1 1 A 42 42 LEU C C 42 178.206 178.922 -0.716 1
1 459 . 41 1 1 A 42 42 LEU CA C 42 57.417 57.728 -0.311 1
1 460 . 41 1 1 A 42 42 LEU CB C 42 41.342 41.278 0.064 1
1 464 . 41 1 1 A 42 42 LEU N N 42 120.418 117.887 2.531 1
1 465 . 41 1 1 A 43 43 ALA H H 43 7.735 7.811 -0.076 1
1 466 . 41 1 1 A 43 43 ALA HA H 43 4.020 4.088 -0.068 1
1 470 . 41 1 1 A 43 43 ALA C C 43 180.826 180.498 0.328 1
1 471 . 41 1 1 A 43 43 ALA CA C 43 54.925 55.026 -0.101 1
1 472 . 41 1 1 A 43 43 ALA CB C 43 17.506 18.234 -0.728 1
1 473 . 41 1 1 A 43 43 ALA N N 43 120.203 122.027 -1.824 1
1 474 . 41 1 1 A 44 44 ILE H H 44 7.149 7.415 -0.266 1
1 475 . 41 1 1 A 44 44 ILE HA H 44 3.603 3.586 0.017 1
1 485 . 41 1 1 A 44 44 ILE C C 44 178.594 178.263 0.331 1
1 486 . 41 1 1 A 44 44 ILE CA C 44 64.782 64.417 0.365 1
1 487 . 41 1 1 A 44 44 ILE CB C 44 37.472 36.966 0.506 1
1 491 . 41 1 1 A 44 44 ILE N N 44 118.881 119.418 -0.537 1
1 492 . 41 1 1 A 45 45 VAL H H 45 7.968 7.845 0.123 1
1 493 . 41 1 1 A 45 45 VAL HA H 45 2.925 3.407 -0.482 1
1 501 . 41 1 1 A 45 45 VAL C C 45 177.023 177.608 -0.585 1
1 502 . 41 1 1 A 45 45 VAL CA C 45 67.081 66.503 0.578 1
1 503 . 41 1 1 A 45 45 VAL CB C 45 30.854 31.249 -0.395 1
1 506 . 41 1 1 A 45 45 VAL N N 45 120.764 121.044 -0.280 1
1 507 . 41 1 1 A 46 46 GLU H H 46 8.399 8.262 0.137 1
1 508 . 41 1 1 A 46 46 GLU HA H 46 3.848 3.879 -0.031 1
1 513 . 41 1 1 A 46 46 GLU C C 46 178.656 179.089 -0.433 1
1 514 . 41 1 1 A 46 46 GLU CA C 46 59.491 59.316 0.175 1
1 515 . 41 1 1 A 46 46 GLU CB C 46 28.991 29.229 -0.238 1
1 517 . 41 1 1 A 46 46 GLU N N 46 116.599 120.000 -3.401 1
1 518 . 41 1 1 A 47 47 SER H H 47 7.273 7.932 -0.659 1
1 519 . 41 1 1 A 47 47 SER HA H 47 4.287 4.087 0.200 1
1 521 . 41 1 1 A 47 47 SER CA C 47 61.047 62.446 -1.399 1
1 522 . 41 1 1 A 47 47 SER CB C 47 63.016 62.907 0.109 1
1 523 . 41 1 1 A 47 47 SER N N 47 113.609 117.454 -3.845 1
1 524 . 41 1 1 A 48 48 VAL H H 48 8.006 7.605 0.401 1
1 525 . 41 1 1 A 48 48 VAL HA H 48 3.556 3.708 -0.152 1
1 533 . 41 1 1 A 48 48 VAL C C 48 177.257 177.501 -0.244 1
1 534 . 41 1 1 A 48 48 VAL CA C 48 65.025 64.387 0.638 1
1 535 . 41 1 1 A 48 48 VAL CB C 48 31.841 31.141 0.700 1
1 538 . 41 1 1 A 48 48 VAL N N 48 122.327 119.195 3.132 1
1 539 . 41 1 1 A 49 49 ALA H H 49 8.369 7.518 0.851 1
1 540 . 41 1 1 A 49 49 ALA HA H 49 4.115 3.976 0.139 1
1 544 . 41 1 1 A 49 49 ALA C C 49 177.307 178.987 -1.680 1
1 545 . 41 1 1 A 49 49 ALA CA C 49 53.253 53.467 -0.214 1
1 546 . 41 1 1 A 49 49 ALA CB C 49 20.131 18.781 1.350 1
1 547 . 41 1 1 A 49 49 ALA N N 49 118.050 123.751 -5.701 1
1 548 . 41 1 1 A 50 50 ASP H H 50 7.052 7.513 -0.461 1
1 549 . 41 1 1 A 50 50 ASP HA H 50 4.788 4.472 0.316 1
1 552 . 41 1 1 A 50 50 ASP C C 50 175.481 175.711 -0.230 1
1 553 . 41 1 1 A 50 50 ASP CA C 50 53.681 55.174 -1.493 1
1 554 . 41 1 1 A 50 50 ASP CB C 50 39.333 41.178 -1.845 1
1 555 . 41 1 1 A 50 50 ASP N N 50 116.997 117.067 -0.070 1
1 556 . 41 1 1 A 51 51 ASN H H 51 8.535 7.598 0.937 1
1 557 . 41 1 1 A 51 51 ASN HA H 51 4.628 4.574 0.054 1
1 562 . 41 1 1 A 51 51 ASN C C 51 174.077 174.215 -0.138 1
1 563 . 41 1 1 A 51 51 ASN CA C 51 52.315 51.220 1.095 1
1 564 . 41 1 1 A 51 51 ASN CB C 51 41.928 40.532 1.396 1
1 565 . 41 1 1 A 51 51 ASN N N 51 118.626 114.308 4.318 1
1 567 . 41 1 1 A 52 52 TRP H H 52 8.555 8.572 -0.017 1
1 574 . 41 1 1 A 52 52 TRP C C 52 173.269 176.458 -3.189 1
1 575 . 41 1 1 A 52 52 TRP CA C 52 55.031 56.824 -1.793 1
1 576 . 41 1 1 A 52 52 TRP CB C 52 26.801 30.302 -3.501 1
1 582 . 41 1 1 A 52 52 TRP N N 52 120.693 120.128 0.565 1
1 584 . 41 1 1 A 53 53 LEU H H 53 7.847 9.351 -1.504 1
1 585 . 41 1 1 A 53 53 LEU HA H 53 4.859 5.060 -0.201 1
1 595 . 41 1 1 A 53 53 LEU C C 53 177.397 176.110 1.287 1
1 596 . 41 1 1 A 53 53 LEU CA C 53 53.619 53.175 0.444 1
1 597 . 41 1 1 A 53 53 LEU CB C 53 41.812 45.537 -3.725 1
1 601 . 41 1 1 A 53 53 LEU N N 53 124.741 125.361 -0.620 1
1 602 . 41 1 1 A 54 54 THR H H 54 8.850 9.160 -0.310 1
1 603 . 41 1 1 A 54 54 THR HA H 54 4.598 5.145 -0.547 1
1 608 . 41 1 1 A 54 54 THR CA C 54 60.531 58.816 1.715 1
1 609 . 41 1 1 A 54 54 THR CB C 54 67.183 70.426 -3.243 1
1 611 . 41 1 1 A 54 54 THR N N 54 113.407 111.089 2.318 1
1 612 . 41 1 1 A 55 55 PRO HA H 55 4.511 4.297 0.214 1
1 619 . 41 1 1 A 55 55 PRO C C 55 179.383 178.105 1.278 1
1 620 . 41 1 1 A 55 55 PRO CA C 55 67.159 65.858 1.301 1
1 621 . 41 1 1 A 55 55 PRO CB C 55 32.095 31.678 0.417 1
1 622 . 41 1 1 A 56 56 THR H H 56 8.575 7.803 0.772 1
1 623 . 41 1 1 A 56 56 THR HA H 56 4.229 4.213 0.016 1
1 628 . 41 1 1 A 56 56 THR C C 56 176.668 176.689 -0.021 1
1 629 . 41 1 1 A 56 56 THR CA C 56 66.943 65.072 1.871 1
1 630 . 41 1 1 A 56 56 THR CB C 56 68.129 68.896 -0.767 1
1 632 . 41 1 1 A 56 56 THR N N 56 114.855 110.709 4.146 1
1 633 . 41 1 1 A 57 57 ASP H H 57 8.730 8.164 0.566 1
1 634 . 41 1 1 A 57 57 ASP HA H 57 4.425 4.663 -0.238 1
1 637 . 41 1 1 A 57 57 ASP C C 57 178.351 179.018 -0.667 1
1 638 . 41 1 1 A 57 57 ASP CA C 57 57.963 56.612 1.351 1
1 639 . 41 1 1 A 57 57 ASP CB C 57 40.134 40.642 -0.508 1
1 640 . 41 1 1 A 57 57 ASP N N 57 126.239 120.163 6.076 1
1 641 . 41 1 1 A 58 58 TRP H H 58 8.244 8.608 -0.364 1
1 642 . 41 1 1 A 58 58 TRP HA H 58 4.030 4.492 -0.462 1
1 650 . 41 1 1 A 58 58 TRP C C 58 177.432 179.086 -1.654 1
1 651 . 41 1 1 A 58 58 TRP CA C 58 62.731 60.081 2.650 1
1 652 . 41 1 1 A 58 58 TRP CB C 58 29.122 29.196 -0.074 1
1 657 . 41 1 1 A 58 58 TRP N N 58 119.241 119.970 -0.729 1
1 659 . 41 1 1 A 59 59 ASN H H 59 8.098 8.568 -0.470 1
1 660 . 41 1 1 A 59 59 ASN HA H 59 4.424 4.697 -0.273 1
1 663 . 41 1 1 A 59 59 ASN C C 59 176.952 178.323 -1.371 1
1 664 . 41 1 1 A 59 59 ASN CA C 59 58.135 56.610 1.525 1
1 665 . 41 1 1 A 59 59 ASN CB C 59 40.168 39.317 0.851 1
1 666 . 41 1 1 A 59 59 ASN N N 59 115.747 117.901 -2.154 1
1 667 . 41 1 1 A 60 60 THR H H 60 8.712 8.159 0.553 1
1 668 . 41 1 1 A 60 60 THR HA H 60 3.717 4.132 -0.415 1
1 673 . 41 1 1 A 60 60 THR C C 60 176.044 176.804 -0.760 1
1 674 . 41 1 1 A 60 60 THR CA C 60 66.576 67.261 -0.685 1
1 675 . 41 1 1 A 60 60 THR CB C 60 69.251 68.096 1.155 1
1 677 . 41 1 1 A 60 60 THR N N 60 114.896 116.763 -1.867 1
1 678 . 41 1 1 A 61 61 LEU H H 61 8.485 8.518 -0.033 1
1 679 . 41 1 1 A 61 61 LEU HA H 61 3.391 3.834 -0.443 1
1 689 . 41 1 1 A 61 61 LEU C C 61 177.433 178.657 -1.224 1
1 690 . 41 1 1 A 61 61 LEU CA C 61 58.354 58.414 -0.060 1
1 691 . 41 1 1 A 61 61 LEU CB C 61 41.761 42.046 -0.285 1
1 695 . 41 1 1 A 61 61 LEU N N 61 123.433 122.187 1.246 1
1 696 . 41 1 1 A 62 62 VAL H H 62 8.073 8.427 -0.354 1
1 697 . 41 1 1 A 62 62 VAL HA H 62 3.207 3.891 -0.684 1
1 705 . 41 1 1 A 62 62 VAL C C 62 177.585 177.734 -0.149 1
1 706 . 41 1 1 A 62 62 VAL CA C 62 67.345 65.365 1.980 1
1 707 . 41 1 1 A 62 62 VAL CB C 62 30.905 30.758 0.147 1
1 710 . 41 1 1 A 62 62 VAL N N 62 116.018 118.689 -2.671 1
1 711 . 41 1 1 A 63 63 ARG H H 63 7.765 8.081 -0.316 1
1 712 . 41 1 1 A 63 63 ARG HA H 63 3.602 4.090 -0.488 1
1 719 . 41 1 1 A 63 63 ARG C C 63 177.818 177.060 0.758 1
1 720 . 41 1 1 A 63 63 ARG CA C 63 58.049 58.001 0.048 1
1 721 . 41 1 1 A 63 63 ARG CB C 63 29.955 29.484 0.471 1
1 724 . 41 1 1 A 63 63 ARG N N 63 116.700 120.755 -4.055 1
1 725 . 41 1 1 A 64 64 ALA H H 64 7.574 7.985 -0.411 1
1 726 . 41 1 1 A 64 64 ALA HA H 64 4.158 4.305 -0.147 1
1 730 . 41 1 1 A 64 64 ALA C C 64 179.886 178.167 1.719 1
1 731 . 41 1 1 A 64 64 ALA CA C 64 54.007 52.124 1.883 1
1 732 . 41 1 1 A 64 64 ALA CB C 64 19.147 19.162 -0.015 1
1 733 . 41 1 1 A 64 64 ALA N N 64 117.555 120.786 -3.231 1
1 734 . 41 1 1 A 65 65 VAL H H 65 7.554 7.708 -0.154 1
1 735 . 41 1 1 A 65 65 VAL HA H 65 4.253 4.321 -0.068 1
1 743 . 41 1 1 A 65 65 VAL C C 65 174.180 174.957 -0.777 1
1 744 . 41 1 1 A 65 65 VAL CA C 65 62.683 63.244 -0.561 1
1 745 . 41 1 1 A 65 65 VAL CB C 65 33.458 34.495 -1.037 1
1 748 . 41 1 1 A 65 65 VAL N N 65 110.013 116.862 -6.849 1
1 749 . 41 1 1 A 66 66 LEU H H 66 7.792 7.655 0.137 1
1 750 . 41 1 1 A 66 66 LEU HA H 66 4.790 4.683 0.107 1
1 760 . 41 1 1 A 66 66 LEU C C 66 177.537 174.711 2.826 1
1 761 . 41 1 1 A 66 66 LEU CA C 66 52.823 52.934 -0.111 1
1 762 . 41 1 1 A 66 66 LEU CB C 66 44.071 44.691 -0.620 1
1 766 . 41 1 1 A 66 66 LEU N N 66 118.967 121.148 -2.181 1
1 767 . 41 1 1 A 67 67 SER H H 67 9.208 8.059 1.149 1
1 768 . 41 1 1 A 67 67 SER HA H 67 4.414 4.853 -0.439 1
1 771 . 41 1 1 A 67 67 SER CA C 67 57.943 57.805 0.138 1
1 772 . 41 1 1 A 67 67 SER CB C 67 64.743 65.850 -1.107 1
1 773 . 41 1 1 A 67 67 SER N N 67 116.378 116.367 0.011 1
1 774 . 41 1 1 A 69 69 GLY HA2 H 69 3.916 3.739 0.177 1
1 775 . 41 1 1 A 69 69 GLY HA3 H 69 3.867 3.775 0.092 1
1 776 . 41 1 1 A 69 69 GLY C C 69 176.783 175.280 1.503 1
1 777 . 41 1 1 A 69 69 GLY CA C 69 46.977 47.086 -0.109 1
1 778 . 41 1 1 A 70 70 ASP H H 70 7.674 8.085 -0.411 1
1 779 . 41 1 1 A 70 70 ASP HA H 70 4.511 3.375 1.136 1
1 782 . 41 1 1 A 70 70 ASP C C 70 178.096 177.611 0.485 1
1 783 . 41 1 1 A 70 70 ASP CA C 70 57.262 56.264 0.998 1
1 784 . 41 1 1 A 70 70 ASP CB C 70 40.594 39.484 1.110 1
1 785 . 41 1 1 A 70 70 ASP N N 70 123.930 122.129 1.801 1
1 786 . 41 1 1 A 71 71 HIS H H 71 8.729 7.979 0.750 1
1 787 . 41 1 1 A 71 71 HIS HA H 71 4.235 3.964 0.271 1
1 790 . 41 1 1 A 71 71 HIS C C 71 176.769 176.823 -0.054 1
1 791 . 41 1 1 A 71 71 HIS CA C 71 60.041 59.740 0.301 1
1 792 . 41 1 1 A 71 71 HIS CB C 71 30.682 29.622 1.060 1
1 793 . 41 1 1 A 71 71 HIS N N 71 121.003 119.638 1.365 1
1 794 . 41 1 1 A 72 72 LEU H H 72 7.620 7.718 -0.098 1
1 795 . 41 1 1 A 72 72 LEU HA H 72 3.769 3.695 0.074 1
1 805 . 41 1 1 A 72 72 LEU C C 72 180.275 179.034 1.241 1
1 806 . 41 1 1 A 72 72 LEU CA C 72 58.192 57.986 0.206 1
1 807 . 41 1 1 A 72 72 LEU CB C 72 41.381 41.502 -0.121 1
1 811 . 41 1 1 A 72 72 LEU N N 72 118.569 117.826 0.743 1
1 812 . 41 1 1 A 73 73 LEU H H 73 7.542 7.964 -0.422 1
1 813 . 41 1 1 A 73 73 LEU HA H 73 4.107 4.182 -0.075 1
1 823 . 41 1 1 A 73 73 LEU C C 73 179.436 179.062 0.374 1
1 824 . 41 1 1 A 73 73 LEU CA C 73 58.026 57.287 0.739 1
1 825 . 41 1 1 A 73 73 LEU CB C 73 41.638 41.966 -0.328 1
1 829 . 41 1 1 A 73 73 LEU N N 73 121.418 119.451 1.967 1
1 830 . 41 1 1 A 74 74 TRP H H 74 8.786 8.406 0.380 1
1 831 . 41 1 1 A 74 74 TRP HA H 74 3.589 5.213 -1.624 1
1 840 . 41 1 1 A 74 74 TRP C C 74 176.816 178.729 -1.913 1
1 841 . 41 1 1 A 74 74 TRP CA C 74 63.046 59.900 3.146 1
1 842 . 41 1 1 A 74 74 TRP CB C 74 28.065 29.141 -1.076 1
1 848 . 41 1 1 A 74 74 TRP N N 74 121.111 118.120 2.991 1
1 850 . 41 1 1 A 75 75 LYS H H 75 8.939 7.853 1.086 1
1 851 . 41 1 1 A 75 75 LYS HA H 75 3.055 4.193 -1.138 1
1 860 . 41 1 1 A 75 75 LYS C C 75 177.967 179.500 -1.533 1
1 861 . 41 1 1 A 75 75 LYS CA C 75 60.029 58.744 1.285 1
1 862 . 41 1 1 A 75 75 LYS CB C 75 32.533 32.967 -0.434 1
1 866 . 41 1 1 A 75 75 LYS N N 75 119.783 118.677 1.106 1
1 867 . 41 1 1 A 76 76 SER H H 76 7.832 7.753 0.079 1
1 868 . 41 1 1 A 76 76 SER HA H 76 4.040 4.342 -0.302 1
1 871 . 41 1 1 A 76 76 SER C C 76 177.816 177.350 0.466 1
1 872 . 41 1 1 A 76 76 SER CA C 76 62.105 61.219 0.886 1
1 873 . 41 1 1 A 76 76 SER CB C 76 62.679 63.278 -0.599 1
1 874 . 41 1 1 A 76 76 SER N N 76 113.395 114.954 -1.559 1
1 875 . 41 1 1 A 77 77 GLU H H 77 7.590 7.692 -0.102 1
1 876 . 41 1 1 A 77 77 GLU HA H 77 4.042 4.164 -0.122 1
1 881 . 41 1 1 A 77 77 GLU C C 77 177.809 179.001 -1.192 1
1 882 . 41 1 1 A 77 77 GLU CA C 77 58.270 59.147 -0.877 1
1 883 . 41 1 1 A 77 77 GLU CB C 77 29.208 29.104 0.104 1
1 885 . 41 1 1 A 77 77 GLU N N 77 121.574 121.464 0.110 1
1 886 . 41 1 1 A 78 78 PHE H H 78 9.081 7.944 1.137 1
1 887 . 41 1 1 A 78 78 PHE HA H 78 3.778 4.265 -0.487 1
1 895 . 41 1 1 A 78 78 PHE C C 78 178.114 177.421 0.693 1
1 896 . 41 1 1 A 78 78 PHE CA C 78 60.629 61.364 -0.735 1
1 897 . 41 1 1 A 78 78 PHE CB C 78 38.295 38.831 -0.536 1
1 902 . 41 1 1 A 78 78 PHE N N 78 122.682 120.753 1.929 1
1 903 . 41 1 1 A 79 79 PHE H H 79 8.890 8.005 0.885 1
1 904 . 41 1 1 A 79 79 PHE HA H 79 3.800 4.090 -0.290 1
1 912 . 41 1 1 A 79 79 PHE C C 79 178.354 178.224 0.130 1
1 913 . 41 1 1 A 79 79 PHE CA C 79 60.704 61.794 -1.090 1
1 914 . 41 1 1 A 79 79 PHE CB C 79 37.184 38.695 -1.511 1
1 920 . 41 1 1 A 79 79 PHE N N 79 121.056 117.617 3.439 1
1 921 . 41 1 1 A 80 80 GLU H H 80 7.793 8.101 -0.308 1
1 922 . 41 1 1 A 80 80 GLU HA H 80 4.082 3.983 0.099 1
1 927 . 41 1 1 A 80 80 GLU C C 80 179.068 178.832 0.236 1
1 928 . 41 1 1 A 80 80 GLU CA C 80 59.735 59.762 -0.027 1
1 929 . 41 1 1 A 80 80 GLU CB C 80 28.722 29.296 -0.574 1
1 931 . 41 1 1 A 80 80 GLU N N 80 120.312 119.897 0.415 1
1 932 . 41 1 1 A 81 81 ASN H H 81 8.624 9.015 -0.391 1
1 933 . 41 1 1 A 81 81 ASN HA H 81 4.521 4.434 0.087 1
1 938 . 41 1 1 A 81 81 ASN C C 81 179.262 177.570 1.692 1
1 939 . 41 1 1 A 81 81 ASN CA C 81 55.504 56.031 -0.527 1
1 940 . 41 1 1 A 81 81 ASN CB C 81 37.517 37.444 0.073 1
1 941 . 41 1 1 A 81 81 ASN N N 81 119.338 117.149 2.189 1
1 943 . 41 1 1 A 82 82 CYS H H 82 8.554 8.023 0.531 1
1 944 . 41 1 1 A 82 82 CYS HA H 82 3.792 4.009 -0.217 1
1 947 . 41 1 1 A 82 82 CYS C C 82 176.478 177.143 -0.665 1
1 948 . 41 1 1 A 82 82 CYS CA C 82 65.232 63.945 1.287 1
1 949 . 41 1 1 A 82 82 CYS CB C 82 26.762 27.070 -0.308 1
1 950 . 41 1 1 A 82 82 CYS N N 82 120.576 117.590 2.986 1
1 951 . 41 1 1 A 83 83 ARG H H 83 8.522 7.776 0.746 1
1 952 . 41 1 1 A 83 83 ARG HA H 83 3.932 4.127 -0.195 1
1 960 . 41 1 1 A 83 83 ARG C C 83 179.138 178.571 0.567 1
1 961 . 41 1 1 A 83 83 ARG CA C 83 60.443 58.906 1.537 1
1 962 . 41 1 1 A 83 83 ARG CB C 83 29.550 29.519 0.031 1
1 965 . 41 1 1 A 83 83 ARG N N 83 123.035 119.997 3.038 1
1 967 . 41 1 1 A 84 84 ASP H H 84 7.791 7.931 -0.140 1
1 968 . 41 1 1 A 84 84 ASP HA H 84 4.353 4.385 -0.032 1
1 971 . 41 1 1 A 84 84 ASP C C 84 178.649 178.715 -0.066 1
1 972 . 41 1 1 A 84 84 ASP CA C 84 57.767 57.549 0.218 1
1 973 . 41 1 1 A 84 84 ASP CB C 84 41.305 41.542 -0.237 1
1 974 . 41 1 1 A 84 84 ASP N N 84 120.332 119.486 0.846 1
1 975 . 41 1 1 A 85 85 THR H H 85 8.370 8.325 0.045 1
1 976 . 41 1 1 A 85 85 THR HA H 85 3.730 3.909 -0.179 1
1 981 . 41 1 1 A 85 85 THR C C 85 175.198 176.377 -1.179 1
1 982 . 41 1 1 A 85 85 THR CA C 85 66.830 65.769 1.061 1
1 983 . 41 1 1 A 85 85 THR CB C 85 68.533 68.435 0.098 1
1 985 . 41 1 1 A 85 85 THR N N 85 117.360 115.478 1.882 1
1 986 . 41 1 1 A 86 86 ALA H H 86 8.845 7.845 1.000 1
1 987 . 41 1 1 A 86 86 ALA HA H 86 3.991 4.213 -0.222 1
1 991 . 41 1 1 A 86 86 ALA C C 86 179.980 179.515 0.465 1
1 992 . 41 1 1 A 86 86 ALA CA C 86 55.769 55.108 0.661 1
1 993 . 41 1 1 A 86 86 ALA CB C 86 17.881 18.390 -0.509 1
1 994 . 41 1 1 A 86 86 ALA N N 86 123.613 123.681 -0.068 1
1 995 . 41 1 1 A 87 87 LYS H H 87 7.686 8.135 -0.449 1
1 996 . 41 1 1 A 87 87 LYS HA H 87 4.099 4.041 0.058 1
1 1005 . 41 1 1 A 87 87 LYS C C 87 179.592 178.828 0.764 1
1 1006 . 41 1 1 A 87 87 LYS CA C 87 59.708 59.243 0.465 1
1 1007 . 41 1 1 A 87 87 LYS CB C 87 32.054 31.878 0.176 1
1 1011 . 41 1 1 A 87 87 LYS N N 87 119.623 116.295 3.328 1
1 1012 . 41 1 1 A 88 88 ARG H H 88 7.683 7.684 -0.001 1
1 1013 . 41 1 1 A 88 88 ARG HA H 88 4.051 4.176 -0.125 1
1 1020 . 41 1 1 A 88 88 ARG C C 88 180.053 179.014 1.039 1
1 1021 . 41 1 1 A 88 88 ARG CA C 88 59.558 59.045 0.513 1
1 1022 . 41 1 1 A 88 88 ARG CB C 88 29.684 29.867 -0.183 1
1 1025 . 41 1 1 A 88 88 ARG N N 88 120.788 119.667 1.121 1
1 1026 . 41 1 1 A 89 89 ASN H H 89 8.973 8.195 0.778 1
1 1027 . 41 1 1 A 89 89 ASN HA H 89 4.354 4.636 -0.282 1
1 1032 . 41 1 1 A 89 89 ASN C C 89 178.382 178.576 -0.194 1
1 1033 . 41 1 1 A 89 89 ASN CA C 89 55.334 55.805 -0.471 1
1 1034 . 41 1 1 A 89 89 ASN CB C 89 37.864 37.883 -0.019 1
1 1035 . 41 1 1 A 89 89 ASN N N 89 121.012 117.573 3.439 1
1 1037 . 41 1 1 A 90 90 GLN H H 90 8.152 7.868 0.284 1
1 1038 . 41 1 1 A 90 90 GLN HA H 90 4.020 4.176 -0.156 1
1 1045 . 41 1 1 A 90 90 GLN C C 90 179.075 178.856 0.219 1
1 1046 . 41 1 1 A 90 90 GLN CA C 90 59.318 58.774 0.544 1
1 1047 . 41 1 1 A 90 90 GLN CB C 90 28.049 28.856 -0.807 1
1 1049 . 41 1 1 A 90 90 GLN N N 90 122.122 120.790 1.332 1
1 1051 . 41 1 1 A 91 91 GLN H H 91 7.514 8.672 -1.158 1
1 1052 . 41 1 1 A 91 91 GLN HA H 91 4.053 4.117 -0.064 1
1 1059 . 41 1 1 A 91 91 GLN C C 91 177.081 176.996 0.085 1
1 1060 . 41 1 1 A 91 91 GLN CA C 91 58.031 58.306 -0.275 1
1 1061 . 41 1 1 A 91 91 GLN CB C 91 28.365 27.564 0.801 1
1 1063 . 41 1 1 A 91 91 GLN N N 91 118.124 117.998 0.126 1
1 1065 . 41 1 1 A 92 92 ALA H H 92 7.704 7.577 0.127 1
1 1066 . 41 1 1 A 92 92 ALA HA H 92 4.246 4.444 -0.198 1
1 1070 . 41 1 1 A 92 92 ALA C C 92 178.450 177.936 0.514 1
1 1071 . 41 1 1 A 92 92 ALA CA C 92 52.671 51.850 0.821 1
1 1072 . 41 1 1 A 92 92 ALA CB C 92 19.316 19.411 -0.095 1
1 1073 . 41 1 1 A 92 92 ALA N N 92 119.880 121.107 -1.227 1
1 1074 . 41 1 1 A 93 93 GLY H H 93 7.693 8.029 -0.336 1
1 1075 . 41 1 1 A 93 93 GLY HA2 H 93 3.941 3.886 0.055 1
1 1076 . 41 1 1 A 93 93 GLY HA3 H 93 3.744 3.890 -0.146 1
1 1077 . 41 1 1 A 93 93 GLY C C 93 174.344 175.485 -1.141 1
1 1078 . 41 1 1 A 93 93 GLY CA C 93 45.949 46.861 -0.912 1
1 1079 . 41 1 1 A 93 93 GLY N N 93 105.347 107.599 -2.252 1
1 1080 . 41 1 1 A 94 94 ASN H H 94 7.076 9.300 -2.224 1
1 1081 . 41 1 1 A 94 94 ASN HA H 94 4.115 4.679 -0.564 1
1 1085 . 41 1 1 A 94 94 ASN C C 94 175.410 175.453 -0.043 1
1 1086 . 41 1 1 A 94 94 ASN CA C 94 52.651 52.610 0.041 1
1 1087 . 41 1 1 A 94 94 ASN CB C 94 38.330 39.240 -0.910 1
1 1088 . 41 1 1 A 94 94 ASN N N 94 115.747 116.958 -1.211 1
1 1090 . 41 1 1 A 95 95 GLY H H 95 8.236 8.133 0.103 1
1 1091 . 41 1 1 A 95 95 GLY HA2 H 95 3.633 3.624 0.009 1
1 1092 . 41 1 1 A 95 95 GLY HA3 H 95 3.633 3.846 -0.213 1
1 1093 . 41 1 1 A 95 95 GLY C C 95 174.450 174.401 0.049 1
1 1094 . 41 1 1 A 95 95 GLY CA C 95 45.522 45.157 0.365 1
1 1095 . 41 1 1 A 95 95 GLY N N 95 109.166 107.263 1.903 1
1 1096 . 41 1 1 A 96 96 TRP H H 96 7.899 7.254 0.645 1
1 1097 . 41 1 1 A 96 96 TRP HA H 96 5.241 4.593 0.648 1
1 1106 . 41 1 1 A 96 96 TRP C C 96 175.661 175.815 -0.154 1
1 1107 . 41 1 1 A 96 96 TRP CA C 96 55.090 58.530 -3.440 1
1 1108 . 41 1 1 A 96 96 TRP CB C 96 27.138 30.180 -3.042 1
1 1114 . 41 1 1 A 96 96 TRP N N 96 122.840 120.926 1.914 1
1 1116 . 41 1 1 A 97 97 ASP H H 97 7.344 8.459 -1.115 1
1 1117 . 41 1 1 A 97 97 ASP HA H 97 4.829 5.203 -0.374 1
1 1120 . 41 1 1 A 97 97 ASP C C 97 175.019 177.183 -2.164 1
1 1121 . 41 1 1 A 97 97 ASP CA C 97 52.149 52.126 0.023 1
1 1122 . 41 1 1 A 97 97 ASP CB C 97 42.697 42.578 0.119 1
1 1123 . 41 1 1 A 97 97 ASP N N 97 126.861 125.995 0.866 1
1 1124 . 41 1 1 A 98 98 PHE H H 98 8.566 9.259 -0.693 1
1 1125 . 41 1 1 A 98 98 PHE HA H 98 3.727 4.600 -0.873 1
1 1133 . 41 1 1 A 98 98 PHE C C 98 177.443 177.160 0.283 1
1 1134 . 41 1 1 A 98 98 PHE CA C 98 62.471 59.755 2.716 1
1 1135 . 41 1 1 A 98 98 PHE CB C 98 39.919 37.783 2.136 1
1 1141 . 41 1 1 A 98 98 PHE N N 98 117.781 117.574 0.207 1
1 1142 . 41 1 1 A 99 99 ASP H H 99 8.259 8.488 -0.229 1
1 1143 . 41 1 1 A 99 99 ASP HA H 99 3.960 4.486 -0.526 1
1 1146 . 41 1 1 A 99 99 ASP C C 99 178.132 178.372 -0.240 1
1 1147 . 41 1 1 A 99 99 ASP CA C 99 57.658 56.717 0.941 1
1 1148 . 41 1 1 A 99 99 ASP CB C 99 38.572 40.777 -2.205 1
1 1149 . 41 1 1 A 99 99 ASP N N 99 121.709 120.884 0.825 1
1 1150 . 41 1 1 A 100 100 MET H H 100 8.008 8.214 -0.206 1
1 1151 . 41 1 1 A 100 100 MET HA H 100 3.644 4.307 -0.663 1
1 1156 . 41 1 1 A 100 100 MET C C 100 180.008 177.638 2.370 1
1 1157 . 41 1 1 A 100 100 MET CA C 100 58.598 58.400 0.198 1
1 1158 . 41 1 1 A 100 100 MET CB C 100 33.423 33.295 0.128 1
1 1160 . 41 1 1 A 100 100 MET N N 100 119.668 117.695 1.973 1
1 1161 . 41 1 1 A 101 101 LEU H H 101 7.961 8.358 -0.397 1
1 1162 . 41 1 1 A 101 101 LEU HA H 101 3.523 4.208 -0.685 1
1 1172 . 41 1 1 A 101 101 LEU C C 101 173.873 176.670 -2.797 1
1 1173 . 41 1 1 A 101 101 LEU CA C 101 58.743 54.642 4.101 1
1 1174 . 41 1 1 A 101 101 LEU CB C 101 42.632 41.440 1.192 1
1 1178 . 41 1 1 A 101 101 LEU N N 101 119.752 118.607 1.145 1
1 1179 . 41 1 1 A 102 102 THR H H 102 6.955 8.051 -1.096 1
1 1180 . 41 1 1 A 102 102 THR HA H 102 4.134 3.928 0.206 1
1 1185 . 41 1 1 A 102 102 THR C C 102 176.513 175.163 1.350 1
1 1186 . 41 1 1 A 102 102 THR CA C 102 61.125 62.265 -1.140 1
1 1187 . 41 1 1 A 102 102 THR CB C 102 71.415 71.484 -0.069 1
1 1189 . 41 1 1 A 102 102 THR N N 102 124.665 118.502 6.163 1
1 1190 . 41 1 1 A 103 103 GLY H H 103 7.816 7.646 0.170 1
1 1191 . 41 1 1 A 103 103 GLY HA2 H 103 3.824 3.959 -0.135 1
1 1192 . 41 1 1 A 103 103 GLY HA3 H 103 3.824 4.007 -0.183 1
1 1193 . 41 1 1 A 103 103 GLY C C 103 174.126 173.573 0.553 1
1 1194 . 41 1 1 A 103 103 GLY CA C 103 47.805 46.588 1.217 1
1 1195 . 41 1 1 A 103 103 GLY N N 103 114.191 111.158 3.033 1
1 1196 . 41 1 1 A 104 104 SER H H 104 8.860 7.704 1.156 1
1 1197 . 41 1 1 A 104 104 SER HA H 104 4.758 4.966 -0.208 1
1 1200 . 41 1 1 A 104 104 SER C C 104 174.591 173.031 1.560 1
1 1201 . 41 1 1 A 104 104 SER CA C 104 56.755 57.648 -0.893 1
1 1202 . 41 1 1 A 104 104 SER CB C 104 65.050 64.966 0.084 1
1 1203 . 41 1 1 A 104 104 SER N N 104 114.771 113.788 0.983 1
1 1204 . 41 1 1 A 105 105 GLY H H 105 8.788 8.324 0.464 1
1 1205 . 41 1 1 A 105 105 GLY HA2 H 105 3.733 3.954 -0.221 1
1 1206 . 41 1 1 A 105 105 GLY HA3 H 105 3.733 4.102 -0.369 1
1 1207 . 41 1 1 A 105 105 GLY CA C 105 47.247 45.999 1.248 1
1 1208 . 41 1 1 A 105 105 GLY N N 105 110.394 113.468 -3.074 1
1 1209 . 41 1 1 A 106 106 ASN HA H 106 4.454 4.828 -0.374 1
1 1212 . 41 1 1 A 106 106 ASN C C 106 175.180 175.799 -0.619 1
1 1213 . 41 1 1 A 106 106 ASN CA C 106 54.492 53.760 0.732 1
1 1214 . 41 1 1 A 106 106 ASN CB C 106 37.282 41.047 -3.765 1
1 1215 . 41 1 1 A 107 107 TYR H H 107 8.241 6.744 1.497 1
1 1216 . 41 1 1 A 107 107 TYR HA H 107 4.335 4.826 -0.491 1
1 1223 . 41 1 1 A 107 107 TYR C C 107 173.954 175.279 -1.325 1
1 1224 . 41 1 1 A 107 107 TYR CA C 107 57.727 57.049 0.678 1
1 1225 . 41 1 1 A 107 107 TYR CB C 107 37.063 39.133 -2.070 1
1 1230 . 41 1 1 A 107 107 TYR N N 107 120.708 112.888 7.820 1
1 1231 . 41 1 1 A 108 108 SER H H 108 7.117 7.932 -0.815 1
1 1232 . 41 1 1 A 108 108 SER HA H 108 4.221 4.659 -0.438 1
1 1235 . 41 1 1 A 108 108 SER C C 108 174.834 173.771 1.063 1
1 1236 . 41 1 1 A 108 108 SER CA C 108 59.859 57.451 2.408 1
1 1237 . 41 1 1 A 108 108 SER CB C 108 63.846 63.409 0.437 1
1 1238 . 41 1 1 A 108 108 SER N N 108 113.362 116.246 -2.884 1
1 1239 . 41 1 1 A 109 109 SER H H 109 8.053 7.796 0.257 1
1 1240 . 41 1 1 A 109 109 SER HA H 109 4.560 4.753 -0.193 1
1 1243 . 41 1 1 A 109 109 SER CA C 109 57.141 57.468 -0.327 1
1 1244 . 41 1 1 A 109 109 SER CB C 109 64.874 64.403 0.471 1
1 1245 . 41 1 1 A 109 109 SER N N 109 116.657 115.646 1.011 1
1 1246 . 41 1 1 A 110 110 THR HA H 110 3.541 3.932 -0.391 1
1 1251 . 41 1 1 A 110 110 THR C C 110 175.477 175.945 -0.468 1
1 1252 . 41 1 1 A 110 110 THR CA C 110 66.443 66.502 -0.059 1
1 1253 . 41 1 1 A 110 110 THR CB C 110 68.091 68.712 -0.621 1
1 1255 . 41 1 1 A 111 111 ASP H H 111 8.224 8.359 -0.135 1
1 1256 . 41 1 1 A 111 111 ASP HA H 111 4.237 4.377 -0.140 1
1 1259 . 41 1 1 A 111 111 ASP C C 111 177.520 178.521 -1.001 1
1 1260 . 41 1 1 A 111 111 ASP CA C 111 57.559 57.161 0.398 1
1 1261 . 41 1 1 A 111 111 ASP CB C 111 40.292 40.684 -0.392 1
1 1262 . 41 1 1 A 111 111 ASP N N 111 119.490 120.000 -0.510 1
1 1263 . 41 1 1 A 112 112 ALA H H 112 7.431 8.155 -0.724 1
1 1264 . 41 1 1 A 112 112 ALA HA H 112 4.191 4.094 0.097 1
1 1268 . 41 1 1 A 112 112 ALA C C 112 180.646 179.834 0.812 1
1 1269 . 41 1 1 A 112 112 ALA CA C 112 54.534 55.144 -0.610 1
1 1270 . 41 1 1 A 112 112 ALA CB C 112 18.992 18.705 0.287 1
1 1271 . 41 1 1 A 112 112 ALA N N 112 119.710 121.902 -2.192 1
1 1272 . 41 1 1 A 113 113 GLN H H 113 7.576 7.938 -0.362 1
1 1273 . 41 1 1 A 113 113 GLN HA H 113 3.562 4.293 -0.731 1
1 1278 . 41 1 1 A 113 113 GLN C C 113 176.756 177.904 -1.148 1
1 1279 . 41 1 1 A 113 113 GLN CA C 113 57.736 58.604 -0.868 1
1 1280 . 41 1 1 A 113 113 GLN CB C 113 29.110 28.600 0.510 1
1 1281 . 41 1 1 A 113 113 GLN N N 113 117.518 118.095 -0.577 1
1 1283 . 41 1 1 A 114 114 MET H H 114 8.192 8.005 0.187 1
1 1284 . 41 1 1 A 114 114 MET HA H 114 4.231 4.475 -0.244 1
1 1289 . 41 1 1 A 114 114 MET C C 114 175.648 177.232 -1.584 1
1 1290 . 41 1 1 A 114 114 MET CA C 114 57.446 57.516 -0.070 1
1 1291 . 41 1 1 A 114 114 MET CB C 114 33.570 32.955 0.615 1
1 1293 . 41 1 1 A 114 114 MET N N 114 111.509 120.041 -8.532 1
1 1294 . 41 1 1 A 115 115 GLN H H 115 6.940 7.472 -0.532 1
1 1295 . 41 1 1 A 115 115 GLN HA H 115 4.307 4.442 -0.135 1
1 1302 . 41 1 1 A 115 115 GLN C C 115 176.270 174.789 1.481 1
1 1303 . 41 1 1 A 115 115 GLN CA C 115 54.680 54.908 -0.228 1
1 1304 . 41 1 1 A 115 115 GLN CB C 115 28.233 28.756 -0.523 1
1 1306 . 41 1 1 A 115 115 GLN N N 115 114.300 116.637 -2.337 1
1 1308 . 41 1 1 A 116 116 TYR H H 116 6.677 7.356 -0.679 1
1 1309 . 41 1 1 A 116 116 TYR HA H 116 4.193 4.523 -0.330 1
1 1312 . 41 1 1 A 116 116 TYR C C 116 175.268 175.123 0.145 1
1 1313 . 41 1 1 A 116 116 TYR CA C 116 54.357 57.807 -3.450 1
1 1314 . 41 1 1 A 116 116 TYR CB C 116 35.498 39.382 -3.884 1
1 1315 . 41 1 1 A 116 116 TYR N N 116 117.919 118.799 -0.880 1
1 1316 . 41 1 1 A 117 117 ASP H H 117 8.081 9.287 -1.206 1
1 1317 . 41 1 1 A 117 117 ASP HA H 117 4.665 5.078 -0.413 1
1 1320 . 41 1 1 A 117 117 ASP CA C 117 52.422 52.703 -0.281 1
1 1321 . 41 1 1 A 117 117 ASP CB C 117 42.416 40.800 1.616 1
1 1322 . 41 1 1 A 117 117 ASP N N 117 120.887 121.507 -0.620 1
1 1323 . 41 1 1 A 118 118 PRO C C 118 179.180 178.678 0.502 1
1 1324 . 41 1 1 A 118 118 PRO CA C 118 65.942 65.098 0.844 1
1 1325 . 41 1 1 A 118 118 PRO CB C 118 32.197 31.829 0.368 1
1 1326 . 41 1 1 A 119 119 GLY H H 119 9.742 8.284 1.458 1
1 1327 . 41 1 1 A 119 119 GLY C C 119 175.622 174.964 0.658 1
1 1328 . 41 1 1 A 119 119 GLY CA C 119 46.785 46.364 0.421 1
1 1329 . 41 1 1 A 119 119 GLY N N 119 106.412 106.497 -0.085 1
1 1330 . 41 1 1 A 120 120 LEU H H 120 6.666 7.049 -0.383 1
1 1331 . 41 1 1 A 120 120 LEU HA H 120 3.365 3.228 0.137 1
1 1341 . 41 1 1 A 120 120 LEU C C 120 179.262 178.498 0.764 1
1 1342 . 41 1 1 A 120 120 LEU CA C 120 56.605 57.558 -0.953 1
1 1343 . 41 1 1 A 120 120 LEU CB C 120 39.262 41.514 -2.252 1
1 1347 . 41 1 1 A 120 120 LEU N N 120 126.226 121.960 4.266 1
1 1348 . 41 1 1 A 121 121 PHE H H 121 7.356 8.431 -1.075 1
1 1349 . 41 1 1 A 121 121 PHE HA H 121 4.459 3.905 0.554 1
1 1352 . 41 1 1 A 121 121 PHE C C 121 179.716 176.788 2.928 1
1 1353 . 41 1 1 A 121 121 PHE CA C 121 62.838 61.901 0.937 1
1 1354 . 41 1 1 A 121 121 PHE CB C 121 37.603 38.676 -1.073 1
1 1355 . 41 1 1 A 121 121 PHE N N 121 117.437 119.307 -1.870 1
1 1356 . 41 1 1 A 122 122 ALA H H 122 7.926 7.867 0.059 1
1 1357 . 41 1 1 A 122 122 ALA HA H 122 4.523 3.912 0.611 1
1 1361 . 41 1 1 A 122 122 ALA C C 122 180.435 179.763 0.672 1
1 1362 . 41 1 1 A 122 122 ALA CA C 122 55.527 55.248 0.279 1
1 1363 . 41 1 1 A 122 122 ALA CB C 122 17.814 18.026 -0.212 1
1 1364 . 41 1 1 A 122 122 ALA N N 122 121.068 121.170 -0.102 1
1 1365 . 41 1 1 A 123 123 GLN H H 123 7.507 8.189 -0.682 1
1 1366 . 41 1 1 A 123 123 GLN HA H 123 4.153 3.896 0.257 1
1 1371 . 41 1 1 A 123 123 GLN C C 123 180.561 178.544 2.017 1
1 1372 . 41 1 1 A 123 123 GLN CA C 123 59.948 58.891 1.057 1
1 1373 . 41 1 1 A 123 123 GLN CB C 123 29.135 28.311 0.824 1
1 1375 . 41 1 1 A 123 123 GLN N N 123 120.324 117.077 3.247 1
1 1376 . 41 1 1 A 124 124 ILE H H 124 8.318 8.000 0.318 1
1 1377 . 41 1 1 A 124 124 ILE HA H 124 3.635 3.423 0.212 1
1 1387 . 41 1 1 A 124 124 ILE C C 124 176.481 177.526 -1.045 1
1 1388 . 41 1 1 A 124 124 ILE CA C 124 66.432 64.740 1.692 1
1 1389 . 41 1 1 A 124 124 ILE CB C 124 39.168 37.766 1.402 1
1 1393 . 41 1 1 A 124 124 ILE N N 124 123.747 120.908 2.839 1
1 1394 . 41 1 1 A 125 125 GLN H H 125 8.474 8.193 0.281 1
1 1395 . 41 1 1 A 125 125 GLN HA H 125 4.264 3.738 0.526 1
1 1402 . 41 1 1 A 125 125 GLN C C 125 178.947 177.652 1.295 1
1 1403 . 41 1 1 A 125 125 GLN CA C 125 59.651 58.175 1.476 1
1 1404 . 41 1 1 A 125 125 GLN CB C 125 28.880 27.842 1.038 1
1 1406 . 41 1 1 A 125 125 GLN N N 125 120.368 119.453 0.915 1
1 1408 . 41 1 1 A 126 126 ALA H H 126 8.002 7.587 0.415 1
1 1409 . 41 1 1 A 126 126 ALA HA H 126 4.144 4.088 0.056 1
1 1413 . 41 1 1 A 126 126 ALA C C 126 179.316 179.792 -0.476 1
1 1414 . 41 1 1 A 126 126 ALA CA C 126 55.036 54.724 0.312 1
1 1415 . 41 1 1 A 126 126 ALA CB C 126 18.087 18.244 -0.157 1
1 1416 . 41 1 1 A 126 126 ALA N N 126 121.661 121.829 -0.168 1
1 1417 . 41 1 1 A 127 127 ALA H H 127 7.823 7.719 0.104 1
1 1418 . 41 1 1 A 127 127 ALA HA H 127 4.162 4.155 0.007 1
1 1422 . 41 1 1 A 127 127 ALA C C 127 180.707 179.445 1.262 1
1 1423 . 41 1 1 A 127 127 ALA CA C 127 55.080 54.903 0.177 1
1 1424 . 41 1 1 A 127 127 ALA CB C 127 19.354 18.398 0.956 1
1 1425 . 41 1 1 A 127 127 ALA N N 127 119.853 119.878 -0.025 1
1 1426 . 41 1 1 A 128 128 ALA H H 128 8.936 8.024 0.912 1
1 1427 . 41 1 1 A 128 128 ALA HA H 128 3.928 4.173 -0.245 1
1 1431 . 41 1 1 A 128 128 ALA C C 128 181.031 179.489 1.542 1
1 1432 . 41 1 1 A 128 128 ALA CA C 128 55.502 54.805 0.697 1
1 1433 . 41 1 1 A 128 128 ALA CB C 128 16.609 17.783 -1.174 1
1 1434 . 41 1 1 A 128 128 ALA N N 128 121.355 120.574 0.781 1
1 1435 . 41 1 1 A 129 129 THR H H 129 8.543 7.877 0.666 1
1 1436 . 41 1 1 A 129 129 THR HA H 129 4.015 3.927 0.088 1
1 1441 . 41 1 1 A 129 129 THR C C 129 177.332 176.580 0.752 1
1 1442 . 41 1 1 A 129 129 THR CA C 129 65.893 65.657 0.236 1
1 1443 . 41 1 1 A 129 129 THR CB C 129 68.566 68.159 0.407 1
1 1445 . 41 1 1 A 129 129 THR N N 129 112.709 111.265 1.444 1
1 1446 . 41 1 1 A 130 130 LYS H H 130 8.126 7.464 0.662 1
1 1447 . 41 1 1 A 130 130 LYS HA H 130 4.000 4.017 -0.017 1
1 1456 . 41 1 1 A 130 130 LYS C C 130 179.082 178.708 0.374 1
1 1457 . 41 1 1 A 130 130 LYS CA C 130 60.299 58.990 1.309 1
1 1458 . 41 1 1 A 130 130 LYS CB C 130 32.767 32.200 0.567 1
1 1462 . 41 1 1 A 130 130 LYS N N 130 123.879 122.011 1.868 1
1 1463 . 41 1 1 A 131 131 ALA H H 131 7.184 7.992 -0.808 1
1 1464 . 41 1 1 A 131 131 ALA HA H 131 4.005 4.285 -0.280 1
1 1468 . 41 1 1 A 131 131 ALA C C 131 178.482 179.638 -1.156 1
1 1469 . 41 1 1 A 131 131 ALA CA C 131 55.027 55.260 -0.233 1
1 1470 . 41 1 1 A 131 131 ALA CB C 131 18.669 19.567 -0.898 1
1 1471 . 41 1 1 A 131 131 ALA N N 131 118.590 120.736 -2.146 1
1 1472 . 41 1 1 A 132 132 TRP H H 132 7.977 8.848 -0.871 1
1 1473 . 41 1 1 A 132 132 TRP HA H 132 4.001 3.996 0.005 1
1 1480 . 41 1 1 A 132 132 TRP C C 132 177.332 175.958 1.374 1
1 1481 . 41 1 1 A 132 132 TRP CA C 132 60.431 57.733 2.698 1
1 1482 . 41 1 1 A 132 132 TRP CB C 132 27.786 27.699 0.087 1
1 1486 . 41 1 1 A 132 132 TRP N N 132 119.168 117.310 1.858 1
1 1488 . 41 1 1 A 133 133 ARG H H 133 8.006 8.144 -0.138 1
1 1489 . 41 1 1 A 133 133 ARG HA H 133 4.027 4.515 -0.488 1
1 1497 . 41 1 1 A 133 133 ARG C C 133 176.664 178.119 -1.455 1
1 1498 . 41 1 1 A 133 133 ARG CA C 133 59.355 57.216 2.139 1
1 1499 . 41 1 1 A 133 133 ARG CB C 133 30.451 32.386 -1.935 1
1 1502 . 41 1 1 A 133 133 ARG N N 133 113.062 120.671 -7.609 1
1 1504 . 41 1 1 A 134 134 LYS H H 134 7.322 8.170 -0.848 1
1 1505 . 41 1 1 A 134 134 LYS HA H 134 4.313 4.386 -0.073 1
1 1514 . 41 1 1 A 134 134 LYS C C 134 176.282 176.343 -0.061 1
1 1515 . 41 1 1 A 134 134 LYS CA C 134 54.922 55.470 -0.548 1
1 1516 . 41 1 1 A 134 134 LYS CB C 134 32.633 30.690 1.943 1
1 1520 . 41 1 1 A 134 134 LYS N N 134 118.170 119.671 -1.501 1
1 1521 . 41 1 1 A 135 135 LEU H H 135 7.440 8.072 -0.632 1
1 1522 . 41 1 1 A 135 135 LEU HA H 135 4.174 4.640 -0.466 1
1 1532 . 41 1 1 A 135 135 LEU CA C 135 54.408 51.784 2.624 1
1 1533 . 41 1 1 A 135 135 LEU CB C 135 40.407 41.859 -1.452 1
1 1537 . 41 1 1 A 135 135 LEU N N 135 123.358 122.088 1.270 1
1 1538 . 41 1 1 A 136 136 PRO HA H 136 4.437 4.485 -0.048 1
1 1545 . 41 1 1 A 136 136 PRO C C 136 177.106 176.062 1.044 1
1 1546 . 41 1 1 A 136 136 PRO CA C 136 62.889 64.934 -2.045 1
1 1547 . 41 1 1 A 136 136 PRO CB C 136 32.192 32.296 -0.104 1
1 1550 . 41 1 1 A 137 137 VAL H H 137 8.219 7.356 0.863 1
1 1551 . 41 1 1 A 137 137 VAL HA H 137 4.077 4.455 -0.378 1
1 1559 . 41 1 1 A 137 137 VAL C C 137 176.305 173.727 2.578 1
1 1560 . 41 1 1 A 137 137 VAL CA C 137 61.958 59.370 2.588 1
1 1561 . 41 1 1 A 137 137 VAL CB C 137 32.755 35.477 -2.722 1
1 1564 . 41 1 1 A 137 137 VAL N N 137 120.079 109.612 10.467 1
1 1565 . 41 1 1 A 138 138 LYS H H 138 8.444 8.497 -0.053 1
1 1566 . 41 1 1 A 138 138 LYS HA H 138 4.316 5.045 -0.729 1
1 1575 . 41 1 1 A 138 138 LYS C C 138 176.790 176.978 -0.188 1
1 1576 . 41 1 1 A 138 138 LYS CA C 138 56.792 54.407 2.385 1
1 1577 . 41 1 1 A 138 138 LYS CB C 138 33.205 35.745 -2.540 1
1 1581 . 41 1 1 A 138 138 LYS N N 138 126.449 120.526 5.923 1
1 1582 . 41 1 1 A 139 139 GLY H H 139 8.518 8.597 -0.079 1
1 1583 . 41 1 1 A 139 139 GLY HA2 H 139 4.070 4.050 0.020 1
1 1584 . 41 1 1 A 139 139 GLY HA3 H 139 3.897 4.054 -0.157 1
1 1585 . 41 1 1 A 139 139 GLY C C 139 172.874 173.021 -0.147 1
1 1586 . 41 1 1 A 139 139 GLY CA C 139 45.157 44.597 0.560 1
1 1587 . 41 1 1 A 139 139 GLY N N 139 112.617 108.941 3.676 1
1 6 . 42 1 1 A 2 2 VAL H H 2 8.992 7.881 1.111 1
1 7 . 42 1 1 A 2 2 VAL HA H 2 5.370 4.711 0.659 1
1 15 . 42 1 1 A 2 2 VAL C C 2 174.325 174.030 0.295 1
1 16 . 42 1 1 A 2 2 VAL CA C 2 61.267 60.545 0.722 1
1 17 . 42 1 1 A 2 2 VAL CB C 2 33.890 35.027 -1.137 1
1 20 . 42 1 1 A 2 2 VAL N N 2 126.939 116.478 10.461 1
1 21 . 42 1 1 A 3 3 THR H H 3 8.912 8.722 0.190 1
1 22 . 42 1 1 A 3 3 THR HA H 3 4.505 5.205 -0.700 1
1 27 . 42 1 1 A 3 3 THR C C 3 172.710 172.839 -0.129 1
1 28 . 42 1 1 A 3 3 THR CA C 3 59.689 59.583 0.106 1
1 29 . 42 1 1 A 3 3 THR CB C 3 72.398 72.353 0.045 1
1 31 . 42 1 1 A 3 3 THR N N 3 118.091 122.474 -4.383 1
1 32 . 42 1 1 A 4 4 GLU H H 4 8.631 8.916 -0.285 1
1 33 . 42 1 1 A 4 4 GLU HA H 4 5.788 4.980 0.808 1
1 38 . 42 1 1 A 4 4 GLU C C 4 175.758 174.390 1.368 1
1 39 . 42 1 1 A 4 4 GLU CA C 4 54.902 54.132 0.770 1
1 40 . 42 1 1 A 4 4 GLU CB C 4 35.097 33.837 1.260 1
1 42 . 42 1 1 A 4 4 GLU N N 4 120.966 124.612 -3.646 1
1 43 . 42 1 1 A 5 5 THR H H 5 9.188 9.018 0.170 1
1 44 . 42 1 1 A 5 5 THR HA H 5 4.739 5.108 -0.369 1
1 49 . 42 1 1 A 5 5 THR C C 5 172.757 172.193 0.564 1
1 50 . 42 1 1 A 5 5 THR CA C 5 60.382 60.122 0.260 1
1 51 . 42 1 1 A 5 5 THR CB C 5 71.558 72.093 -0.535 1
1 53 . 42 1 1 A 5 5 THR N N 5 119.366 114.853 4.513 1
1 54 . 42 1 1 A 6 6 VAL H H 6 8.476 8.749 -0.273 1
1 55 . 42 1 1 A 6 6 VAL HA H 6 5.026 5.865 -0.839 1
1 63 . 42 1 1 A 6 6 VAL C C 6 176.674 174.992 1.682 1
1 64 . 42 1 1 A 6 6 VAL CA C 6 61.008 60.944 0.064 1
1 65 . 42 1 1 A 6 6 VAL CB C 6 33.861 35.215 -1.354 1
1 68 . 42 1 1 A 6 6 VAL N N 6 121.384 124.885 -3.501 1
1 69 . 42 1 1 A 7 7 ASP H H 7 8.848 8.737 0.111 1
1 70 . 42 1 1 A 7 7 ASP HA H 7 4.797 4.775 0.022 1
1 73 . 42 1 1 A 7 7 ASP CA C 7 52.834 54.424 -1.590 1
1 74 . 42 1 1 A 7 7 ASP CB C 7 42.219 42.067 0.152 1
1 75 . 42 1 1 A 7 7 ASP N N 7 127.061 127.758 -0.697 1
1 76 . 42 1 1 A 8 8 GLY C C 8 175.143 173.965 1.178 1
1 77 . 42 1 1 A 8 8 GLY CA C 8 46.553 46.335 0.218 1
1 78 . 42 1 1 A 9 9 GLN H H 9 8.408 7.809 0.599 1
1 79 . 42 1 1 A 9 9 GLN HA H 9 4.541 4.305 0.236 1
1 86 . 42 1 1 A 9 9 GLN C C 9 176.463 177.087 -0.624 1
1 87 . 42 1 1 A 9 9 GLN CA C 9 55.167 54.974 0.193 1
1 88 . 42 1 1 A 9 9 GLN CB C 9 29.376 27.982 1.394 1
1 90 . 42 1 1 A 9 9 GLN N N 9 118.300 116.523 1.777 1
1 92 . 42 1 1 A 10 10 GLY H H 10 8.162 8.261 -0.099 1
1 93 . 42 1 1 A 10 10 GLY HA2 H 10 4.174 3.932 0.242 1
1 94 . 42 1 1 A 10 10 GLY HA3 H 10 3.521 3.946 -0.425 1
1 95 . 42 1 1 A 10 10 GLY C C 10 174.092 174.673 -0.581 1
1 96 . 42 1 1 A 10 10 GLY CA C 10 45.558 46.260 -0.702 1
1 97 . 42 1 1 A 10 10 GLY N N 10 108.747 110.645 -1.898 1
1 98 . 42 1 1 A 11 11 GLN H H 11 8.507 7.850 0.657 1
1 99 . 42 1 1 A 11 11 GLN HA H 11 4.202 4.531 -0.329 1
1 106 . 42 1 1 A 11 11 GLN C C 11 173.992 174.453 -0.461 1
1 107 . 42 1 1 A 11 11 GLN CA C 11 55.098 54.656 0.442 1
1 108 . 42 1 1 A 11 11 GLN CB C 11 29.097 30.573 -1.476 1
1 110 . 42 1 1 A 11 11 GLN N N 11 122.979 119.873 3.106 1
1 112 . 42 1 1 A 12 12 ALA H H 12 8.259 8.868 -0.609 1
1 113 . 42 1 1 A 12 12 ALA HA H 12 5.156 5.191 -0.035 1
1 117 . 42 1 1 A 12 12 ALA C C 12 177.284 176.484 0.800 1
1 118 . 42 1 1 A 12 12 ALA CA C 12 51.087 50.754 0.333 1
1 119 . 42 1 1 A 12 12 ALA CB C 12 20.500 19.993 0.507 1
1 120 . 42 1 1 A 12 12 ALA N N 12 127.100 128.645 -1.545 1
1 121 . 42 1 1 A 13 13 TRP H H 13 9.245 8.848 0.397 1
1 122 . 42 1 1 A 13 13 TRP HA H 13 4.717 5.347 -0.630 1
1 131 . 42 1 1 A 13 13 TRP C C 13 175.108 174.347 0.761 1
1 132 . 42 1 1 A 13 13 TRP CA C 13 55.966 55.486 0.480 1
1 133 . 42 1 1 A 13 13 TRP CB C 13 31.912 32.014 -0.102 1
1 139 . 42 1 1 A 13 13 TRP N N 13 123.088 120.567 2.521 1
1 141 . 42 1 1 A 14 14 ARG H H 14 8.575 8.710 -0.135 1
1 142 . 42 1 1 A 14 14 ARG HA H 14 5.335 4.390 0.945 1
1 150 . 42 1 1 A 14 14 ARG C C 14 175.191 174.123 1.068 1
1 151 . 42 1 1 A 14 14 ARG CA C 14 53.106 55.135 -2.029 1
1 152 . 42 1 1 A 14 14 ARG CB C 14 32.749 31.592 1.157 1
1 154 . 42 1 1 A 14 14 ARG N N 14 121.163 119.802 1.361 1
1 156 . 42 1 1 A 15 15 HIS H H 15 8.595 7.970 0.625 1
1 157 . 42 1 1 A 15 15 HIS HA H 15 4.790 5.128 -0.338 1
1 161 . 42 1 1 A 15 15 HIS C C 15 173.770 174.339 -0.569 1
1 162 . 42 1 1 A 15 15 HIS CA C 15 55.289 54.754 0.535 1
1 163 . 42 1 1 A 15 15 HIS CB C 15 33.208 33.117 0.091 1
1 165 . 42 1 1 A 15 15 HIS N N 15 117.643 119.431 -1.788 1
1 166 . 42 1 1 A 16 16 HIS H H 16 8.993 8.873 0.120 1
1 167 . 42 1 1 A 16 16 HIS HA H 16 5.158 4.726 0.432 1
1 171 . 42 1 1 A 16 16 HIS C C 16 173.608 173.872 -0.264 1
1 172 . 42 1 1 A 16 16 HIS CA C 16 56.450 55.965 0.485 1
1 173 . 42 1 1 A 16 16 HIS CB C 16 34.171 30.813 3.358 1
1 175 . 42 1 1 A 16 16 HIS N N 16 123.520 123.723 -0.203 1
1 176 . 42 1 1 A 17 17 ASN H H 17 7.829 8.892 -1.063 1
1 177 . 42 1 1 A 17 17 ASN HA H 17 4.713 5.078 -0.365 1
1 182 . 42 1 1 A 17 17 ASN C C 17 173.682 174.561 -0.879 1
1 183 . 42 1 1 A 17 17 ASN CA C 17 51.822 51.477 0.345 1
1 184 . 42 1 1 A 17 17 ASN CB C 17 43.176 41.721 1.455 1
1 185 . 42 1 1 A 17 17 ASN N N 17 122.213 126.107 -3.894 1
1 187 . 42 1 1 A 18 18 GLY H H 18 8.423 8.376 0.047 1
1 188 . 42 1 1 A 18 18 GLY HA2 H 18 3.931 3.968 -0.037 1
1 189 . 42 1 1 A 18 18 GLY HA3 H 18 3.707 4.008 -0.301 1
1 190 . 42 1 1 A 18 18 GLY C C 18 173.985 172.793 1.192 1
1 191 . 42 1 1 A 18 18 GLY CA C 18 43.949 45.142 -1.193 1
1 192 . 42 1 1 A 18 18 GLY N N 18 106.991 109.368 -2.377 1
1 193 . 42 1 1 A 19 19 PHE H H 19 8.338 8.903 -0.565 1
1 194 . 42 1 1 A 19 19 PHE HA H 19 4.068 4.859 -0.791 1
1 197 . 42 1 1 A 19 19 PHE C C 19 176.568 175.160 1.408 1
1 198 . 42 1 1 A 19 19 PHE CA C 19 59.338 57.730 1.608 1
1 199 . 42 1 1 A 19 19 PHE CB C 19 40.201 40.815 -0.614 1
1 200 . 42 1 1 A 19 19 PHE N N 19 116.857 120.931 -4.074 1
1 201 . 42 1 1 A 20 20 ASP H H 20 8.794 8.724 0.070 1
1 202 . 42 1 1 A 20 20 ASP HA H 20 4.485 4.802 -0.317 1
1 205 . 42 1 1 A 20 20 ASP C C 20 177.379 176.393 0.986 1
1 206 . 42 1 1 A 20 20 ASP CA C 20 54.140 53.561 0.579 1
1 207 . 42 1 1 A 20 20 ASP CB C 20 41.915 41.002 0.913 1
1 208 . 42 1 1 A 20 20 ASP N N 20 123.025 123.747 -0.722 1
1 209 . 42 1 1 A 21 21 PHE H H 21 8.862 9.082 -0.220 1
1 210 . 42 1 1 A 21 21 PHE HA H 21 4.087 4.114 -0.027 1
1 218 . 42 1 1 A 21 21 PHE C C 21 176.952 177.229 -0.277 1
1 219 . 42 1 1 A 21 21 PHE CA C 21 61.095 62.233 -1.138 1
1 220 . 42 1 1 A 21 21 PHE CB C 21 38.678 39.100 -0.422 1
1 226 . 42 1 1 A 21 21 PHE N N 21 127.163 127.266 -0.103 1
1 227 . 42 1 1 A 22 22 ALA H H 22 8.561 8.433 0.128 1
1 228 . 42 1 1 A 22 22 ALA HA H 22 3.878 4.001 -0.123 1
1 232 . 42 1 1 A 22 22 ALA C C 22 180.710 180.235 0.475 1
1 233 . 42 1 1 A 22 22 ALA CA C 22 55.211 55.183 0.028 1
1 234 . 42 1 1 A 22 22 ALA CB C 22 18.321 18.151 0.170 1
1 235 . 42 1 1 A 22 22 ALA N N 22 120.293 121.305 -1.012 1
1 236 . 42 1 1 A 23 23 VAL H H 23 7.241 7.552 -0.311 1
1 237 . 42 1 1 A 23 23 VAL HA H 23 3.684 3.497 0.187 1
1 245 . 42 1 1 A 23 23 VAL C C 23 177.101 178.376 -1.275 1
1 246 . 42 1 1 A 23 23 VAL CA C 23 65.237 67.004 -1.767 1
1 247 . 42 1 1 A 23 23 VAL CB C 23 31.780 31.654 0.126 1
1 250 . 42 1 1 A 23 23 VAL N N 23 118.775 118.378 0.397 1
1 251 . 42 1 1 A 24 24 ILE H H 24 6.761 7.925 -1.164 1
1 252 . 42 1 1 A 24 24 ILE HA H 24 3.196 3.528 -0.332 1
1 262 . 42 1 1 A 24 24 ILE C C 24 177.287 178.030 -0.743 1
1 263 . 42 1 1 A 24 24 ILE CA C 24 63.404 65.455 -2.051 1
1 264 . 42 1 1 A 24 24 ILE CB C 24 36.294 37.469 -1.175 1
1 268 . 42 1 1 A 24 24 ILE N N 24 119.036 119.593 -0.557 1
1 269 . 42 1 1 A 25 25 LYS H H 25 8.032 8.099 -0.067 1
1 270 . 42 1 1 A 25 25 LYS HA H 25 3.809 3.717 0.092 1
1 279 . 42 1 1 A 25 25 LYS C C 25 179.450 177.011 2.439 1
1 280 . 42 1 1 A 25 25 LYS CA C 25 59.621 58.987 0.634 1
1 281 . 42 1 1 A 25 25 LYS CB C 25 32.259 31.829 0.430 1
1 285 . 42 1 1 A 25 25 LYS N N 25 118.368 120.126 -1.758 1
1 286 . 42 1 1 A 26 26 GLU H H 26 7.845 7.969 -0.124 1
1 287 . 42 1 1 A 26 26 GLU HA H 26 4.021 4.239 -0.218 1
1 292 . 42 1 1 A 26 26 GLU C C 26 179.191 178.928 0.263 1
1 293 . 42 1 1 A 26 26 GLU CA C 26 59.530 58.885 0.645 1
1 294 . 42 1 1 A 26 26 GLU CB C 26 29.449 29.677 -0.228 1
1 296 . 42 1 1 A 26 26 GLU N N 26 120.522 118.853 1.669 1
1 297 . 42 1 1 A 27 27 LEU H H 27 8.165 7.761 0.404 1
1 298 . 42 1 1 A 27 27 LEU HA H 27 4.163 4.119 0.044 1
1 308 . 42 1 1 A 27 27 LEU C C 27 177.256 178.241 -0.985 1
1 309 . 42 1 1 A 27 27 LEU CA C 27 58.049 57.463 0.586 1
1 310 . 42 1 1 A 27 27 LEU CB C 27 41.365 41.850 -0.485 1
1 314 . 42 1 1 A 27 27 LEU N N 27 120.879 120.760 0.119 1
1 315 . 42 1 1 A 28 28 LYS H H 28 8.902 8.451 0.451 1
1 316 . 42 1 1 A 28 28 LYS HA H 28 4.199 4.317 -0.118 1
1 317 . 42 1 1 A 28 28 LYS C C 28 179.707 178.889 0.818 1
1 318 . 42 1 1 A 28 28 LYS CA C 28 60.097 59.871 0.226 1
1 319 . 42 1 1 A 28 28 LYS CB C 28 33.420 32.116 1.304 1
1 320 . 42 1 1 A 28 28 LYS N N 28 120.050 120.254 -0.204 1
1 321 . 42 1 1 A 29 29 THR H H 29 8.294 8.152 0.142 1
1 322 . 42 1 1 A 29 29 THR HA H 29 3.892 4.020 -0.128 1
1 327 . 42 1 1 A 29 29 THR C C 29 175.711 176.736 -1.025 1
1 328 . 42 1 1 A 29 29 THR CA C 29 66.846 66.490 0.356 1
1 329 . 42 1 1 A 29 29 THR CB C 29 68.794 68.993 -0.199 1
1 331 . 42 1 1 A 29 29 THR N N 29 115.933 116.618 -0.685 1
1 332 . 42 1 1 A 30 30 ALA H H 30 8.244 8.741 -0.497 1
1 333 . 42 1 1 A 30 30 ALA HA H 30 4.241 4.259 -0.018 1
1 337 . 42 1 1 A 30 30 ALA C C 30 179.128 180.110 -0.982 1
1 338 . 42 1 1 A 30 30 ALA CA C 30 55.714 55.708 0.006 1
1 339 . 42 1 1 A 30 30 ALA CB C 30 18.955 18.102 0.853 1
1 340 . 42 1 1 A 30 30 ALA N N 30 124.617 123.207 1.410 1
1 341 . 42 1 1 A 31 31 ALA H H 31 8.968 8.614 0.354 1
1 342 . 42 1 1 A 31 31 ALA HA H 31 3.890 4.152 -0.262 1
1 346 . 42 1 1 A 31 31 ALA C C 31 180.352 179.739 0.613 1
1 347 . 42 1 1 A 31 31 ALA CA C 31 55.454 54.942 0.512 1
1 348 . 42 1 1 A 31 31 ALA CB C 31 17.124 18.218 -1.094 1
1 349 . 42 1 1 A 31 31 ALA N N 31 119.327 120.515 -1.188 1
1 350 . 42 1 1 A 32 32 SER H H 32 7.995 7.920 0.075 1
1 351 . 42 1 1 A 32 32 SER HA H 32 4.238 4.242 -0.004 1
1 354 . 42 1 1 A 32 32 SER C C 32 175.612 176.420 -0.808 1
1 355 . 42 1 1 A 32 32 SER CA C 32 61.203 61.757 -0.554 1
1 356 . 42 1 1 A 32 32 SER CB C 32 63.406 63.753 -0.347 1
1 357 . 42 1 1 A 32 32 SER N N 32 111.962 114.662 -2.700 1
1 358 . 42 1 1 A 33 33 GLN H H 33 8.333 8.290 0.043 1
1 359 . 42 1 1 A 33 33 GLN HA H 33 3.992 4.036 -0.044 1
1 366 . 42 1 1 A 33 33 GLN C C 33 177.486 177.349 0.137 1
1 367 . 42 1 1 A 33 33 GLN CA C 33 58.277 58.671 -0.394 1
1 368 . 42 1 1 A 33 33 GLN CB C 33 29.140 29.064 0.076 1
1 370 . 42 1 1 A 33 33 GLN N N 33 119.527 121.070 -1.543 1
1 372 . 42 1 1 A 34 34 TYR H H 34 8.587 8.167 0.420 1
1 373 . 42 1 1 A 34 34 TYR HA H 34 4.792 4.690 0.102 1
1 380 . 42 1 1 A 34 34 TYR C C 34 176.499 176.586 -0.087 1
1 381 . 42 1 1 A 34 34 TYR CA C 34 57.711 58.339 -0.628 1
1 382 . 42 1 1 A 34 34 TYR CB C 34 39.561 39.531 0.030 1
1 387 . 42 1 1 A 34 34 TYR N N 34 114.610 115.012 -0.402 1
1 388 . 42 1 1 A 35 35 GLY H H 35 7.346 8.341 -0.995 1
1 389 . 42 1 1 A 35 35 GLY HA2 H 35 4.785 4.129 0.656 1
1 390 . 42 1 1 A 35 35 GLY HA3 H 35 4.007 4.138 -0.131 1
1 391 . 42 1 1 A 35 35 GLY C C 35 175.796 173.487 2.309 1
1 392 . 42 1 1 A 35 35 GLY CA C 35 44.355 45.002 -0.647 1
1 393 . 42 1 1 A 35 35 GLY N N 35 108.501 107.134 1.367 1
1 394 . 42 1 1 A 36 36 ALA H H 36 9.363 8.250 1.113 1
1 395 . 42 1 1 A 36 36 ALA HA H 36 4.217 4.852 -0.635 1
1 399 . 42 1 1 A 36 36 ALA C C 36 178.039 178.106 -0.067 1
1 400 . 42 1 1 A 36 36 ALA CA C 36 56.114 51.212 4.902 1
1 401 . 42 1 1 A 36 36 ALA CB C 36 19.179 20.811 -1.632 1
1 402 . 42 1 1 A 36 36 ALA N N 36 125.811 124.680 1.131 1
1 403 . 42 1 1 A 37 37 THR H H 37 8.070 8.738 -0.668 1
1 404 . 42 1 1 A 37 37 THR HA H 37 4.570 4.131 0.439 1
1 409 . 42 1 1 A 37 37 THR C C 37 173.685 174.039 -0.354 1
1 410 . 42 1 1 A 37 37 THR CA C 37 59.822 65.494 -5.672 1
1 411 . 42 1 1 A 37 37 THR CB C 37 68.267 66.779 1.488 1
1 413 . 42 1 1 A 37 37 THR N N 37 129.410 109.381 20.029 1
1 414 . 42 1 1 A 38 38 ALA H H 38 6.853 7.873 -1.020 1
1 415 . 42 1 1 A 38 38 ALA HA H 38 4.601 4.611 -0.010 1
1 419 . 42 1 1 A 38 38 ALA CA C 38 50.758 50.548 0.210 1
1 420 . 42 1 1 A 38 38 ALA CB C 38 18.325 19.979 -1.654 1
1 421 . 42 1 1 A 38 38 ALA N N 38 124.674 125.009 -0.335 1
1 422 . 42 1 1 A 40 40 TYR HA H 40 4.032 3.970 0.062 1
1 429 . 42 1 1 A 40 40 TYR C C 40 176.456 177.480 -1.024 1
1 430 . 42 1 1 A 40 40 TYR CA C 40 61.010 61.870 -0.860 1
1 431 . 42 1 1 A 40 40 TYR CB C 40 39.286 38.478 0.808 1
1 436 . 42 1 1 A 41 41 THR H H 41 6.874 8.184 -1.310 1
1 437 . 42 1 1 A 41 41 THR HA H 41 3.616 3.775 -0.159 1
1 442 . 42 1 1 A 41 41 THR C C 41 176.930 176.481 0.449 1
1 443 . 42 1 1 A 41 41 THR CA C 41 65.557 65.523 0.034 1
1 444 . 42 1 1 A 41 41 THR CB C 41 68.228 69.365 -1.137 1
1 446 . 42 1 1 A 41 41 THR N N 41 115.143 113.868 1.275 1
1 447 . 42 1 1 A 42 42 LEU H H 42 8.623 7.770 0.853 1
1 448 . 42 1 1 A 42 42 LEU HA H 42 3.708 4.059 -0.351 1
1 458 . 42 1 1 A 42 42 LEU C C 42 178.206 179.110 -0.904 1
1 459 . 42 1 1 A 42 42 LEU CA C 42 57.417 57.728 -0.311 1
1 460 . 42 1 1 A 42 42 LEU CB C 42 41.342 41.215 0.127 1
1 464 . 42 1 1 A 42 42 LEU N N 42 120.418 119.447 0.971 1
1 465 . 42 1 1 A 43 43 ALA H H 43 7.735 7.991 -0.256 1
1 466 . 42 1 1 A 43 43 ALA HA H 43 4.020 3.939 0.081 1
1 470 . 42 1 1 A 43 43 ALA C C 43 180.826 180.368 0.458 1
1 471 . 42 1 1 A 43 43 ALA CA C 43 54.925 55.142 -0.217 1
1 472 . 42 1 1 A 43 43 ALA CB C 43 17.506 17.858 -0.352 1
1 473 . 42 1 1 A 43 43 ALA N N 43 120.203 121.936 -1.733 1
1 474 . 42 1 1 A 44 44 ILE H H 44 7.149 7.298 -0.149 1
1 475 . 42 1 1 A 44 44 ILE HA H 44 3.603 3.557 0.046 1
1 485 . 42 1 1 A 44 44 ILE C C 44 178.594 178.217 0.377 1
1 486 . 42 1 1 A 44 44 ILE CA C 44 64.782 64.614 0.168 1
1 487 . 42 1 1 A 44 44 ILE CB C 44 37.472 37.648 -0.176 1
1 491 . 42 1 1 A 44 44 ILE N N 44 118.881 119.440 -0.559 1
1 492 . 42 1 1 A 45 45 VAL H H 45 7.968 7.815 0.153 1
1 493 . 42 1 1 A 45 45 VAL HA H 45 2.925 3.301 -0.376 1
1 501 . 42 1 1 A 45 45 VAL C C 45 177.023 177.458 -0.435 1
1 502 . 42 1 1 A 45 45 VAL CA C 45 67.081 66.874 0.207 1
1 503 . 42 1 1 A 45 45 VAL CB C 45 30.854 31.231 -0.377 1
1 506 . 42 1 1 A 45 45 VAL N N 45 120.764 119.651 1.113 1
1 507 . 42 1 1 A 46 46 GLU H H 46 8.399 8.202 0.197 1
1 508 . 42 1 1 A 46 46 GLU HA H 46 3.848 3.825 0.023 1
1 513 . 42 1 1 A 46 46 GLU C C 46 178.656 178.974 -0.318 1
1 514 . 42 1 1 A 46 46 GLU CA C 46 59.491 59.390 0.101 1
1 515 . 42 1 1 A 46 46 GLU CB C 46 28.991 29.334 -0.343 1
1 517 . 42 1 1 A 46 46 GLU N N 46 116.599 119.525 -2.926 1
1 518 . 42 1 1 A 47 47 SER H H 47 7.273 8.084 -0.811 1
1 519 . 42 1 1 A 47 47 SER HA H 47 4.287 4.058 0.229 1
1 521 . 42 1 1 A 47 47 SER CA C 47 61.047 62.572 -1.525 1
1 522 . 42 1 1 A 47 47 SER CB C 47 63.016 62.919 0.097 1
1 523 . 42 1 1 A 47 47 SER N N 47 113.609 116.928 -3.319 1
1 524 . 42 1 1 A 48 48 VAL H H 48 8.006 8.134 -0.128 1
1 525 . 42 1 1 A 48 48 VAL HA H 48 3.556 3.544 0.012 1
1 533 . 42 1 1 A 48 48 VAL C C 48 177.257 177.510 -0.253 1
1 534 . 42 1 1 A 48 48 VAL CA C 48 65.025 66.542 -1.517 1
1 535 . 42 1 1 A 48 48 VAL CB C 48 31.841 31.447 0.394 1
1 538 . 42 1 1 A 48 48 VAL N N 48 122.327 121.511 0.816 1
1 539 . 42 1 1 A 49 49 ALA H H 49 8.369 7.699 0.670 1
1 540 . 42 1 1 A 49 49 ALA HA H 49 4.115 4.243 -0.128 1
1 544 . 42 1 1 A 49 49 ALA C C 49 177.307 177.247 0.060 1
1 545 . 42 1 1 A 49 49 ALA CA C 49 53.253 53.132 0.121 1
1 546 . 42 1 1 A 49 49 ALA CB C 49 20.131 18.180 1.951 1
1 547 . 42 1 1 A 49 49 ALA N N 49 118.050 120.664 -2.614 1
1 548 . 42 1 1 A 50 50 ASP H H 50 7.052 7.873 -0.821 1
1 549 . 42 1 1 A 50 50 ASP HA H 50 4.788 4.573 0.215 1
1 552 . 42 1 1 A 50 50 ASP C C 50 175.481 175.990 -0.509 1
1 553 . 42 1 1 A 50 50 ASP CA C 50 53.681 54.396 -0.715 1
1 554 . 42 1 1 A 50 50 ASP CB C 50 39.333 41.110 -1.777 1
1 555 . 42 1 1 A 50 50 ASP N N 50 116.997 117.084 -0.087 1
1 556 . 42 1 1 A 51 51 ASN H H 51 8.535 7.589 0.946 1
1 557 . 42 1 1 A 51 51 ASN HA H 51 4.628 4.908 -0.280 1
1 562 . 42 1 1 A 51 51 ASN C C 51 174.077 175.426 -1.349 1
1 563 . 42 1 1 A 51 51 ASN CA C 51 52.315 51.764 0.551 1
1 564 . 42 1 1 A 51 51 ASN CB C 51 41.928 40.164 1.764 1
1 565 . 42 1 1 A 51 51 ASN N N 51 118.626 117.615 1.011 1
1 567 . 42 1 1 A 52 52 TRP H H 52 8.555 8.160 0.395 1
1 574 . 42 1 1 A 52 52 TRP C C 52 173.269 175.994 -2.725 1
1 575 . 42 1 1 A 52 52 TRP CA C 52 55.031 58.410 -3.379 1
1 576 . 42 1 1 A 52 52 TRP CB C 52 26.801 29.256 -2.455 1
1 582 . 42 1 1 A 52 52 TRP N N 52 120.693 121.286 -0.593 1
1 584 . 42 1 1 A 53 53 LEU H H 53 7.847 9.150 -1.303 1
1 585 . 42 1 1 A 53 53 LEU HA H 53 4.859 5.207 -0.348 1
1 595 . 42 1 1 A 53 53 LEU C C 53 177.397 175.624 1.773 1
1 596 . 42 1 1 A 53 53 LEU CA C 53 53.619 54.438 -0.819 1
1 597 . 42 1 1 A 53 53 LEU CB C 53 41.812 46.016 -4.204 1
1 601 . 42 1 1 A 53 53 LEU N N 53 124.741 125.815 -1.074 1
1 602 . 42 1 1 A 54 54 THR H H 54 8.850 9.057 -0.207 1
1 603 . 42 1 1 A 54 54 THR HA H 54 4.598 5.011 -0.413 1
1 608 . 42 1 1 A 54 54 THR CA C 54 60.531 60.126 0.405 1
1 609 . 42 1 1 A 54 54 THR CB C 54 67.183 68.994 -1.811 1
1 611 . 42 1 1 A 54 54 THR N N 54 113.407 116.045 -2.638 1
1 612 . 42 1 1 A 55 55 PRO HA H 55 4.511 3.739 0.772 1
1 619 . 42 1 1 A 55 55 PRO C C 55 179.383 177.690 1.693 1
1 620 . 42 1 1 A 55 55 PRO CA C 55 67.159 65.248 1.911 1
1 621 . 42 1 1 A 55 55 PRO CB C 55 32.095 31.673 0.422 1
1 622 . 42 1 1 A 56 56 THR H H 56 8.575 7.660 0.915 1
1 623 . 42 1 1 A 56 56 THR HA H 56 4.229 4.116 0.113 1
1 628 . 42 1 1 A 56 56 THR C C 56 176.668 176.496 0.172 1
1 629 . 42 1 1 A 56 56 THR CA C 56 66.943 65.077 1.866 1
1 630 . 42 1 1 A 56 56 THR CB C 56 68.129 68.669 -0.540 1
1 632 . 42 1 1 A 56 56 THR N N 56 114.855 111.458 3.397 1
1 633 . 42 1 1 A 57 57 ASP H H 57 8.730 8.019 0.711 1
1 634 . 42 1 1 A 57 57 ASP HA H 57 4.425 4.351 0.074 1
1 637 . 42 1 1 A 57 57 ASP C C 57 178.351 178.828 -0.477 1
1 638 . 42 1 1 A 57 57 ASP CA C 57 57.963 56.607 1.356 1
1 639 . 42 1 1 A 57 57 ASP CB C 57 40.134 40.329 -0.195 1
1 640 . 42 1 1 A 57 57 ASP N N 57 126.239 120.332 5.907 1
1 641 . 42 1 1 A 58 58 TRP H H 58 8.244 7.987 0.257 1
1 642 . 42 1 1 A 58 58 TRP HA H 58 4.030 4.431 -0.401 1
1 650 . 42 1 1 A 58 58 TRP C C 58 177.432 179.290 -1.858 1
1 651 . 42 1 1 A 58 58 TRP CA C 58 62.731 59.920 2.811 1
1 652 . 42 1 1 A 58 58 TRP CB C 58 29.122 29.195 -0.073 1
1 657 . 42 1 1 A 58 58 TRP N N 58 119.241 120.486 -1.245 1
1 659 . 42 1 1 A 59 59 ASN H H 59 8.098 8.417 -0.319 1
1 660 . 42 1 1 A 59 59 ASN HA H 59 4.424 4.414 0.010 1
1 663 . 42 1 1 A 59 59 ASN C C 59 176.952 178.025 -1.073 1
1 664 . 42 1 1 A 59 59 ASN CA C 59 58.135 56.535 1.600 1
1 665 . 42 1 1 A 59 59 ASN CB C 59 40.168 38.375 1.793 1
1 666 . 42 1 1 A 59 59 ASN N N 59 115.747 117.784 -2.037 1
1 667 . 42 1 1 A 60 60 THR H H 60 8.712 7.822 0.890 1
1 668 . 42 1 1 A 60 60 THR HA H 60 3.717 4.073 -0.356 1
1 673 . 42 1 1 A 60 60 THR C C 60 176.044 176.786 -0.742 1
1 674 . 42 1 1 A 60 60 THR CA C 60 66.576 66.381 0.195 1
1 675 . 42 1 1 A 60 60 THR CB C 60 69.251 68.339 0.912 1
1 677 . 42 1 1 A 60 60 THR N N 60 114.896 117.719 -2.823 1
1 678 . 42 1 1 A 61 61 LEU H H 61 8.485 8.412 0.073 1
1 679 . 42 1 1 A 61 61 LEU HA H 61 3.391 4.069 -0.678 1
1 689 . 42 1 1 A 61 61 LEU C C 61 177.433 178.561 -1.128 1
1 690 . 42 1 1 A 61 61 LEU CA C 61 58.354 58.580 -0.226 1
1 691 . 42 1 1 A 61 61 LEU CB C 61 41.761 42.257 -0.496 1
1 695 . 42 1 1 A 61 61 LEU N N 61 123.433 122.640 0.793 1
1 696 . 42 1 1 A 62 62 VAL H H 62 8.073 8.401 -0.328 1
1 697 . 42 1 1 A 62 62 VAL HA H 62 3.207 3.822 -0.615 1
1 705 . 42 1 1 A 62 62 VAL C C 62 177.585 177.469 0.116 1
1 706 . 42 1 1 A 62 62 VAL CA C 62 67.345 65.121 2.224 1
1 707 . 42 1 1 A 62 62 VAL CB C 62 30.905 30.550 0.355 1
1 710 . 42 1 1 A 62 62 VAL N N 62 116.018 118.536 -2.518 1
1 711 . 42 1 1 A 63 63 ARG H H 63 7.765 7.736 0.029 1
1 712 . 42 1 1 A 63 63 ARG HA H 63 3.602 4.055 -0.453 1
1 719 . 42 1 1 A 63 63 ARG C C 63 177.818 177.522 0.296 1
1 720 . 42 1 1 A 63 63 ARG CA C 63 58.049 59.550 -1.501 1
1 721 . 42 1 1 A 63 63 ARG CB C 63 29.955 29.944 0.011 1
1 724 . 42 1 1 A 63 63 ARG N N 63 116.700 122.425 -5.725 1
1 725 . 42 1 1 A 64 64 ALA H H 64 7.574 8.006 -0.432 1
1 726 . 42 1 1 A 64 64 ALA HA H 64 4.158 4.324 -0.166 1
1 730 . 42 1 1 A 64 64 ALA C C 64 179.886 178.446 1.440 1
1 731 . 42 1 1 A 64 64 ALA CA C 64 54.007 52.719 1.288 1
1 732 . 42 1 1 A 64 64 ALA CB C 64 19.147 19.125 0.022 1
1 733 . 42 1 1 A 64 64 ALA N N 64 117.555 120.768 -3.213 1
1 734 . 42 1 1 A 65 65 VAL H H 65 7.554 7.154 0.400 1
1 735 . 42 1 1 A 65 65 VAL HA H 65 4.253 4.315 -0.062 1
1 743 . 42 1 1 A 65 65 VAL C C 65 174.180 175.193 -1.013 1
1 744 . 42 1 1 A 65 65 VAL CA C 65 62.683 62.905 -0.222 1
1 745 . 42 1 1 A 65 65 VAL CB C 65 33.458 33.306 0.152 1
1 748 . 42 1 1 A 65 65 VAL N N 65 110.013 110.602 -0.589 1
1 749 . 42 1 1 A 66 66 LEU H H 66 7.792 7.941 -0.149 1
1 750 . 42 1 1 A 66 66 LEU HA H 66 4.790 4.710 0.080 1
1 760 . 42 1 1 A 66 66 LEU C C 66 177.537 174.421 3.116 1
1 761 . 42 1 1 A 66 66 LEU CA C 66 52.823 53.386 -0.563 1
1 762 . 42 1 1 A 66 66 LEU CB C 66 44.071 45.700 -1.629 1
1 766 . 42 1 1 A 66 66 LEU N N 66 118.967 122.392 -3.425 1
1 767 . 42 1 1 A 67 67 SER H H 67 9.208 8.404 0.804 1
1 768 . 42 1 1 A 67 67 SER HA H 67 4.414 5.181 -0.767 1
1 771 . 42 1 1 A 67 67 SER CA C 67 57.943 56.950 0.993 1
1 772 . 42 1 1 A 67 67 SER CB C 67 64.743 66.103 -1.360 1
1 773 . 42 1 1 A 67 67 SER N N 67 116.378 115.599 0.779 1
1 774 . 42 1 1 A 69 69 GLY HA2 H 69 3.916 3.804 0.112 1
1 775 . 42 1 1 A 69 69 GLY HA3 H 69 3.867 3.832 0.035 1
1 776 . 42 1 1 A 69 69 GLY C C 69 176.783 175.529 1.254 1
1 777 . 42 1 1 A 69 69 GLY CA C 69 46.977 46.453 0.524 1
1 778 . 42 1 1 A 70 70 ASP H H 70 7.674 8.154 -0.480 1
1 779 . 42 1 1 A 70 70 ASP HA H 70 4.511 3.801 0.710 1
1 782 . 42 1 1 A 70 70 ASP C C 70 178.096 178.391 -0.295 1
1 783 . 42 1 1 A 70 70 ASP CA C 70 57.262 56.569 0.693 1
1 784 . 42 1 1 A 70 70 ASP CB C 70 40.594 39.731 0.863 1
1 785 . 42 1 1 A 70 70 ASP N N 70 123.930 121.856 2.074 1
1 786 . 42 1 1 A 71 71 HIS H H 71 8.729 7.900 0.829 1
1 787 . 42 1 1 A 71 71 HIS HA H 71 4.235 4.181 0.054 1
1 790 . 42 1 1 A 71 71 HIS C C 71 176.769 176.715 0.054 1
1 791 . 42 1 1 A 71 71 HIS CA C 71 60.041 59.979 0.062 1
1 792 . 42 1 1 A 71 71 HIS CB C 71 30.682 30.339 0.343 1
1 793 . 42 1 1 A 71 71 HIS N N 71 121.003 119.619 1.384 1
1 794 . 42 1 1 A 72 72 LEU H H 72 7.620 7.943 -0.323 1
1 795 . 42 1 1 A 72 72 LEU HA H 72 3.769 3.794 -0.025 1
1 805 . 42 1 1 A 72 72 LEU C C 72 180.275 179.199 1.076 1
1 806 . 42 1 1 A 72 72 LEU CA C 72 58.192 57.956 0.236 1
1 807 . 42 1 1 A 72 72 LEU CB C 72 41.381 41.257 0.124 1
1 811 . 42 1 1 A 72 72 LEU N N 72 118.569 118.474 0.095 1
1 812 . 42 1 1 A 73 73 LEU H H 73 7.542 7.582 -0.040 1
1 813 . 42 1 1 A 73 73 LEU HA H 73 4.107 4.160 -0.053 1
1 823 . 42 1 1 A 73 73 LEU C C 73 179.436 179.158 0.278 1
1 824 . 42 1 1 A 73 73 LEU CA C 73 58.026 57.316 0.710 1
1 825 . 42 1 1 A 73 73 LEU CB C 73 41.638 42.087 -0.449 1
1 829 . 42 1 1 A 73 73 LEU N N 73 121.418 120.394 1.024 1
1 830 . 42 1 1 A 74 74 TRP H H 74 8.786 7.963 0.823 1
1 831 . 42 1 1 A 74 74 TRP HA H 74 3.589 5.439 -1.850 1
1 840 . 42 1 1 A 74 74 TRP C C 74 176.816 178.744 -1.928 1
1 841 . 42 1 1 A 74 74 TRP CA C 74 63.046 59.699 3.347 1
1 842 . 42 1 1 A 74 74 TRP CB C 74 28.065 28.876 -0.811 1
1 848 . 42 1 1 A 74 74 TRP N N 74 121.111 118.103 3.008 1
1 850 . 42 1 1 A 75 75 LYS H H 75 8.939 7.491 1.448 1
1 851 . 42 1 1 A 75 75 LYS HA H 75 3.055 4.157 -1.102 1
1 860 . 42 1 1 A 75 75 LYS C C 75 177.967 179.334 -1.367 1
1 861 . 42 1 1 A 75 75 LYS CA C 75 60.029 58.530 1.499 1
1 862 . 42 1 1 A 75 75 LYS CB C 75 32.533 33.091 -0.558 1
1 866 . 42 1 1 A 75 75 LYS N N 75 119.783 118.519 1.264 1
1 867 . 42 1 1 A 76 76 SER H H 76 7.832 8.164 -0.332 1
1 868 . 42 1 1 A 76 76 SER HA H 76 4.040 4.324 -0.284 1
1 871 . 42 1 1 A 76 76 SER C C 76 177.816 176.830 0.986 1
1 872 . 42 1 1 A 76 76 SER CA C 76 62.105 62.012 0.093 1
1 873 . 42 1 1 A 76 76 SER CB C 76 62.679 62.968 -0.289 1
1 874 . 42 1 1 A 76 76 SER N N 76 113.395 117.066 -3.671 1
1 875 . 42 1 1 A 77 77 GLU H H 77 7.590 7.471 0.119 1
1 876 . 42 1 1 A 77 77 GLU HA H 77 4.042 4.329 -0.287 1
1 881 . 42 1 1 A 77 77 GLU C C 77 177.809 178.543 -0.734 1
1 882 . 42 1 1 A 77 77 GLU CA C 77 58.270 58.546 -0.276 1
1 883 . 42 1 1 A 77 77 GLU CB C 77 29.208 29.337 -0.129 1
1 885 . 42 1 1 A 77 77 GLU N N 77 121.574 122.665 -1.091 1
1 886 . 42 1 1 A 78 78 PHE H H 78 9.081 7.845 1.236 1
1 887 . 42 1 1 A 78 78 PHE HA H 78 3.778 4.338 -0.560 1
1 895 . 42 1 1 A 78 78 PHE C C 78 178.114 177.594 0.520 1
1 896 . 42 1 1 A 78 78 PHE CA C 78 60.629 61.255 -0.626 1
1 897 . 42 1 1 A 78 78 PHE CB C 78 38.295 38.917 -0.622 1
1 902 . 42 1 1 A 78 78 PHE N N 78 122.682 122.342 0.340 1
1 903 . 42 1 1 A 79 79 PHE H H 79 8.890 8.024 0.866 1
1 904 . 42 1 1 A 79 79 PHE HA H 79 3.800 3.944 -0.144 1
1 912 . 42 1 1 A 79 79 PHE C C 79 178.354 178.219 0.135 1
1 913 . 42 1 1 A 79 79 PHE CA C 79 60.704 62.456 -1.752 1
1 914 . 42 1 1 A 79 79 PHE CB C 79 37.184 38.773 -1.589 1
1 920 . 42 1 1 A 79 79 PHE N N 79 121.056 117.448 3.608 1
1 921 . 42 1 1 A 80 80 GLU H H 80 7.793 8.102 -0.309 1
1 922 . 42 1 1 A 80 80 GLU HA H 80 4.082 4.011 0.071 1
1 927 . 42 1 1 A 80 80 GLU C C 80 179.068 179.457 -0.389 1
1 928 . 42 1 1 A 80 80 GLU CA C 80 59.735 59.393 0.342 1
1 929 . 42 1 1 A 80 80 GLU CB C 80 28.722 29.282 -0.560 1
1 931 . 42 1 1 A 80 80 GLU N N 80 120.312 119.163 1.149 1
1 932 . 42 1 1 A 81 81 ASN H H 81 8.624 8.585 0.039 1
1 933 . 42 1 1 A 81 81 ASN HA H 81 4.521 4.505 0.016 1
1 938 . 42 1 1 A 81 81 ASN C C 81 179.262 177.657 1.605 1
1 939 . 42 1 1 A 81 81 ASN CA C 81 55.504 56.383 -0.879 1
1 940 . 42 1 1 A 81 81 ASN CB C 81 37.517 37.640 -0.123 1
1 941 . 42 1 1 A 81 81 ASN N N 81 119.338 118.468 0.870 1
1 943 . 42 1 1 A 82 82 CYS H H 82 8.554 8.144 0.410 1
1 944 . 42 1 1 A 82 82 CYS HA H 82 3.792 4.103 -0.311 1
1 947 . 42 1 1 A 82 82 CYS C C 82 176.478 177.163 -0.685 1
1 948 . 42 1 1 A 82 82 CYS CA C 82 65.232 62.049 3.183 1
1 949 . 42 1 1 A 82 82 CYS CB C 82 26.762 26.902 -0.140 1
1 950 . 42 1 1 A 82 82 CYS N N 82 120.576 118.903 1.673 1
1 951 . 42 1 1 A 83 83 ARG H H 83 8.522 7.912 0.610 1
1 952 . 42 1 1 A 83 83 ARG HA H 83 3.932 4.124 -0.192 1
1 960 . 42 1 1 A 83 83 ARG C C 83 179.138 178.754 0.384 1
1 961 . 42 1 1 A 83 83 ARG CA C 83 60.443 59.056 1.387 1
1 962 . 42 1 1 A 83 83 ARG CB C 83 29.550 29.759 -0.209 1
1 965 . 42 1 1 A 83 83 ARG N N 83 123.035 120.391 2.644 1
1 967 . 42 1 1 A 84 84 ASP H H 84 7.791 8.222 -0.431 1
1 968 . 42 1 1 A 84 84 ASP HA H 84 4.353 4.355 -0.002 1
1 971 . 42 1 1 A 84 84 ASP C C 84 178.649 178.929 -0.280 1
1 972 . 42 1 1 A 84 84 ASP CA C 84 57.767 57.583 0.184 1
1 973 . 42 1 1 A 84 84 ASP CB C 84 41.305 41.796 -0.491 1
1 974 . 42 1 1 A 84 84 ASP N N 84 120.332 119.440 0.892 1
1 975 . 42 1 1 A 85 85 THR H H 85 8.370 7.936 0.434 1
1 976 . 42 1 1 A 85 85 THR HA H 85 3.730 3.908 -0.178 1
1 981 . 42 1 1 A 85 85 THR C C 85 175.198 176.390 -1.192 1
1 982 . 42 1 1 A 85 85 THR CA C 85 66.830 66.275 0.555 1
1 983 . 42 1 1 A 85 85 THR CB C 85 68.533 68.331 0.202 1
1 985 . 42 1 1 A 85 85 THR N N 85 117.360 115.474 1.886 1
1 986 . 42 1 1 A 86 86 ALA H H 86 8.845 8.313 0.532 1
1 987 . 42 1 1 A 86 86 ALA HA H 86 3.991 4.102 -0.111 1
1 991 . 42 1 1 A 86 86 ALA C C 86 179.980 179.675 0.305 1
1 992 . 42 1 1 A 86 86 ALA CA C 86 55.769 55.174 0.595 1
1 993 . 42 1 1 A 86 86 ALA CB C 86 17.881 18.219 -0.338 1
1 994 . 42 1 1 A 86 86 ALA N N 86 123.613 123.693 -0.080 1
1 995 . 42 1 1 A 87 87 LYS H H 87 7.686 8.140 -0.454 1
1 996 . 42 1 1 A 87 87 LYS HA H 87 4.099 4.050 0.049 1
1 1005 . 42 1 1 A 87 87 LYS C C 87 179.592 178.509 1.083 1
1 1006 . 42 1 1 A 87 87 LYS CA C 87 59.708 59.138 0.570 1
1 1007 . 42 1 1 A 87 87 LYS CB C 87 32.054 31.847 0.207 1
1 1011 . 42 1 1 A 87 87 LYS N N 87 119.623 116.407 3.216 1
1 1012 . 42 1 1 A 88 88 ARG H H 88 7.683 7.665 0.018 1
1 1013 . 42 1 1 A 88 88 ARG HA H 88 4.051 4.168 -0.117 1
1 1020 . 42 1 1 A 88 88 ARG C C 88 180.053 178.736 1.317 1
1 1021 . 42 1 1 A 88 88 ARG CA C 88 59.558 59.096 0.462 1
1 1022 . 42 1 1 A 88 88 ARG CB C 88 29.684 29.805 -0.121 1
1 1025 . 42 1 1 A 88 88 ARG N N 88 120.788 119.290 1.498 1
1 1026 . 42 1 1 A 89 89 ASN H H 89 8.973 7.906 1.067 1
1 1027 . 42 1 1 A 89 89 ASN HA H 89 4.354 4.675 -0.321 1
1 1032 . 42 1 1 A 89 89 ASN C C 89 178.382 178.795 -0.413 1
1 1033 . 42 1 1 A 89 89 ASN CA C 89 55.334 55.909 -0.575 1
1 1034 . 42 1 1 A 89 89 ASN CB C 89 37.864 37.920 -0.056 1
1 1035 . 42 1 1 A 89 89 ASN N N 89 121.012 117.539 3.473 1
1 1037 . 42 1 1 A 90 90 GLN H H 90 8.152 7.768 0.384 1
1 1038 . 42 1 1 A 90 90 GLN HA H 90 4.020 4.160 -0.140 1
1 1045 . 42 1 1 A 90 90 GLN C C 90 179.075 178.820 0.255 1
1 1046 . 42 1 1 A 90 90 GLN CA C 90 59.318 59.016 0.302 1
1 1047 . 42 1 1 A 90 90 GLN CB C 90 28.049 28.205 -0.156 1
1 1049 . 42 1 1 A 90 90 GLN N N 90 122.122 120.955 1.167 1
1 1051 . 42 1 1 A 91 91 GLN H H 91 7.514 8.492 -0.978 1
1 1052 . 42 1 1 A 91 91 GLN HA H 91 4.053 4.102 -0.049 1
1 1059 . 42 1 1 A 91 91 GLN C C 91 177.081 178.791 -1.710 1
1 1060 . 42 1 1 A 91 91 GLN CA C 91 58.031 58.794 -0.763 1
1 1061 . 42 1 1 A 91 91 GLN CB C 91 28.365 28.467 -0.102 1
1 1063 . 42 1 1 A 91 91 GLN N N 91 118.124 119.087 -0.963 1
1 1065 . 42 1 1 A 92 92 ALA H H 92 7.704 7.433 0.271 1
1 1066 . 42 1 1 A 92 92 ALA HA H 92 4.246 4.345 -0.099 1
1 1070 . 42 1 1 A 92 92 ALA C C 92 178.450 177.798 0.652 1
1 1071 . 42 1 1 A 92 92 ALA CA C 92 52.671 52.146 0.525 1
1 1072 . 42 1 1 A 92 92 ALA CB C 92 19.316 19.445 -0.129 1
1 1073 . 42 1 1 A 92 92 ALA N N 92 119.880 118.660 1.220 1
1 1074 . 42 1 1 A 93 93 GLY H H 93 7.693 7.982 -0.289 1
1 1075 . 42 1 1 A 93 93 GLY HA2 H 93 3.941 3.953 -0.012 1
1 1076 . 42 1 1 A 93 93 GLY HA3 H 93 3.744 3.966 -0.222 1
1 1077 . 42 1 1 A 93 93 GLY C C 93 174.344 174.787 -0.443 1
1 1078 . 42 1 1 A 93 93 GLY CA C 93 45.949 46.711 -0.762 1
1 1079 . 42 1 1 A 93 93 GLY N N 93 105.347 108.159 -2.812 1
1 1080 . 42 1 1 A 94 94 ASN H H 94 7.076 8.630 -1.554 1
1 1081 . 42 1 1 A 94 94 ASN HA H 94 4.115 4.947 -0.832 1
1 1085 . 42 1 1 A 94 94 ASN C C 94 175.410 175.780 -0.370 1
1 1086 . 42 1 1 A 94 94 ASN CA C 94 52.651 52.895 -0.244 1
1 1087 . 42 1 1 A 94 94 ASN CB C 94 38.330 40.420 -2.090 1
1 1088 . 42 1 1 A 94 94 ASN N N 94 115.747 117.470 -1.723 1
1 1090 . 42 1 1 A 95 95 GLY H H 95 8.236 8.196 0.040 1
1 1091 . 42 1 1 A 95 95 GLY HA2 H 95 3.633 3.356 0.277 1
1 1092 . 42 1 1 A 95 95 GLY HA3 H 95 3.633 3.575 0.058 1
1 1093 . 42 1 1 A 95 95 GLY C C 95 174.450 172.868 1.582 1
1 1094 . 42 1 1 A 95 95 GLY CA C 95 45.522 46.336 -0.814 1
1 1095 . 42 1 1 A 95 95 GLY N N 95 109.166 107.984 1.182 1
1 1096 . 42 1 1 A 96 96 TRP H H 96 7.899 7.426 0.473 1
1 1097 . 42 1 1 A 96 96 TRP HA H 96 5.241 5.376 -0.135 1
1 1106 . 42 1 1 A 96 96 TRP C C 96 175.661 174.524 1.137 1
1 1107 . 42 1 1 A 96 96 TRP CA C 96 55.090 55.695 -0.605 1
1 1108 . 42 1 1 A 96 96 TRP CB C 96 27.138 34.456 -7.318 1
1 1114 . 42 1 1 A 96 96 TRP N N 96 122.840 119.006 3.834 1
1 1116 . 42 1 1 A 97 97 ASP H H 97 7.344 9.006 -1.662 1
1 1117 . 42 1 1 A 97 97 ASP HA H 97 4.829 5.308 -0.479 1
1 1120 . 42 1 1 A 97 97 ASP C C 97 175.019 175.899 -0.880 1
1 1121 . 42 1 1 A 97 97 ASP CA C 97 52.149 53.545 -1.396 1
1 1122 . 42 1 1 A 97 97 ASP CB C 97 42.697 44.285 -1.588 1
1 1123 . 42 1 1 A 97 97 ASP N N 97 126.861 120.850 6.011 1
1 1124 . 42 1 1 A 98 98 PHE H H 98 8.566 9.218 -0.652 1
1 1125 . 42 1 1 A 98 98 PHE HA H 98 3.727 4.468 -0.741 1
1 1133 . 42 1 1 A 98 98 PHE C C 98 177.443 176.770 0.673 1
1 1134 . 42 1 1 A 98 98 PHE CA C 98 62.471 59.562 2.909 1
1 1135 . 42 1 1 A 98 98 PHE CB C 98 39.919 38.093 1.826 1
1 1141 . 42 1 1 A 98 98 PHE N N 98 117.781 121.685 -3.904 1
1 1142 . 42 1 1 A 99 99 ASP H H 99 8.259 7.877 0.382 1
1 1143 . 42 1 1 A 99 99 ASP HA H 99 3.960 4.227 -0.267 1
1 1146 . 42 1 1 A 99 99 ASP C C 99 178.132 178.804 -0.672 1
1 1147 . 42 1 1 A 99 99 ASP CA C 99 57.658 56.641 1.017 1
1 1148 . 42 1 1 A 99 99 ASP CB C 99 38.572 40.235 -1.663 1
1 1149 . 42 1 1 A 99 99 ASP N N 99 121.709 122.093 -0.384 1
1 1150 . 42 1 1 A 100 100 MET H H 100 8.008 8.106 -0.098 1
1 1151 . 42 1 1 A 100 100 MET HA H 100 3.644 4.098 -0.454 1
1 1156 . 42 1 1 A 100 100 MET C C 100 180.008 177.252 2.756 1
1 1157 . 42 1 1 A 100 100 MET CA C 100 58.598 58.517 0.081 1
1 1158 . 42 1 1 A 100 100 MET CB C 100 33.423 33.234 0.189 1
1 1160 . 42 1 1 A 100 100 MET N N 100 119.668 118.945 0.723 1
1 1161 . 42 1 1 A 101 101 LEU H H 101 7.961 8.599 -0.638 1
1 1162 . 42 1 1 A 101 101 LEU HA H 101 3.523 4.481 -0.958 1
1 1172 . 42 1 1 A 101 101 LEU C C 101 173.873 176.060 -2.187 1
1 1173 . 42 1 1 A 101 101 LEU CA C 101 58.743 54.230 4.513 1
1 1174 . 42 1 1 A 101 101 LEU CB C 101 42.632 42.333 0.299 1
1 1178 . 42 1 1 A 101 101 LEU N N 101 119.752 118.753 0.999 1
1 1179 . 42 1 1 A 102 102 THR H H 102 6.955 8.505 -1.550 1
1 1180 . 42 1 1 A 102 102 THR HA H 102 4.134 4.452 -0.318 1
1 1185 . 42 1 1 A 102 102 THR C C 102 176.513 174.186 2.327 1
1 1186 . 42 1 1 A 102 102 THR CA C 102 61.125 62.199 -1.074 1
1 1187 . 42 1 1 A 102 102 THR CB C 102 71.415 69.647 1.768 1
1 1189 . 42 1 1 A 102 102 THR N N 102 124.665 120.496 4.169 1
1 1190 . 42 1 1 A 103 103 GLY H H 103 7.816 8.894 -1.078 1
1 1191 . 42 1 1 A 103 103 GLY HA2 H 103 3.824 3.932 -0.108 1
1 1192 . 42 1 1 A 103 103 GLY HA3 H 103 3.824 4.026 -0.202 1
1 1193 . 42 1 1 A 103 103 GLY C C 103 174.126 174.165 -0.039 1
1 1194 . 42 1 1 A 103 103 GLY CA C 103 47.805 47.575 0.230 1
1 1195 . 42 1 1 A 103 103 GLY N N 103 114.191 113.389 0.802 1
1 1196 . 42 1 1 A 104 104 SER H H 104 8.860 8.319 0.541 1
1 1197 . 42 1 1 A 104 104 SER HA H 104 4.758 4.641 0.117 1
1 1200 . 42 1 1 A 104 104 SER C C 104 174.591 174.035 0.556 1
1 1201 . 42 1 1 A 104 104 SER CA C 104 56.755 59.428 -2.673 1
1 1202 . 42 1 1 A 104 104 SER CB C 104 65.050 64.867 0.183 1
1 1203 . 42 1 1 A 104 104 SER N N 104 114.771 118.610 -3.839 1
1 1204 . 42 1 1 A 105 105 GLY H H 105 8.788 7.850 0.938 1
1 1205 . 42 1 1 A 105 105 GLY HA2 H 105 3.733 3.887 -0.154 1
1 1206 . 42 1 1 A 105 105 GLY HA3 H 105 3.733 3.981 -0.248 1
1 1207 . 42 1 1 A 105 105 GLY CA C 105 47.247 45.088 2.159 1
1 1208 . 42 1 1 A 105 105 GLY N N 105 110.394 107.707 2.687 1
1 1209 . 42 1 1 A 106 106 ASN HA H 106 4.454 4.874 -0.420 1
1 1212 . 42 1 1 A 106 106 ASN C C 106 175.180 176.276 -1.096 1
1 1213 . 42 1 1 A 106 106 ASN CA C 106 54.492 54.062 0.430 1
1 1214 . 42 1 1 A 106 106 ASN CB C 106 37.282 41.386 -4.104 1
1 1215 . 42 1 1 A 107 107 TYR H H 107 8.241 7.127 1.114 1
1 1216 . 42 1 1 A 107 107 TYR HA H 107 4.335 4.772 -0.437 1
1 1223 . 42 1 1 A 107 107 TYR C C 107 173.954 175.848 -1.894 1
1 1224 . 42 1 1 A 107 107 TYR CA C 107 57.727 57.370 0.357 1
1 1225 . 42 1 1 A 107 107 TYR CB C 107 37.063 39.361 -2.298 1
1 1230 . 42 1 1 A 107 107 TYR N N 107 120.708 115.233 5.475 1
1 1231 . 42 1 1 A 108 108 SER H H 108 7.117 7.772 -0.655 1
1 1232 . 42 1 1 A 108 108 SER HA H 108 4.221 4.497 -0.276 1
1 1235 . 42 1 1 A 108 108 SER C C 108 174.834 174.880 -0.046 1
1 1236 . 42 1 1 A 108 108 SER CA C 108 59.859 58.980 0.879 1
1 1237 . 42 1 1 A 108 108 SER CB C 108 63.846 64.393 -0.547 1
1 1238 . 42 1 1 A 108 108 SER N N 108 113.362 114.716 -1.354 1
1 1239 . 42 1 1 A 109 109 SER H H 109 8.053 7.701 0.352 1
1 1240 . 42 1 1 A 109 109 SER HA H 109 4.560 4.166 0.394 1
1 1243 . 42 1 1 A 109 109 SER CA C 109 57.141 60.732 -3.591 1
1 1244 . 42 1 1 A 109 109 SER CB C 109 64.874 61.800 3.074 1
1 1245 . 42 1 1 A 109 109 SER N N 109 116.657 115.714 0.943 1
1 1246 . 42 1 1 A 110 110 THR HA H 110 3.541 3.952 -0.411 1
1 1251 . 42 1 1 A 110 110 THR C C 110 175.477 176.070 -0.593 1
1 1252 . 42 1 1 A 110 110 THR CA C 110 66.443 65.459 0.984 1
1 1253 . 42 1 1 A 110 110 THR CB C 110 68.091 68.422 -0.331 1
1 1255 . 42 1 1 A 111 111 ASP H H 111 8.224 8.095 0.129 1
1 1256 . 42 1 1 A 111 111 ASP HA H 111 4.237 4.265 -0.028 1
1 1259 . 42 1 1 A 111 111 ASP C C 111 177.520 178.395 -0.875 1
1 1260 . 42 1 1 A 111 111 ASP CA C 111 57.559 57.047 0.512 1
1 1261 . 42 1 1 A 111 111 ASP CB C 111 40.292 40.529 -0.237 1
1 1262 . 42 1 1 A 111 111 ASP N N 111 119.490 119.805 -0.315 1
1 1263 . 42 1 1 A 112 112 ALA H H 112 7.431 7.585 -0.154 1
1 1264 . 42 1 1 A 112 112 ALA HA H 112 4.191 3.995 0.196 1
1 1268 . 42 1 1 A 112 112 ALA C C 112 180.646 179.591 1.055 1
1 1269 . 42 1 1 A 112 112 ALA CA C 112 54.534 54.959 -0.425 1
1 1270 . 42 1 1 A 112 112 ALA CB C 112 18.992 18.157 0.835 1
1 1271 . 42 1 1 A 112 112 ALA N N 112 119.710 121.922 -2.212 1
1 1272 . 42 1 1 A 113 113 GLN H H 113 7.576 7.880 -0.304 1
1 1273 . 42 1 1 A 113 113 GLN HA H 113 3.562 3.934 -0.372 1
1 1278 . 42 1 1 A 113 113 GLN C C 113 176.756 177.488 -0.732 1
1 1279 . 42 1 1 A 113 113 GLN CA C 113 57.736 58.423 -0.687 1
1 1280 . 42 1 1 A 113 113 GLN CB C 113 29.110 28.506 0.604 1
1 1281 . 42 1 1 A 113 113 GLN N N 113 117.518 118.235 -0.717 1
1 1283 . 42 1 1 A 114 114 MET H H 114 8.192 8.411 -0.219 1
1 1284 . 42 1 1 A 114 114 MET HA H 114 4.231 3.621 0.610 1
1 1289 . 42 1 1 A 114 114 MET C C 114 175.648 177.551 -1.903 1
1 1290 . 42 1 1 A 114 114 MET CA C 114 57.446 57.594 -0.148 1
1 1291 . 42 1 1 A 114 114 MET CB C 114 33.570 32.259 1.311 1
1 1293 . 42 1 1 A 114 114 MET N N 114 111.509 118.649 -7.140 1
1 1294 . 42 1 1 A 115 115 GLN H H 115 6.940 7.146 -0.206 1
1 1295 . 42 1 1 A 115 115 GLN HA H 115 4.307 4.327 -0.020 1
1 1302 . 42 1 1 A 115 115 GLN C C 115 176.270 174.662 1.608 1
1 1303 . 42 1 1 A 115 115 GLN CA C 115 54.680 55.509 -0.829 1
1 1304 . 42 1 1 A 115 115 GLN CB C 115 28.233 28.872 -0.639 1
1 1306 . 42 1 1 A 115 115 GLN N N 115 114.300 116.262 -1.962 1
1 1308 . 42 1 1 A 116 116 TYR H H 116 6.677 8.067 -1.390 1
1 1309 . 42 1 1 A 116 116 TYR HA H 116 4.193 4.390 -0.197 1
1 1312 . 42 1 1 A 116 116 TYR C C 116 175.268 174.010 1.258 1
1 1313 . 42 1 1 A 116 116 TYR CA C 116 54.357 58.280 -3.923 1
1 1314 . 42 1 1 A 116 116 TYR CB C 116 35.498 36.769 -1.271 1
1 1315 . 42 1 1 A 116 116 TYR N N 116 117.919 116.583 1.336 1
1 1316 . 42 1 1 A 117 117 ASP H H 117 8.081 8.359 -0.278 1
1 1317 . 42 1 1 A 117 117 ASP HA H 117 4.665 5.219 -0.554 1
1 1320 . 42 1 1 A 117 117 ASP CA C 117 52.422 50.679 1.743 1
1 1321 . 42 1 1 A 117 117 ASP CB C 117 42.416 43.054 -0.638 1
1 1322 . 42 1 1 A 117 117 ASP N N 117 120.887 125.156 -4.269 1
1 1323 . 42 1 1 A 118 118 PRO C C 118 179.180 178.273 0.907 1
1 1324 . 42 1 1 A 118 118 PRO CA C 118 65.942 65.204 0.738 1
1 1325 . 42 1 1 A 118 118 PRO CB C 118 32.197 32.016 0.181 1
1 1326 . 42 1 1 A 119 119 GLY H H 119 9.742 8.621 1.121 1
1 1327 . 42 1 1 A 119 119 GLY C C 119 175.622 175.074 0.548 1
1 1328 . 42 1 1 A 119 119 GLY CA C 119 46.785 46.047 0.738 1
1 1329 . 42 1 1 A 119 119 GLY N N 119 106.412 106.023 0.389 1
1 1330 . 42 1 1 A 120 120 LEU H H 120 6.666 7.882 -1.216 1
1 1331 . 42 1 1 A 120 120 LEU HA H 120 3.365 3.683 -0.318 1
1 1341 . 42 1 1 A 120 120 LEU C C 120 179.262 178.475 0.787 1
1 1342 . 42 1 1 A 120 120 LEU CA C 120 56.605 57.101 -0.496 1
1 1343 . 42 1 1 A 120 120 LEU CB C 120 39.262 41.747 -2.485 1
1 1347 . 42 1 1 A 120 120 LEU N N 120 126.226 123.250 2.976 1
1 1348 . 42 1 1 A 121 121 PHE H H 121 7.356 8.582 -1.226 1
1 1349 . 42 1 1 A 121 121 PHE HA H 121 4.459 4.038 0.421 1
1 1352 . 42 1 1 A 121 121 PHE C C 121 179.716 177.036 2.680 1
1 1353 . 42 1 1 A 121 121 PHE CA C 121 62.838 62.237 0.601 1
1 1354 . 42 1 1 A 121 121 PHE CB C 121 37.603 39.396 -1.793 1
1 1355 . 42 1 1 A 121 121 PHE N N 121 117.437 119.647 -2.210 1
1 1356 . 42 1 1 A 122 122 ALA H H 122 7.926 7.977 -0.051 1
1 1357 . 42 1 1 A 122 122 ALA HA H 122 4.523 3.807 0.716 1
1 1361 . 42 1 1 A 122 122 ALA C C 122 180.435 179.751 0.684 1
1 1362 . 42 1 1 A 122 122 ALA CA C 122 55.527 55.244 0.283 1
1 1363 . 42 1 1 A 122 122 ALA CB C 122 17.814 17.915 -0.101 1
1 1364 . 42 1 1 A 122 122 ALA N N 122 121.068 121.372 -0.304 1
1 1365 . 42 1 1 A 123 123 GLN H H 123 7.507 7.776 -0.269 1
1 1366 . 42 1 1 A 123 123 GLN HA H 123 4.153 3.957 0.196 1
1 1371 . 42 1 1 A 123 123 GLN C C 123 180.561 178.959 1.602 1
1 1372 . 42 1 1 A 123 123 GLN CA C 123 59.948 58.658 1.290 1
1 1373 . 42 1 1 A 123 123 GLN CB C 123 29.135 28.263 0.872 1
1 1375 . 42 1 1 A 123 123 GLN N N 123 120.324 116.401 3.923 1
1 1376 . 42 1 1 A 124 124 ILE H H 124 8.318 7.894 0.424 1
1 1377 . 42 1 1 A 124 124 ILE HA H 124 3.635 3.842 -0.207 1
1 1387 . 42 1 1 A 124 124 ILE C C 124 176.481 177.797 -1.316 1
1 1388 . 42 1 1 A 124 124 ILE CA C 124 66.432 64.397 2.035 1
1 1389 . 42 1 1 A 124 124 ILE CB C 124 39.168 37.669 1.499 1
1 1393 . 42 1 1 A 124 124 ILE N N 124 123.747 118.061 5.686 1
1 1394 . 42 1 1 A 125 125 GLN H H 125 8.474 7.889 0.585 1
1 1395 . 42 1 1 A 125 125 GLN HA H 125 4.264 3.929 0.335 1
1 1402 . 42 1 1 A 125 125 GLN C C 125 178.947 177.840 1.107 1
1 1403 . 42 1 1 A 125 125 GLN CA C 125 59.651 58.360 1.291 1
1 1404 . 42 1 1 A 125 125 GLN CB C 125 28.880 27.729 1.151 1
1 1406 . 42 1 1 A 125 125 GLN N N 125 120.368 121.453 -1.085 1
1 1408 . 42 1 1 A 126 126 ALA H H 126 8.002 7.413 0.589 1
1 1409 . 42 1 1 A 126 126 ALA HA H 126 4.144 3.989 0.155 1
1 1413 . 42 1 1 A 126 126 ALA C C 126 179.316 179.369 -0.053 1
1 1414 . 42 1 1 A 126 126 ALA CA C 126 55.036 54.880 0.156 1
1 1415 . 42 1 1 A 126 126 ALA CB C 126 18.087 18.298 -0.211 1
1 1416 . 42 1 1 A 126 126 ALA N N 126 121.661 122.662 -1.001 1
1 1417 . 42 1 1 A 127 127 ALA H H 127 7.823 7.991 -0.168 1
1 1418 . 42 1 1 A 127 127 ALA HA H 127 4.162 3.957 0.205 1
1 1422 . 42 1 1 A 127 127 ALA C C 127 180.707 179.451 1.256 1
1 1423 . 42 1 1 A 127 127 ALA CA C 127 55.080 54.856 0.224 1
1 1424 . 42 1 1 A 127 127 ALA CB C 127 19.354 18.242 1.112 1
1 1425 . 42 1 1 A 127 127 ALA N N 127 119.853 119.934 -0.081 1
1 1426 . 42 1 1 A 128 128 ALA H H 128 8.936 7.793 1.143 1
1 1427 . 42 1 1 A 128 128 ALA HA H 128 3.928 3.896 0.032 1
1 1431 . 42 1 1 A 128 128 ALA C C 128 181.031 179.445 1.586 1
1 1432 . 42 1 1 A 128 128 ALA CA C 128 55.502 54.681 0.821 1
1 1433 . 42 1 1 A 128 128 ALA CB C 128 16.609 17.709 -1.100 1
1 1434 . 42 1 1 A 128 128 ALA N N 128 121.355 120.478 0.877 1
1 1435 . 42 1 1 A 129 129 THR H H 129 8.543 7.613 0.930 1
1 1436 . 42 1 1 A 129 129 THR HA H 129 4.015 3.559 0.456 1
1 1441 . 42 1 1 A 129 129 THR C C 129 177.332 176.355 0.977 1
1 1442 . 42 1 1 A 129 129 THR CA C 129 65.893 64.991 0.902 1
1 1443 . 42 1 1 A 129 129 THR CB C 129 68.566 68.445 0.121 1
1 1445 . 42 1 1 A 129 129 THR N N 129 112.709 112.133 0.576 1
1 1446 . 42 1 1 A 130 130 LYS H H 130 8.126 7.429 0.697 1
1 1447 . 42 1 1 A 130 130 LYS HA H 130 4.000 3.964 0.036 1
1 1456 . 42 1 1 A 130 130 LYS C C 130 179.082 178.709 0.373 1
1 1457 . 42 1 1 A 130 130 LYS CA C 130 60.299 58.839 1.460 1
1 1458 . 42 1 1 A 130 130 LYS CB C 130 32.767 32.138 0.629 1
1 1462 . 42 1 1 A 130 130 LYS N N 130 123.879 120.292 3.587 1
1 1463 . 42 1 1 A 131 131 ALA H H 131 7.184 7.690 -0.506 1
1 1464 . 42 1 1 A 131 131 ALA HA H 131 4.005 4.186 -0.181 1
1 1468 . 42 1 1 A 131 131 ALA C C 131 178.482 179.568 -1.086 1
1 1469 . 42 1 1 A 131 131 ALA CA C 131 55.027 55.172 -0.145 1
1 1470 . 42 1 1 A 131 131 ALA CB C 131 18.669 19.231 -0.562 1
1 1471 . 42 1 1 A 131 131 ALA N N 131 118.590 121.103 -2.513 1
1 1472 . 42 1 1 A 132 132 TRP H H 132 7.977 8.502 -0.525 1
1 1473 . 42 1 1 A 132 132 TRP HA H 132 4.001 4.283 -0.282 1
1 1480 . 42 1 1 A 132 132 TRP C C 132 177.332 175.705 1.627 1
1 1481 . 42 1 1 A 132 132 TRP CA C 132 60.431 57.383 3.048 1
1 1482 . 42 1 1 A 132 132 TRP CB C 132 27.786 27.678 0.108 1
1 1486 . 42 1 1 A 132 132 TRP N N 132 119.168 117.060 2.108 1
1 1488 . 42 1 1 A 133 133 ARG H H 133 8.006 7.915 0.091 1
1 1489 . 42 1 1 A 133 133 ARG HA H 133 4.027 4.332 -0.305 1
1 1497 . 42 1 1 A 133 133 ARG C C 133 176.664 178.766 -2.102 1
1 1498 . 42 1 1 A 133 133 ARG CA C 133 59.355 57.478 1.877 1
1 1499 . 42 1 1 A 133 133 ARG CB C 133 30.451 32.051 -1.600 1
1 1502 . 42 1 1 A 133 133 ARG N N 133 113.062 121.010 -7.948 1
1 1504 . 42 1 1 A 134 134 LYS H H 134 7.322 7.524 -0.202 1
1 1505 . 42 1 1 A 134 134 LYS HA H 134 4.313 4.182 0.131 1
1 1514 . 42 1 1 A 134 134 LYS C C 134 176.282 176.781 -0.499 1
1 1515 . 42 1 1 A 134 134 LYS CA C 134 54.922 59.040 -4.118 1
1 1516 . 42 1 1 A 134 134 LYS CB C 134 32.633 32.313 0.320 1
1 1520 . 42 1 1 A 134 134 LYS N N 134 118.170 118.893 -0.723 1
1 1521 . 42 1 1 A 135 135 LEU H H 135 7.440 7.547 -0.107 1
1 1522 . 42 1 1 A 135 135 LEU HA H 135 4.174 4.560 -0.386 1
1 1532 . 42 1 1 A 135 135 LEU CA C 135 54.408 53.357 1.051 1
1 1533 . 42 1 1 A 135 135 LEU CB C 135 40.407 41.793 -1.386 1
1 1537 . 42 1 1 A 135 135 LEU N N 135 123.358 118.128 5.230 1
1 1538 . 42 1 1 A 136 136 PRO HA H 136 4.437 4.505 -0.068 1
1 1545 . 42 1 1 A 136 136 PRO C C 136 177.106 177.620 -0.514 1
1 1546 . 42 1 1 A 136 136 PRO CA C 136 62.889 62.469 0.420 1
1 1547 . 42 1 1 A 136 136 PRO CB C 136 32.192 33.279 -1.087 1
1 1550 . 42 1 1 A 137 137 VAL H H 137 8.219 8.463 -0.244 1
1 1551 . 42 1 1 A 137 137 VAL HA H 137 4.077 4.047 0.030 1
1 1559 . 42 1 1 A 137 137 VAL C C 137 176.305 175.478 0.827 1
1 1560 . 42 1 1 A 137 137 VAL CA C 137 61.958 64.846 -2.888 1
1 1561 . 42 1 1 A 137 137 VAL CB C 137 32.755 31.179 1.576 1
1 1564 . 42 1 1 A 137 137 VAL N N 137 120.079 119.261 0.818 1
1 1565 . 42 1 1 A 138 138 LYS H H 138 8.444 7.809 0.635 1
1 1566 . 42 1 1 A 138 138 LYS HA H 138 4.316 4.528 -0.212 1
1 1575 . 42 1 1 A 138 138 LYS C C 138 176.790 176.233 0.557 1
1 1576 . 42 1 1 A 138 138 LYS CA C 138 56.792 55.423 1.369 1
1 1577 . 42 1 1 A 138 138 LYS CB C 138 33.205 35.040 -1.835 1
1 1581 . 42 1 1 A 138 138 LYS N N 138 126.449 119.334 7.115 1
1 1582 . 42 1 1 A 139 139 GLY H H 139 8.518 8.948 -0.430 1
1 1583 . 42 1 1 A 139 139 GLY HA2 H 139 4.070 3.884 0.186 1
1 1584 . 42 1 1 A 139 139 GLY HA3 H 139 3.897 3.885 0.012 1
1 1585 . 42 1 1 A 139 139 GLY C C 139 172.874 173.111 -0.237 1
1 1586 . 42 1 1 A 139 139 GLY CA C 139 45.157 47.210 -2.053 1
1 1587 . 42 1 1 A 139 139 GLY N N 139 112.617 114.360 -1.743 1
1 6 . 43 1 1 A 2 2 VAL H H 2 8.992 8.981 0.011 1
1 7 . 43 1 1 A 2 2 VAL HA H 2 5.370 4.836 0.534 1
1 15 . 43 1 1 A 2 2 VAL C C 2 174.325 174.667 -0.342 1
1 16 . 43 1 1 A 2 2 VAL CA C 2 61.267 60.837 0.430 1
1 17 . 43 1 1 A 2 2 VAL CB C 2 33.890 34.241 -0.351 1
1 20 . 43 1 1 A 2 2 VAL N N 2 126.939 119.732 7.207 1
1 21 . 43 1 1 A 3 3 THR H H 3 8.912 8.950 -0.038 1
1 22 . 43 1 1 A 3 3 THR HA H 3 4.505 5.030 -0.525 1
1 27 . 43 1 1 A 3 3 THR C C 3 172.710 173.045 -0.335 1
1 28 . 43 1 1 A 3 3 THR CA C 3 59.689 59.759 -0.070 1
1 29 . 43 1 1 A 3 3 THR CB C 3 72.398 71.826 0.572 1
1 31 . 43 1 1 A 3 3 THR N N 3 118.091 122.488 -4.397 1
1 32 . 43 1 1 A 4 4 GLU H H 4 8.631 8.690 -0.059 1
1 33 . 43 1 1 A 4 4 GLU HA H 4 5.788 5.138 0.650 1
1 38 . 43 1 1 A 4 4 GLU C C 4 175.758 176.291 -0.533 1
1 39 . 43 1 1 A 4 4 GLU CA C 4 54.902 55.322 -0.420 1
1 40 . 43 1 1 A 4 4 GLU CB C 4 35.097 31.385 3.712 1
1 42 . 43 1 1 A 4 4 GLU N N 4 120.966 125.460 -4.494 1
1 43 . 43 1 1 A 5 5 THR H H 5 9.188 8.561 0.627 1
1 44 . 43 1 1 A 5 5 THR HA H 5 4.739 5.053 -0.314 1
1 49 . 43 1 1 A 5 5 THR C C 5 172.757 174.295 -1.538 1
1 50 . 43 1 1 A 5 5 THR CA C 5 60.382 60.095 0.287 1
1 51 . 43 1 1 A 5 5 THR CB C 5 71.558 71.451 0.107 1
1 53 . 43 1 1 A 5 5 THR N N 5 119.366 114.025 5.341 1
1 54 . 43 1 1 A 6 6 VAL H H 6 8.476 8.587 -0.111 1
1 55 . 43 1 1 A 6 6 VAL HA H 6 5.026 5.364 -0.338 1
1 63 . 43 1 1 A 6 6 VAL C C 6 176.674 173.635 3.039 1
1 64 . 43 1 1 A 6 6 VAL CA C 6 61.008 59.748 1.260 1
1 65 . 43 1 1 A 6 6 VAL CB C 6 33.861 35.486 -1.625 1
1 68 . 43 1 1 A 6 6 VAL N N 6 121.384 114.732 6.652 1
1 69 . 43 1 1 A 7 7 ASP H H 7 8.848 8.801 0.047 1
1 70 . 43 1 1 A 7 7 ASP HA H 7 4.797 4.701 0.096 1
1 73 . 43 1 1 A 7 7 ASP CA C 7 52.834 54.167 -1.333 1
1 74 . 43 1 1 A 7 7 ASP CB C 7 42.219 42.237 -0.018 1
1 75 . 43 1 1 A 7 7 ASP N N 7 127.061 126.310 0.751 1
1 76 . 43 1 1 A 8 8 GLY C C 8 175.143 174.178 0.965 1
1 77 . 43 1 1 A 8 8 GLY CA C 8 46.553 47.280 -0.727 1
1 78 . 43 1 1 A 9 9 GLN H H 9 8.408 8.659 -0.251 1
1 79 . 43 1 1 A 9 9 GLN HA H 9 4.541 4.435 0.106 1
1 86 . 43 1 1 A 9 9 GLN C C 9 176.463 175.751 0.712 1
1 87 . 43 1 1 A 9 9 GLN CA C 9 55.167 55.806 -0.639 1
1 88 . 43 1 1 A 9 9 GLN CB C 9 29.376 29.044 0.332 1
1 90 . 43 1 1 A 9 9 GLN N N 9 118.300 118.242 0.058 1
1 92 . 43 1 1 A 10 10 GLY H H 10 8.162 7.699 0.463 1
1 93 . 43 1 1 A 10 10 GLY HA2 H 10 4.174 4.154 0.020 1
1 94 . 43 1 1 A 10 10 GLY HA3 H 10 3.521 4.161 -0.640 1
1 95 . 43 1 1 A 10 10 GLY C C 10 174.092 174.419 -0.327 1
1 96 . 43 1 1 A 10 10 GLY CA C 10 45.558 45.724 -0.166 1
1 97 . 43 1 1 A 10 10 GLY N N 10 108.747 105.997 2.750 1
1 98 . 43 1 1 A 11 11 GLN H H 11 8.507 7.742 0.765 1
1 99 . 43 1 1 A 11 11 GLN HA H 11 4.202 4.600 -0.398 1
1 106 . 43 1 1 A 11 11 GLN C C 11 173.992 174.809 -0.817 1
1 107 . 43 1 1 A 11 11 GLN CA C 11 55.098 55.200 -0.102 1
1 108 . 43 1 1 A 11 11 GLN CB C 11 29.097 30.211 -1.114 1
1 110 . 43 1 1 A 11 11 GLN N N 11 122.979 119.180 3.799 1
1 112 . 43 1 1 A 12 12 ALA H H 12 8.259 8.939 -0.680 1
1 113 . 43 1 1 A 12 12 ALA HA H 12 5.156 5.773 -0.617 1
1 117 . 43 1 1 A 12 12 ALA C C 12 177.284 177.227 0.057 1
1 118 . 43 1 1 A 12 12 ALA CA C 12 51.087 50.434 0.653 1
1 119 . 43 1 1 A 12 12 ALA CB C 12 20.500 20.449 0.051 1
1 120 . 43 1 1 A 12 12 ALA N N 12 127.100 125.475 1.625 1
1 121 . 43 1 1 A 13 13 TRP H H 13 9.245 9.385 -0.140 1
1 122 . 43 1 1 A 13 13 TRP HA H 13 4.717 5.049 -0.332 1
1 131 . 43 1 1 A 13 13 TRP C C 13 175.108 175.865 -0.757 1
1 132 . 43 1 1 A 13 13 TRP CA C 13 55.966 57.178 -1.212 1
1 133 . 43 1 1 A 13 13 TRP CB C 13 31.912 30.626 1.286 1
1 139 . 43 1 1 A 13 13 TRP N N 13 123.088 124.382 -1.294 1
1 141 . 43 1 1 A 14 14 ARG H H 14 8.575 9.001 -0.426 1
1 142 . 43 1 1 A 14 14 ARG HA H 14 5.335 4.976 0.359 1
1 150 . 43 1 1 A 14 14 ARG C C 14 175.191 174.412 0.779 1
1 151 . 43 1 1 A 14 14 ARG CA C 14 53.106 55.102 -1.996 1
1 152 . 43 1 1 A 14 14 ARG CB C 14 32.749 33.914 -1.165 1
1 154 . 43 1 1 A 14 14 ARG N N 14 121.163 121.318 -0.155 1
1 156 . 43 1 1 A 15 15 HIS H H 15 8.595 9.520 -0.925 1
1 157 . 43 1 1 A 15 15 HIS HA H 15 4.790 5.330 -0.540 1
1 161 . 43 1 1 A 15 15 HIS C C 15 173.770 174.252 -0.482 1
1 162 . 43 1 1 A 15 15 HIS CA C 15 55.289 53.371 1.918 1
1 163 . 43 1 1 A 15 15 HIS CB C 15 33.208 32.956 0.252 1
1 165 . 43 1 1 A 15 15 HIS N N 15 117.643 124.258 -6.615 1
1 166 . 43 1 1 A 16 16 HIS H H 16 8.993 9.021 -0.028 1
1 167 . 43 1 1 A 16 16 HIS HA H 16 5.158 4.976 0.182 1
1 171 . 43 1 1 A 16 16 HIS C C 16 173.608 175.154 -1.546 1
1 172 . 43 1 1 A 16 16 HIS CA C 16 56.450 55.522 0.928 1
1 173 . 43 1 1 A 16 16 HIS CB C 16 34.171 31.093 3.078 1
1 175 . 43 1 1 A 16 16 HIS N N 16 123.520 121.366 2.154 1
1 176 . 43 1 1 A 17 17 ASN H H 17 7.829 8.703 -0.874 1
1 177 . 43 1 1 A 17 17 ASN HA H 17 4.713 5.483 -0.770 1
1 182 . 43 1 1 A 17 17 ASN C C 17 173.682 175.556 -1.874 1
1 183 . 43 1 1 A 17 17 ASN CA C 17 51.822 51.767 0.055 1
1 184 . 43 1 1 A 17 17 ASN CB C 17 43.176 41.379 1.797 1
1 185 . 43 1 1 A 17 17 ASN N N 17 122.213 121.058 1.155 1
1 187 . 43 1 1 A 18 18 GLY H H 18 8.423 8.438 -0.015 1
1 188 . 43 1 1 A 18 18 GLY HA2 H 18 3.931 3.724 0.207 1
1 189 . 43 1 1 A 18 18 GLY HA3 H 18 3.707 3.777 -0.070 1
1 190 . 43 1 1 A 18 18 GLY C C 18 173.985 173.315 0.670 1
1 191 . 43 1 1 A 18 18 GLY CA C 18 43.949 43.997 -0.048 1
1 192 . 43 1 1 A 18 18 GLY N N 18 106.991 109.212 -2.221 1
1 193 . 43 1 1 A 19 19 PHE H H 19 8.338 7.979 0.359 1
1 194 . 43 1 1 A 19 19 PHE HA H 19 4.068 4.948 -0.880 1
1 197 . 43 1 1 A 19 19 PHE C C 19 176.568 174.692 1.876 1
1 198 . 43 1 1 A 19 19 PHE CA C 19 59.338 57.876 1.462 1
1 199 . 43 1 1 A 19 19 PHE CB C 19 40.201 39.845 0.356 1
1 200 . 43 1 1 A 19 19 PHE N N 19 116.857 120.441 -3.584 1
1 201 . 43 1 1 A 20 20 ASP H H 20 8.794 8.695 0.099 1
1 202 . 43 1 1 A 20 20 ASP HA H 20 4.485 4.898 -0.413 1
1 205 . 43 1 1 A 20 20 ASP C C 20 177.379 176.917 0.462 1
1 206 . 43 1 1 A 20 20 ASP CA C 20 54.140 54.101 0.039 1
1 207 . 43 1 1 A 20 20 ASP CB C 20 41.915 42.003 -0.088 1
1 208 . 43 1 1 A 20 20 ASP N N 20 123.025 124.975 -1.950 1
1 209 . 43 1 1 A 21 21 PHE H H 21 8.862 9.151 -0.289 1
1 210 . 43 1 1 A 21 21 PHE HA H 21 4.087 4.093 -0.006 1
1 218 . 43 1 1 A 21 21 PHE C C 21 176.952 177.238 -0.286 1
1 219 . 43 1 1 A 21 21 PHE CA C 21 61.095 62.457 -1.362 1
1 220 . 43 1 1 A 21 21 PHE CB C 21 38.678 39.465 -0.787 1
1 226 . 43 1 1 A 21 21 PHE N N 21 127.163 127.479 -0.316 1
1 227 . 43 1 1 A 22 22 ALA H H 22 8.561 8.398 0.163 1
1 228 . 43 1 1 A 22 22 ALA HA H 22 3.878 3.995 -0.117 1
1 232 . 43 1 1 A 22 22 ALA C C 22 180.710 180.143 0.567 1
1 233 . 43 1 1 A 22 22 ALA CA C 22 55.211 55.173 0.038 1
1 234 . 43 1 1 A 22 22 ALA CB C 22 18.321 18.171 0.150 1
1 235 . 43 1 1 A 22 22 ALA N N 22 120.293 121.405 -1.112 1
1 236 . 43 1 1 A 23 23 VAL H H 23 7.241 7.820 -0.579 1
1 237 . 43 1 1 A 23 23 VAL HA H 23 3.684 3.559 0.125 1
1 245 . 43 1 1 A 23 23 VAL C C 23 177.101 178.057 -0.956 1
1 246 . 43 1 1 A 23 23 VAL CA C 23 65.237 66.960 -1.723 1
1 247 . 43 1 1 A 23 23 VAL CB C 23 31.780 31.679 0.101 1
1 250 . 43 1 1 A 23 23 VAL N N 23 118.775 117.954 0.821 1
1 251 . 43 1 1 A 24 24 ILE H H 24 6.761 8.178 -1.417 1
1 252 . 43 1 1 A 24 24 ILE HA H 24 3.196 3.536 -0.340 1
1 262 . 43 1 1 A 24 24 ILE C C 24 177.287 177.887 -0.600 1
1 263 . 43 1 1 A 24 24 ILE CA C 24 63.404 65.587 -2.183 1
1 264 . 43 1 1 A 24 24 ILE CB C 24 36.294 37.898 -1.604 1
1 268 . 43 1 1 A 24 24 ILE N N 24 119.036 119.692 -0.656 1
1 269 . 43 1 1 A 25 25 LYS H H 25 8.032 8.171 -0.139 1
1 270 . 43 1 1 A 25 25 LYS HA H 25 3.809 3.640 0.169 1
1 279 . 43 1 1 A 25 25 LYS C C 25 179.450 179.027 0.423 1
1 280 . 43 1 1 A 25 25 LYS CA C 25 59.621 59.538 0.083 1
1 281 . 43 1 1 A 25 25 LYS CB C 25 32.259 32.183 0.076 1
1 285 . 43 1 1 A 25 25 LYS N N 25 118.368 120.607 -2.239 1
1 286 . 43 1 1 A 26 26 GLU H H 26 7.845 7.803 0.042 1
1 287 . 43 1 1 A 26 26 GLU HA H 26 4.021 4.228 -0.207 1
1 292 . 43 1 1 A 26 26 GLU C C 26 179.191 179.045 0.146 1
1 293 . 43 1 1 A 26 26 GLU CA C 26 59.530 58.862 0.668 1
1 294 . 43 1 1 A 26 26 GLU CB C 26 29.449 29.543 -0.094 1
1 296 . 43 1 1 A 26 26 GLU N N 26 120.522 118.880 1.642 1
1 297 . 43 1 1 A 27 27 LEU H H 27 8.165 8.132 0.033 1
1 298 . 43 1 1 A 27 27 LEU HA H 27 4.163 4.153 0.010 1
1 308 . 43 1 1 A 27 27 LEU C C 27 177.256 178.335 -1.079 1
1 309 . 43 1 1 A 27 27 LEU CA C 27 58.049 57.672 0.377 1
1 310 . 43 1 1 A 27 27 LEU CB C 27 41.365 41.712 -0.347 1
1 314 . 43 1 1 A 27 27 LEU N N 27 120.879 120.662 0.217 1
1 315 . 43 1 1 A 28 28 LYS H H 28 8.902 8.059 0.843 1
1 316 . 43 1 1 A 28 28 LYS HA H 28 4.199 4.782 -0.583 1
1 317 . 43 1 1 A 28 28 LYS C C 28 179.707 179.349 0.358 1
1 318 . 43 1 1 A 28 28 LYS CA C 28 60.097 59.236 0.861 1
1 319 . 43 1 1 A 28 28 LYS CB C 28 33.420 31.763 1.657 1
1 320 . 43 1 1 A 28 28 LYS N N 28 120.050 119.465 0.585 1
1 321 . 43 1 1 A 29 29 THR H H 29 8.294 8.159 0.135 1
1 322 . 43 1 1 A 29 29 THR HA H 29 3.892 3.981 -0.089 1
1 327 . 43 1 1 A 29 29 THR C C 29 175.711 176.760 -1.049 1
1 328 . 43 1 1 A 29 29 THR CA C 29 66.846 66.454 0.392 1
1 329 . 43 1 1 A 29 29 THR CB C 29 68.794 68.922 -0.128 1
1 331 . 43 1 1 A 29 29 THR N N 29 115.933 116.742 -0.809 1
1 332 . 43 1 1 A 30 30 ALA H H 30 8.244 8.567 -0.323 1
1 333 . 43 1 1 A 30 30 ALA HA H 30 4.241 4.252 -0.011 1
1 337 . 43 1 1 A 30 30 ALA C C 30 179.128 179.545 -0.417 1
1 338 . 43 1 1 A 30 30 ALA CA C 30 55.714 55.485 0.229 1
1 339 . 43 1 1 A 30 30 ALA CB C 30 18.955 18.393 0.562 1
1 340 . 43 1 1 A 30 30 ALA N N 30 124.617 123.279 1.338 1
1 341 . 43 1 1 A 31 31 ALA H H 31 8.968 8.427 0.541 1
1 342 . 43 1 1 A 31 31 ALA HA H 31 3.890 4.038 -0.148 1
1 346 . 43 1 1 A 31 31 ALA C C 31 180.352 179.730 0.622 1
1 347 . 43 1 1 A 31 31 ALA CA C 31 55.454 55.455 -0.001 1
1 348 . 43 1 1 A 31 31 ALA CB C 31 17.124 18.178 -1.054 1
1 349 . 43 1 1 A 31 31 ALA N N 31 119.327 120.367 -1.040 1
1 350 . 43 1 1 A 32 32 SER H H 32 7.995 7.949 0.046 1
1 351 . 43 1 1 A 32 32 SER HA H 32 4.238 4.321 -0.083 1
1 354 . 43 1 1 A 32 32 SER C C 32 175.612 176.400 -0.788 1
1 355 . 43 1 1 A 32 32 SER CA C 32 61.203 61.161 0.042 1
1 356 . 43 1 1 A 32 32 SER CB C 32 63.406 63.181 0.225 1
1 357 . 43 1 1 A 32 32 SER N N 32 111.962 112.487 -0.525 1
1 358 . 43 1 1 A 33 33 GLN H H 33 8.333 7.726 0.607 1
1 359 . 43 1 1 A 33 33 GLN HA H 33 3.992 4.208 -0.216 1
1 366 . 43 1 1 A 33 33 GLN C C 33 177.486 177.492 -0.006 1
1 367 . 43 1 1 A 33 33 GLN CA C 33 58.277 57.974 0.303 1
1 368 . 43 1 1 A 33 33 GLN CB C 33 29.140 29.351 -0.211 1
1 370 . 43 1 1 A 33 33 GLN N N 33 119.527 121.373 -1.846 1
1 372 . 43 1 1 A 34 34 TYR H H 34 8.587 8.286 0.301 1
1 373 . 43 1 1 A 34 34 TYR HA H 34 4.792 4.492 0.300 1
1 380 . 43 1 1 A 34 34 TYR C C 34 176.499 176.668 -0.169 1
1 381 . 43 1 1 A 34 34 TYR CA C 34 57.711 59.377 -1.666 1
1 382 . 43 1 1 A 34 34 TYR CB C 34 39.561 39.030 0.531 1
1 387 . 43 1 1 A 34 34 TYR N N 34 114.610 116.028 -1.418 1
1 388 . 43 1 1 A 35 35 GLY H H 35 7.346 8.296 -0.950 1
1 389 . 43 1 1 A 35 35 GLY HA2 H 35 4.785 4.088 0.697 1
1 390 . 43 1 1 A 35 35 GLY HA3 H 35 4.007 4.092 -0.085 1
1 391 . 43 1 1 A 35 35 GLY C C 35 175.796 173.137 2.659 1
1 392 . 43 1 1 A 35 35 GLY CA C 35 44.355 44.916 -0.561 1
1 393 . 43 1 1 A 35 35 GLY N N 35 108.501 106.724 1.777 1
1 394 . 43 1 1 A 36 36 ALA H H 36 9.363 8.291 1.072 1
1 395 . 43 1 1 A 36 36 ALA HA H 36 4.217 4.654 -0.437 1
1 399 . 43 1 1 A 36 36 ALA C C 36 178.039 177.560 0.479 1
1 400 . 43 1 1 A 36 36 ALA CA C 36 56.114 51.883 4.231 1
1 401 . 43 1 1 A 36 36 ALA CB C 36 19.179 19.327 -0.148 1
1 402 . 43 1 1 A 36 36 ALA N N 36 125.811 123.154 2.657 1
1 403 . 43 1 1 A 37 37 THR H H 37 8.070 8.963 -0.893 1
1 404 . 43 1 1 A 37 37 THR HA H 37 4.570 4.497 0.073 1
1 409 . 43 1 1 A 37 37 THR C C 37 173.685 174.163 -0.478 1
1 410 . 43 1 1 A 37 37 THR CA C 37 59.822 62.610 -2.788 1
1 411 . 43 1 1 A 37 37 THR CB C 37 68.267 71.388 -3.121 1
1 413 . 43 1 1 A 37 37 THR N N 37 129.410 118.199 11.211 1
1 414 . 43 1 1 A 38 38 ALA H H 38 6.853 7.515 -0.662 1
1 415 . 43 1 1 A 38 38 ALA HA H 38 4.601 4.571 0.030 1
1 419 . 43 1 1 A 38 38 ALA CA C 38 50.758 50.761 -0.003 1
1 420 . 43 1 1 A 38 38 ALA CB C 38 18.325 19.628 -1.303 1
1 421 . 43 1 1 A 38 38 ALA N N 38 124.674 124.170 0.504 1
1 422 . 43 1 1 A 40 40 TYR HA H 40 4.032 4.032 0.000 1
1 429 . 43 1 1 A 40 40 TYR C C 40 176.456 177.331 -0.875 1
1 430 . 43 1 1 A 40 40 TYR CA C 40 61.010 61.682 -0.672 1
1 431 . 43 1 1 A 40 40 TYR CB C 40 39.286 38.666 0.620 1
1 436 . 43 1 1 A 41 41 THR H H 41 6.874 8.284 -1.410 1
1 437 . 43 1 1 A 41 41 THR HA H 41 3.616 3.813 -0.197 1
1 442 . 43 1 1 A 41 41 THR C C 41 176.930 176.547 0.383 1
1 443 . 43 1 1 A 41 41 THR CA C 41 65.557 65.475 0.082 1
1 444 . 43 1 1 A 41 41 THR CB C 41 68.228 69.061 -0.833 1
1 446 . 43 1 1 A 41 41 THR N N 41 115.143 113.896 1.247 1
1 447 . 43 1 1 A 42 42 LEU H H 42 8.623 7.298 1.325 1
1 448 . 43 1 1 A 42 42 LEU HA H 42 3.708 4.093 -0.385 1
1 458 . 43 1 1 A 42 42 LEU C C 42 178.206 179.156 -0.950 1
1 459 . 43 1 1 A 42 42 LEU CA C 42 57.417 57.713 -0.296 1
1 460 . 43 1 1 A 42 42 LEU CB C 42 41.342 41.221 0.121 1
1 464 . 43 1 1 A 42 42 LEU N N 42 120.418 119.155 1.263 1
1 465 . 43 1 1 A 43 43 ALA H H 43 7.735 7.823 -0.088 1
1 466 . 43 1 1 A 43 43 ALA HA H 43 4.020 4.001 0.019 1
1 470 . 43 1 1 A 43 43 ALA C C 43 180.826 180.387 0.439 1
1 471 . 43 1 1 A 43 43 ALA CA C 43 54.925 54.957 -0.032 1
1 472 . 43 1 1 A 43 43 ALA CB C 43 17.506 18.206 -0.700 1
1 473 . 43 1 1 A 43 43 ALA N N 43 120.203 121.795 -1.592 1
1 474 . 43 1 1 A 44 44 ILE H H 44 7.149 7.326 -0.177 1
1 475 . 43 1 1 A 44 44 ILE HA H 44 3.603 3.624 -0.021 1
1 485 . 43 1 1 A 44 44 ILE C C 44 178.594 178.176 0.418 1
1 486 . 43 1 1 A 44 44 ILE CA C 44 64.782 64.326 0.456 1
1 487 . 43 1 1 A 44 44 ILE CB C 44 37.472 37.851 -0.379 1
1 491 . 43 1 1 A 44 44 ILE N N 44 118.881 119.394 -0.513 1
1 492 . 43 1 1 A 45 45 VAL H H 45 7.968 7.890 0.078 1
1 493 . 43 1 1 A 45 45 VAL HA H 45 2.925 3.366 -0.441 1
1 501 . 43 1 1 A 45 45 VAL C C 45 177.023 177.880 -0.857 1
1 502 . 43 1 1 A 45 45 VAL CA C 45 67.081 66.900 0.181 1
1 503 . 43 1 1 A 45 45 VAL CB C 45 30.854 31.292 -0.438 1
1 506 . 43 1 1 A 45 45 VAL N N 45 120.764 119.507 1.257 1
1 507 . 43 1 1 A 46 46 GLU H H 46 8.399 8.567 -0.168 1
1 508 . 43 1 1 A 46 46 GLU HA H 46 3.848 3.943 -0.095 1
1 513 . 43 1 1 A 46 46 GLU C C 46 178.656 178.655 0.001 1
1 514 . 43 1 1 A 46 46 GLU CA C 46 59.491 59.133 0.358 1
1 515 . 43 1 1 A 46 46 GLU CB C 46 28.991 28.750 0.241 1
1 517 . 43 1 1 A 46 46 GLU N N 46 116.599 119.494 -2.895 1
1 518 . 43 1 1 A 47 47 SER H H 47 7.273 7.411 -0.138 1
1 519 . 43 1 1 A 47 47 SER HA H 47 4.287 4.228 0.059 1
1 521 . 43 1 1 A 47 47 SER CA C 47 61.047 61.368 -0.321 1
1 522 . 43 1 1 A 47 47 SER CB C 47 63.016 62.710 0.306 1
1 523 . 43 1 1 A 47 47 SER N N 47 113.609 115.672 -2.063 1
1 524 . 43 1 1 A 48 48 VAL H H 48 8.006 8.269 -0.263 1
1 525 . 43 1 1 A 48 48 VAL HA H 48 3.556 3.834 -0.278 1
1 533 . 43 1 1 A 48 48 VAL C C 48 177.257 177.238 0.019 1
1 534 . 43 1 1 A 48 48 VAL CA C 48 65.025 64.912 0.113 1
1 535 . 43 1 1 A 48 48 VAL CB C 48 31.841 31.752 0.089 1
1 538 . 43 1 1 A 48 48 VAL N N 48 122.327 118.547 3.780 1
1 539 . 43 1 1 A 49 49 ALA H H 49 8.369 7.798 0.571 1
1 540 . 43 1 1 A 49 49 ALA HA H 49 4.115 4.332 -0.217 1
1 544 . 43 1 1 A 49 49 ALA C C 49 177.307 177.348 -0.041 1
1 545 . 43 1 1 A 49 49 ALA CA C 49 53.253 52.857 0.396 1
1 546 . 43 1 1 A 49 49 ALA CB C 49 20.131 18.433 1.698 1
1 547 . 43 1 1 A 49 49 ALA N N 49 118.050 123.917 -5.867 1
1 548 . 43 1 1 A 50 50 ASP H H 50 7.052 7.958 -0.906 1
1 549 . 43 1 1 A 50 50 ASP HA H 50 4.788 4.820 -0.032 1
1 552 . 43 1 1 A 50 50 ASP C C 50 175.481 176.291 -0.810 1
1 553 . 43 1 1 A 50 50 ASP CA C 50 53.681 54.132 -0.451 1
1 554 . 43 1 1 A 50 50 ASP CB C 50 39.333 41.270 -1.937 1
1 555 . 43 1 1 A 50 50 ASP N N 50 116.997 116.837 0.160 1
1 556 . 43 1 1 A 51 51 ASN H H 51 8.535 7.603 0.932 1
1 557 . 43 1 1 A 51 51 ASN HA H 51 4.628 5.113 -0.485 1
1 562 . 43 1 1 A 51 51 ASN C C 51 174.077 175.522 -1.445 1
1 563 . 43 1 1 A 51 51 ASN CA C 51 52.315 52.019 0.296 1
1 564 . 43 1 1 A 51 51 ASN CB C 51 41.928 40.143 1.785 1
1 565 . 43 1 1 A 51 51 ASN N N 51 118.626 117.756 0.870 1
1 567 . 43 1 1 A 52 52 TRP H H 52 8.555 8.518 0.037 1
1 574 . 43 1 1 A 52 52 TRP C C 52 173.269 176.586 -3.317 1
1 575 . 43 1 1 A 52 52 TRP CA C 52 55.031 57.537 -2.506 1
1 576 . 43 1 1 A 52 52 TRP CB C 52 26.801 29.368 -2.567 1
1 582 . 43 1 1 A 52 52 TRP N N 52 120.693 121.169 -0.476 1
1 584 . 43 1 1 A 53 53 LEU H H 53 7.847 9.060 -1.213 1
1 585 . 43 1 1 A 53 53 LEU HA H 53 4.859 5.284 -0.425 1
1 595 . 43 1 1 A 53 53 LEU C C 53 177.397 175.528 1.869 1
1 596 . 43 1 1 A 53 53 LEU CA C 53 53.619 53.182 0.437 1
1 597 . 43 1 1 A 53 53 LEU CB C 53 41.812 46.165 -4.353 1
1 601 . 43 1 1 A 53 53 LEU N N 53 124.741 120.710 4.031 1
1 602 . 43 1 1 A 54 54 THR H H 54 8.850 8.348 0.502 1
1 603 . 43 1 1 A 54 54 THR HA H 54 4.598 4.836 -0.238 1
1 608 . 43 1 1 A 54 54 THR CA C 54 60.531 58.895 1.636 1
1 609 . 43 1 1 A 54 54 THR CB C 54 67.183 70.169 -2.986 1
1 611 . 43 1 1 A 54 54 THR N N 54 113.407 110.203 3.204 1
1 612 . 43 1 1 A 55 55 PRO HA H 55 4.511 4.446 0.065 1
1 619 . 43 1 1 A 55 55 PRO C C 55 179.383 178.872 0.511 1
1 620 . 43 1 1 A 55 55 PRO CA C 55 67.159 64.698 2.461 1
1 621 . 43 1 1 A 55 55 PRO CB C 55 32.095 32.051 0.044 1
1 622 . 43 1 1 A 56 56 THR H H 56 8.575 7.889 0.686 1
1 623 . 43 1 1 A 56 56 THR HA H 56 4.229 4.114 0.115 1
1 628 . 43 1 1 A 56 56 THR C C 56 176.668 176.167 0.501 1
1 629 . 43 1 1 A 56 56 THR CA C 56 66.943 65.956 0.987 1
1 630 . 43 1 1 A 56 56 THR CB C 56 68.129 68.286 -0.157 1
1 632 . 43 1 1 A 56 56 THR N N 56 114.855 112.528 2.327 1
1 633 . 43 1 1 A 57 57 ASP H H 57 8.730 8.210 0.520 1
1 634 . 43 1 1 A 57 57 ASP HA H 57 4.425 4.742 -0.317 1
1 637 . 43 1 1 A 57 57 ASP C C 57 178.351 178.677 -0.326 1
1 638 . 43 1 1 A 57 57 ASP CA C 57 57.963 57.554 0.409 1
1 639 . 43 1 1 A 57 57 ASP CB C 57 40.134 41.787 -1.653 1
1 640 . 43 1 1 A 57 57 ASP N N 57 126.239 121.383 4.856 1
1 641 . 43 1 1 A 58 58 TRP H H 58 8.244 8.666 -0.422 1
1 642 . 43 1 1 A 58 58 TRP HA H 58 4.030 4.664 -0.634 1
1 650 . 43 1 1 A 58 58 TRP C C 58 177.432 178.920 -1.488 1
1 651 . 43 1 1 A 58 58 TRP CA C 58 62.731 60.081 2.650 1
1 652 . 43 1 1 A 58 58 TRP CB C 58 29.122 29.563 -0.441 1
1 657 . 43 1 1 A 58 58 TRP N N 58 119.241 121.079 -1.838 1
1 659 . 43 1 1 A 59 59 ASN H H 59 8.098 8.910 -0.812 1
1 660 . 43 1 1 A 59 59 ASN HA H 59 4.424 4.369 0.055 1
1 663 . 43 1 1 A 59 59 ASN C C 59 176.952 177.580 -0.628 1
1 664 . 43 1 1 A 59 59 ASN CA C 59 58.135 56.451 1.684 1
1 665 . 43 1 1 A 59 59 ASN CB C 59 40.168 39.731 0.437 1
1 666 . 43 1 1 A 59 59 ASN N N 59 115.747 117.866 -2.119 1
1 667 . 43 1 1 A 60 60 THR H H 60 8.712 7.917 0.795 1
1 668 . 43 1 1 A 60 60 THR HA H 60 3.717 3.918 -0.201 1
1 673 . 43 1 1 A 60 60 THR C C 60 176.044 177.021 -0.977 1
1 674 . 43 1 1 A 60 60 THR CA C 60 66.576 65.932 0.644 1
1 675 . 43 1 1 A 60 60 THR CB C 60 69.251 68.001 1.250 1
1 677 . 43 1 1 A 60 60 THR N N 60 114.896 115.862 -0.966 1
1 678 . 43 1 1 A 61 61 LEU H H 61 8.485 8.227 0.258 1
1 679 . 43 1 1 A 61 61 LEU HA H 61 3.391 3.920 -0.529 1
1 689 . 43 1 1 A 61 61 LEU C C 61 177.433 178.615 -1.182 1
1 690 . 43 1 1 A 61 61 LEU CA C 61 58.354 58.450 -0.096 1
1 691 . 43 1 1 A 61 61 LEU CB C 61 41.761 41.968 -0.207 1
1 695 . 43 1 1 A 61 61 LEU N N 61 123.433 122.339 1.094 1
1 696 . 43 1 1 A 62 62 VAL H H 62 8.073 7.769 0.304 1
1 697 . 43 1 1 A 62 62 VAL HA H 62 3.207 3.203 0.004 1
1 705 . 43 1 1 A 62 62 VAL C C 62 177.585 177.690 -0.105 1
1 706 . 43 1 1 A 62 62 VAL CA C 62 67.345 66.600 0.745 1
1 707 . 43 1 1 A 62 62 VAL CB C 62 30.905 31.075 -0.170 1
1 710 . 43 1 1 A 62 62 VAL N N 62 116.018 117.744 -1.726 1
1 711 . 43 1 1 A 63 63 ARG H H 63 7.765 7.834 -0.069 1
1 712 . 43 1 1 A 63 63 ARG HA H 63 3.602 3.843 -0.241 1
1 719 . 43 1 1 A 63 63 ARG C C 63 177.818 178.388 -0.570 1
1 720 . 43 1 1 A 63 63 ARG CA C 63 58.049 59.574 -1.525 1
1 721 . 43 1 1 A 63 63 ARG CB C 63 29.955 29.914 0.041 1
1 724 . 43 1 1 A 63 63 ARG N N 63 116.700 120.508 -3.808 1
1 725 . 43 1 1 A 64 64 ALA H H 64 7.574 7.666 -0.092 1
1 726 . 43 1 1 A 64 64 ALA HA H 64 4.158 4.345 -0.187 1
1 730 . 43 1 1 A 64 64 ALA C C 64 179.886 179.179 0.707 1
1 731 . 43 1 1 A 64 64 ALA CA C 64 54.007 53.815 0.192 1
1 732 . 43 1 1 A 64 64 ALA CB C 64 19.147 19.904 -0.757 1
1 733 . 43 1 1 A 64 64 ALA N N 64 117.555 119.939 -2.384 1
1 734 . 43 1 1 A 65 65 VAL H H 65 7.554 7.903 -0.349 1
1 735 . 43 1 1 A 65 65 VAL HA H 65 4.253 3.800 0.453 1
1 743 . 43 1 1 A 65 65 VAL C C 65 174.180 176.183 -2.003 1
1 744 . 43 1 1 A 65 65 VAL CA C 65 62.683 65.360 -2.677 1
1 745 . 43 1 1 A 65 65 VAL CB C 65 33.458 31.301 2.157 1
1 748 . 43 1 1 A 65 65 VAL N N 65 110.013 115.691 -5.678 1
1 749 . 43 1 1 A 66 66 LEU H H 66 7.792 6.893 0.899 1
1 750 . 43 1 1 A 66 66 LEU HA H 66 4.790 4.782 0.008 1
1 760 . 43 1 1 A 66 66 LEU C C 66 177.537 175.290 2.247 1
1 761 . 43 1 1 A 66 66 LEU CA C 66 52.823 52.736 0.087 1
1 762 . 43 1 1 A 66 66 LEU CB C 66 44.071 45.754 -1.683 1
1 766 . 43 1 1 A 66 66 LEU N N 66 118.967 121.356 -2.389 1
1 767 . 43 1 1 A 67 67 SER H H 67 9.208 8.358 0.850 1
1 768 . 43 1 1 A 67 67 SER HA H 67 4.414 5.142 -0.728 1
1 771 . 43 1 1 A 67 67 SER CA C 67 57.943 57.222 0.721 1
1 772 . 43 1 1 A 67 67 SER CB C 67 64.743 67.318 -2.575 1
1 773 . 43 1 1 A 67 67 SER N N 67 116.378 115.509 0.869 1
1 774 . 43 1 1 A 69 69 GLY HA2 H 69 3.916 3.782 0.134 1
1 775 . 43 1 1 A 69 69 GLY HA3 H 69 3.867 3.798 0.069 1
1 776 . 43 1 1 A 69 69 GLY C C 69 176.783 175.573 1.210 1
1 777 . 43 1 1 A 69 69 GLY CA C 69 46.977 46.481 0.496 1
1 778 . 43 1 1 A 70 70 ASP H H 70 7.674 8.134 -0.460 1
1 779 . 43 1 1 A 70 70 ASP HA H 70 4.511 3.738 0.773 1
1 782 . 43 1 1 A 70 70 ASP C C 70 178.096 178.340 -0.244 1
1 783 . 43 1 1 A 70 70 ASP CA C 70 57.262 56.511 0.751 1
1 784 . 43 1 1 A 70 70 ASP CB C 70 40.594 39.625 0.969 1
1 785 . 43 1 1 A 70 70 ASP N N 70 123.930 122.033 1.897 1
1 786 . 43 1 1 A 71 71 HIS H H 71 8.729 7.766 0.963 1
1 787 . 43 1 1 A 71 71 HIS HA H 71 4.235 4.219 0.016 1
1 790 . 43 1 1 A 71 71 HIS C C 71 176.769 176.898 -0.129 1
1 791 . 43 1 1 A 71 71 HIS CA C 71 60.041 59.701 0.340 1
1 792 . 43 1 1 A 71 71 HIS CB C 71 30.682 30.470 0.212 1
1 793 . 43 1 1 A 71 71 HIS N N 71 121.003 119.335 1.668 1
1 794 . 43 1 1 A 72 72 LEU H H 72 7.620 7.970 -0.350 1
1 795 . 43 1 1 A 72 72 LEU HA H 72 3.769 3.986 -0.217 1
1 805 . 43 1 1 A 72 72 LEU C C 72 180.275 179.232 1.043 1
1 806 . 43 1 1 A 72 72 LEU CA C 72 58.192 58.002 0.190 1
1 807 . 43 1 1 A 72 72 LEU CB C 72 41.381 41.301 0.080 1
1 811 . 43 1 1 A 72 72 LEU N N 72 118.569 118.764 -0.195 1
1 812 . 43 1 1 A 73 73 LEU H H 73 7.542 7.695 -0.153 1
1 813 . 43 1 1 A 73 73 LEU HA H 73 4.107 4.274 -0.167 1
1 823 . 43 1 1 A 73 73 LEU C C 73 179.436 179.037 0.399 1
1 824 . 43 1 1 A 73 73 LEU CA C 73 58.026 57.243 0.783 1
1 825 . 43 1 1 A 73 73 LEU CB C 73 41.638 42.078 -0.440 1
1 829 . 43 1 1 A 73 73 LEU N N 73 121.418 120.379 1.039 1
1 830 . 43 1 1 A 74 74 TRP H H 74 8.786 8.044 0.742 1
1 831 . 43 1 1 A 74 74 TRP HA H 74 3.589 5.294 -1.705 1
1 840 . 43 1 1 A 74 74 TRP C C 74 176.816 178.621 -1.805 1
1 841 . 43 1 1 A 74 74 TRP CA C 74 63.046 60.047 2.999 1
1 842 . 43 1 1 A 74 74 TRP CB C 74 28.065 29.165 -1.100 1
1 848 . 43 1 1 A 74 74 TRP N N 74 121.111 118.301 2.810 1
1 850 . 43 1 1 A 75 75 LYS H H 75 8.939 7.497 1.442 1
1 851 . 43 1 1 A 75 75 LYS HA H 75 3.055 4.126 -1.071 1
1 860 . 43 1 1 A 75 75 LYS C C 75 177.967 179.459 -1.492 1
1 861 . 43 1 1 A 75 75 LYS CA C 75 60.029 58.630 1.399 1
1 862 . 43 1 1 A 75 75 LYS CB C 75 32.533 32.715 -0.182 1
1 866 . 43 1 1 A 75 75 LYS N N 75 119.783 118.624 1.159 1
1 867 . 43 1 1 A 76 76 SER H H 76 7.832 7.875 -0.043 1
1 868 . 43 1 1 A 76 76 SER HA H 76 4.040 4.482 -0.442 1
1 871 . 43 1 1 A 76 76 SER C C 76 177.816 177.016 0.800 1
1 872 . 43 1 1 A 76 76 SER CA C 76 62.105 61.500 0.605 1
1 873 . 43 1 1 A 76 76 SER CB C 76 62.679 63.235 -0.556 1
1 874 . 43 1 1 A 76 76 SER N N 76 113.395 115.187 -1.792 1
1 875 . 43 1 1 A 77 77 GLU H H 77 7.590 7.654 -0.064 1
1 876 . 43 1 1 A 77 77 GLU HA H 77 4.042 4.345 -0.303 1
1 881 . 43 1 1 A 77 77 GLU C C 77 177.809 178.481 -0.672 1
1 882 . 43 1 1 A 77 77 GLU CA C 77 58.270 58.371 -0.101 1
1 883 . 43 1 1 A 77 77 GLU CB C 77 29.208 29.493 -0.285 1
1 885 . 43 1 1 A 77 77 GLU N N 77 121.574 121.842 -0.268 1
1 886 . 43 1 1 A 78 78 PHE H H 78 9.081 7.835 1.246 1
1 887 . 43 1 1 A 78 78 PHE HA H 78 3.778 4.217 -0.439 1
1 895 . 43 1 1 A 78 78 PHE C C 78 178.114 177.401 0.713 1
1 896 . 43 1 1 A 78 78 PHE CA C 78 60.629 61.273 -0.644 1
1 897 . 43 1 1 A 78 78 PHE CB C 78 38.295 38.657 -0.362 1
1 902 . 43 1 1 A 78 78 PHE N N 78 122.682 122.387 0.295 1
1 903 . 43 1 1 A 79 79 PHE H H 79 8.890 8.018 0.872 1
1 904 . 43 1 1 A 79 79 PHE HA H 79 3.800 4.079 -0.279 1
1 912 . 43 1 1 A 79 79 PHE C C 79 178.354 178.024 0.330 1
1 913 . 43 1 1 A 79 79 PHE CA C 79 60.704 62.235 -1.531 1
1 914 . 43 1 1 A 79 79 PHE CB C 79 37.184 38.676 -1.492 1
1 920 . 43 1 1 A 79 79 PHE N N 79 121.056 117.906 3.150 1
1 921 . 43 1 1 A 80 80 GLU H H 80 7.793 8.105 -0.312 1
1 922 . 43 1 1 A 80 80 GLU HA H 80 4.082 4.114 -0.032 1
1 927 . 43 1 1 A 80 80 GLU C C 80 179.068 179.156 -0.088 1
1 928 . 43 1 1 A 80 80 GLU CA C 80 59.735 59.239 0.496 1
1 929 . 43 1 1 A 80 80 GLU CB C 80 28.722 29.445 -0.723 1
1 931 . 43 1 1 A 80 80 GLU N N 80 120.312 119.347 0.965 1
1 932 . 43 1 1 A 81 81 ASN H H 81 8.624 8.673 -0.049 1
1 933 . 43 1 1 A 81 81 ASN HA H 81 4.521 4.548 -0.027 1
1 938 . 43 1 1 A 81 81 ASN C C 81 179.262 178.097 1.165 1
1 939 . 43 1 1 A 81 81 ASN CA C 81 55.504 56.359 -0.855 1
1 940 . 43 1 1 A 81 81 ASN CB C 81 37.517 37.750 -0.233 1
1 941 . 43 1 1 A 81 81 ASN N N 81 119.338 118.248 1.090 1
1 943 . 43 1 1 A 82 82 CYS H H 82 8.554 7.943 0.611 1
1 944 . 43 1 1 A 82 82 CYS HA H 82 3.792 4.001 -0.209 1
1 947 . 43 1 1 A 82 82 CYS C C 82 176.478 177.121 -0.643 1
1 948 . 43 1 1 A 82 82 CYS CA C 82 65.232 63.750 1.482 1
1 949 . 43 1 1 A 82 82 CYS CB C 82 26.762 26.986 -0.224 1
1 950 . 43 1 1 A 82 82 CYS N N 82 120.576 117.928 2.648 1
1 951 . 43 1 1 A 83 83 ARG H H 83 8.522 7.849 0.673 1
1 952 . 43 1 1 A 83 83 ARG HA H 83 3.932 4.185 -0.253 1
1 960 . 43 1 1 A 83 83 ARG C C 83 179.138 178.683 0.455 1
1 961 . 43 1 1 A 83 83 ARG CA C 83 60.443 58.941 1.502 1
1 962 . 43 1 1 A 83 83 ARG CB C 83 29.550 29.704 -0.154 1
1 965 . 43 1 1 A 83 83 ARG N N 83 123.035 119.877 3.158 1
1 967 . 43 1 1 A 84 84 ASP H H 84 7.791 8.346 -0.555 1
1 968 . 43 1 1 A 84 84 ASP HA H 84 4.353 4.393 -0.040 1
1 971 . 43 1 1 A 84 84 ASP C C 84 178.649 178.437 0.212 1
1 972 . 43 1 1 A 84 84 ASP CA C 84 57.767 57.624 0.143 1
1 973 . 43 1 1 A 84 84 ASP CB C 84 41.305 41.561 -0.256 1
1 974 . 43 1 1 A 84 84 ASP N N 84 120.332 119.651 0.681 1
1 975 . 43 1 1 A 85 85 THR H H 85 8.370 7.985 0.385 1
1 976 . 43 1 1 A 85 85 THR HA H 85 3.730 3.970 -0.240 1
1 981 . 43 1 1 A 85 85 THR C C 85 175.198 176.659 -1.461 1
1 982 . 43 1 1 A 85 85 THR CA C 85 66.830 65.042 1.788 1
1 983 . 43 1 1 A 85 85 THR CB C 85 68.533 68.864 -0.331 1
1 985 . 43 1 1 A 85 85 THR N N 85 117.360 113.405 3.955 1
1 986 . 43 1 1 A 86 86 ALA H H 86 8.845 7.996 0.849 1
1 987 . 43 1 1 A 86 86 ALA HA H 86 3.991 4.090 -0.099 1
1 991 . 43 1 1 A 86 86 ALA C C 86 179.980 179.468 0.512 1
1 992 . 43 1 1 A 86 86 ALA CA C 86 55.769 55.279 0.490 1
1 993 . 43 1 1 A 86 86 ALA CB C 86 17.881 18.068 -0.187 1
1 994 . 43 1 1 A 86 86 ALA N N 86 123.613 123.211 0.402 1
1 995 . 43 1 1 A 87 87 LYS H H 87 7.686 8.237 -0.551 1
1 996 . 43 1 1 A 87 87 LYS HA H 87 4.099 4.044 0.055 1
1 1005 . 43 1 1 A 87 87 LYS C C 87 179.592 178.563 1.029 1
1 1006 . 43 1 1 A 87 87 LYS CA C 87 59.708 59.249 0.459 1
1 1007 . 43 1 1 A 87 87 LYS CB C 87 32.054 31.935 0.119 1
1 1011 . 43 1 1 A 87 87 LYS N N 87 119.623 116.566 3.057 1
1 1012 . 43 1 1 A 88 88 ARG H H 88 7.683 7.807 -0.124 1
1 1013 . 43 1 1 A 88 88 ARG HA H 88 4.051 4.198 -0.147 1
1 1020 . 43 1 1 A 88 88 ARG C C 88 180.053 179.224 0.829 1
1 1021 . 43 1 1 A 88 88 ARG CA C 88 59.558 59.188 0.370 1
1 1022 . 43 1 1 A 88 88 ARG CB C 88 29.684 29.778 -0.094 1
1 1025 . 43 1 1 A 88 88 ARG N N 88 120.788 119.154 1.634 1
1 1026 . 43 1 1 A 89 89 ASN H H 89 8.973 8.176 0.797 1
1 1027 . 43 1 1 A 89 89 ASN HA H 89 4.354 4.618 -0.264 1
1 1032 . 43 1 1 A 89 89 ASN C C 89 178.382 178.609 -0.227 1
1 1033 . 43 1 1 A 89 89 ASN CA C 89 55.334 55.918 -0.584 1
1 1034 . 43 1 1 A 89 89 ASN CB C 89 37.864 38.007 -0.143 1
1 1035 . 43 1 1 A 89 89 ASN N N 89 121.012 117.980 3.032 1
1 1037 . 43 1 1 A 90 90 GLN H H 90 8.152 8.082 0.070 1
1 1038 . 43 1 1 A 90 90 GLN HA H 90 4.020 4.163 -0.143 1
1 1045 . 43 1 1 A 90 90 GLN C C 90 179.075 178.734 0.341 1
1 1046 . 43 1 1 A 90 90 GLN CA C 90 59.318 58.901 0.417 1
1 1047 . 43 1 1 A 90 90 GLN CB C 90 28.049 28.324 -0.275 1
1 1049 . 43 1 1 A 90 90 GLN N N 90 122.122 120.674 1.448 1
1 1051 . 43 1 1 A 91 91 GLN H H 91 7.514 8.474 -0.960 1
1 1052 . 43 1 1 A 91 91 GLN HA H 91 4.053 4.095 -0.042 1
1 1059 . 43 1 1 A 91 91 GLN C C 91 177.081 177.884 -0.803 1
1 1060 . 43 1 1 A 91 91 GLN CA C 91 58.031 58.307 -0.276 1
1 1061 . 43 1 1 A 91 91 GLN CB C 91 28.365 27.607 0.758 1
1 1063 . 43 1 1 A 91 91 GLN N N 91 118.124 118.151 -0.027 1
1 1065 . 43 1 1 A 92 92 ALA H H 92 7.704 7.227 0.477 1
1 1066 . 43 1 1 A 92 92 ALA HA H 92 4.246 4.313 -0.067 1
1 1070 . 43 1 1 A 92 92 ALA C C 92 178.450 177.941 0.509 1
1 1071 . 43 1 1 A 92 92 ALA CA C 92 52.671 52.386 0.285 1
1 1072 . 43 1 1 A 92 92 ALA CB C 92 19.316 19.635 -0.319 1
1 1073 . 43 1 1 A 92 92 ALA N N 92 119.880 120.564 -0.684 1
1 1074 . 43 1 1 A 93 93 GLY H H 93 7.693 8.138 -0.445 1
1 1075 . 43 1 1 A 93 93 GLY HA2 H 93 3.941 3.925 0.016 1
1 1076 . 43 1 1 A 93 93 GLY HA3 H 93 3.744 3.931 -0.187 1
1 1077 . 43 1 1 A 93 93 GLY C C 93 174.344 174.399 -0.055 1
1 1078 . 43 1 1 A 93 93 GLY CA C 93 45.949 46.429 -0.480 1
1 1079 . 43 1 1 A 93 93 GLY N N 93 105.347 107.267 -1.920 1
1 1080 . 43 1 1 A 94 94 ASN H H 94 7.076 8.311 -1.235 1
1 1081 . 43 1 1 A 94 94 ASN HA H 94 4.115 4.938 -0.823 1
1 1085 . 43 1 1 A 94 94 ASN C C 94 175.410 175.896 -0.486 1
1 1086 . 43 1 1 A 94 94 ASN CA C 94 52.651 52.098 0.553 1
1 1087 . 43 1 1 A 94 94 ASN CB C 94 38.330 40.642 -2.312 1
1 1088 . 43 1 1 A 94 94 ASN N N 94 115.747 117.919 -2.172 1
1 1090 . 43 1 1 A 95 95 GLY H H 95 8.236 8.283 -0.047 1
1 1091 . 43 1 1 A 95 95 GLY HA2 H 95 3.633 3.614 0.019 1
1 1092 . 43 1 1 A 95 95 GLY HA3 H 95 3.633 3.773 -0.140 1
1 1093 . 43 1 1 A 95 95 GLY C C 95 174.450 174.168 0.282 1
1 1094 . 43 1 1 A 95 95 GLY CA C 95 45.522 45.455 0.067 1
1 1095 . 43 1 1 A 95 95 GLY N N 95 109.166 109.852 -0.686 1
1 1096 . 43 1 1 A 96 96 TRP H H 96 7.899 7.409 0.490 1
1 1097 . 43 1 1 A 96 96 TRP HA H 96 5.241 4.772 0.469 1
1 1106 . 43 1 1 A 96 96 TRP C C 96 175.661 175.239 0.422 1
1 1107 . 43 1 1 A 96 96 TRP CA C 96 55.090 57.392 -2.302 1
1 1108 . 43 1 1 A 96 96 TRP CB C 96 27.138 28.615 -1.477 1
1 1114 . 43 1 1 A 96 96 TRP N N 96 122.840 121.993 0.847 1
1 1116 . 43 1 1 A 97 97 ASP H H 97 7.344 8.669 -1.325 1
1 1117 . 43 1 1 A 97 97 ASP HA H 97 4.829 5.106 -0.277 1
1 1120 . 43 1 1 A 97 97 ASP C C 97 175.019 177.833 -2.814 1
1 1121 . 43 1 1 A 97 97 ASP CA C 97 52.149 52.790 -0.641 1
1 1122 . 43 1 1 A 97 97 ASP CB C 97 42.697 43.021 -0.324 1
1 1123 . 43 1 1 A 97 97 ASP N N 97 126.861 125.911 0.950 1
1 1124 . 43 1 1 A 98 98 PHE H H 98 8.566 9.266 -0.700 1
1 1125 . 43 1 1 A 98 98 PHE HA H 98 3.727 4.357 -0.630 1
1 1133 . 43 1 1 A 98 98 PHE C C 98 177.443 177.214 0.229 1
1 1134 . 43 1 1 A 98 98 PHE CA C 98 62.471 60.097 2.374 1
1 1135 . 43 1 1 A 98 98 PHE CB C 98 39.919 38.091 1.828 1
1 1141 . 43 1 1 A 98 98 PHE N N 98 117.781 122.510 -4.729 1
1 1142 . 43 1 1 A 99 99 ASP H H 99 8.259 8.555 -0.296 1
1 1143 . 43 1 1 A 99 99 ASP HA H 99 3.960 3.982 -0.022 1
1 1146 . 43 1 1 A 99 99 ASP C C 99 178.132 178.320 -0.188 1
1 1147 . 43 1 1 A 99 99 ASP CA C 99 57.658 56.593 1.065 1
1 1148 . 43 1 1 A 99 99 ASP CB C 99 38.572 40.545 -1.973 1
1 1149 . 43 1 1 A 99 99 ASP N N 99 121.709 121.286 0.423 1
1 1150 . 43 1 1 A 100 100 MET H H 100 8.008 8.033 -0.025 1
1 1151 . 43 1 1 A 100 100 MET HA H 100 3.644 4.038 -0.394 1
1 1156 . 43 1 1 A 100 100 MET C C 100 180.008 177.031 2.977 1
1 1157 . 43 1 1 A 100 100 MET CA C 100 58.598 58.735 -0.137 1
1 1158 . 43 1 1 A 100 100 MET CB C 100 33.423 32.811 0.612 1
1 1160 . 43 1 1 A 100 100 MET N N 100 119.668 117.784 1.884 1
1 1161 . 43 1 1 A 101 101 LEU H H 101 7.961 8.283 -0.322 1
1 1162 . 43 1 1 A 101 101 LEU HA H 101 3.523 4.352 -0.829 1
1 1172 . 43 1 1 A 101 101 LEU C C 101 173.873 176.696 -2.823 1
1 1173 . 43 1 1 A 101 101 LEU CA C 101 58.743 54.153 4.590 1
1 1174 . 43 1 1 A 101 101 LEU CB C 101 42.632 41.735 0.897 1
1 1178 . 43 1 1 A 101 101 LEU N N 101 119.752 119.494 0.258 1
1 1179 . 43 1 1 A 102 102 THR H H 102 6.955 8.387 -1.432 1
1 1180 . 43 1 1 A 102 102 THR HA H 102 4.134 4.609 -0.475 1
1 1185 . 43 1 1 A 102 102 THR C C 102 176.513 175.340 1.173 1
1 1186 . 43 1 1 A 102 102 THR CA C 102 61.125 62.631 -1.506 1
1 1187 . 43 1 1 A 102 102 THR CB C 102 71.415 70.644 0.771 1
1 1189 . 43 1 1 A 102 102 THR N N 102 124.665 116.514 8.151 1
1 1190 . 43 1 1 A 103 103 GLY H H 103 7.816 7.975 -0.159 1
1 1191 . 43 1 1 A 103 103 GLY HA2 H 103 3.824 3.821 0.003 1
1 1192 . 43 1 1 A 103 103 GLY HA3 H 103 3.824 3.876 -0.052 1
1 1193 . 43 1 1 A 103 103 GLY C C 103 174.126 173.516 0.610 1
1 1194 . 43 1 1 A 103 103 GLY CA C 103 47.805 45.677 2.128 1
1 1195 . 43 1 1 A 103 103 GLY N N 103 114.191 112.533 1.658 1
1 1196 . 43 1 1 A 104 104 SER H H 104 8.860 7.920 0.940 1
1 1197 . 43 1 1 A 104 104 SER HA H 104 4.758 5.036 -0.278 1
1 1200 . 43 1 1 A 104 104 SER C C 104 174.591 173.374 1.217 1
1 1201 . 43 1 1 A 104 104 SER CA C 104 56.755 57.724 -0.969 1
1 1202 . 43 1 1 A 104 104 SER CB C 104 65.050 66.699 -1.649 1
1 1203 . 43 1 1 A 104 104 SER N N 104 114.771 114.673 0.098 1
1 1204 . 43 1 1 A 105 105 GLY H H 105 8.788 8.299 0.489 1
1 1205 . 43 1 1 A 105 105 GLY HA2 H 105 3.733 3.794 -0.061 1
1 1206 . 43 1 1 A 105 105 GLY HA3 H 105 3.733 4.107 -0.374 1
1 1207 . 43 1 1 A 105 105 GLY CA C 105 47.247 45.882 1.365 1
1 1208 . 43 1 1 A 105 105 GLY N N 105 110.394 110.097 0.297 1
1 1209 . 43 1 1 A 106 106 ASN HA H 106 4.454 4.940 -0.486 1
1 1212 . 43 1 1 A 106 106 ASN C C 106 175.180 176.453 -1.273 1
1 1213 . 43 1 1 A 106 106 ASN CA C 106 54.492 54.094 0.398 1
1 1214 . 43 1 1 A 106 106 ASN CB C 106 37.282 41.291 -4.009 1
1 1215 . 43 1 1 A 107 107 TYR H H 107 8.241 7.547 0.694 1
1 1216 . 43 1 1 A 107 107 TYR HA H 107 4.335 4.803 -0.468 1
1 1223 . 43 1 1 A 107 107 TYR C C 107 173.954 176.842 -2.888 1
1 1224 . 43 1 1 A 107 107 TYR CA C 107 57.727 57.803 -0.076 1
1 1225 . 43 1 1 A 107 107 TYR CB C 107 37.063 40.235 -3.172 1
1 1230 . 43 1 1 A 107 107 TYR N N 107 120.708 114.832 5.876 1
1 1231 . 43 1 1 A 108 108 SER H H 108 7.117 8.443 -1.326 1
1 1232 . 43 1 1 A 108 108 SER HA H 108 4.221 4.225 -0.004 1
1 1235 . 43 1 1 A 108 108 SER C C 108 174.834 174.101 0.733 1
1 1236 . 43 1 1 A 108 108 SER CA C 108 59.859 61.233 -1.374 1
1 1237 . 43 1 1 A 108 108 SER CB C 108 63.846 62.439 1.407 1
1 1238 . 43 1 1 A 108 108 SER N N 108 113.362 116.889 -3.527 1
1 1239 . 43 1 1 A 109 109 SER H H 109 8.053 7.649 0.404 1
1 1240 . 43 1 1 A 109 109 SER HA H 109 4.560 4.321 0.239 1
1 1243 . 43 1 1 A 109 109 SER CA C 109 57.141 60.843 -3.702 1
1 1244 . 43 1 1 A 109 109 SER CB C 109 64.874 61.863 3.011 1
1 1245 . 43 1 1 A 109 109 SER N N 109 116.657 113.654 3.003 1
1 1246 . 43 1 1 A 110 110 THR HA H 110 3.541 3.916 -0.375 1
1 1251 . 43 1 1 A 110 110 THR C C 110 175.477 176.026 -0.549 1
1 1252 . 43 1 1 A 110 110 THR CA C 110 66.443 67.079 -0.636 1
1 1253 . 43 1 1 A 110 110 THR CB C 110 68.091 68.568 -0.477 1
1 1255 . 43 1 1 A 111 111 ASP H H 111 8.224 8.384 -0.160 1
1 1256 . 43 1 1 A 111 111 ASP HA H 111 4.237 4.313 -0.076 1
1 1259 . 43 1 1 A 111 111 ASP C C 111 177.520 178.539 -1.019 1
1 1260 . 43 1 1 A 111 111 ASP CA C 111 57.559 57.345 0.214 1
1 1261 . 43 1 1 A 111 111 ASP CB C 111 40.292 40.451 -0.159 1
1 1262 . 43 1 1 A 111 111 ASP N N 111 119.490 119.968 -0.478 1
1 1263 . 43 1 1 A 112 112 ALA H H 112 7.431 7.891 -0.460 1
1 1264 . 43 1 1 A 112 112 ALA HA H 112 4.191 4.179 0.012 1
1 1268 . 43 1 1 A 112 112 ALA C C 112 180.646 180.239 0.407 1
1 1269 . 43 1 1 A 112 112 ALA CA C 112 54.534 55.388 -0.854 1
1 1270 . 43 1 1 A 112 112 ALA CB C 112 18.992 18.348 0.644 1
1 1271 . 43 1 1 A 112 112 ALA N N 112 119.710 123.163 -3.453 1
1 1272 . 43 1 1 A 113 113 GLN H H 113 7.576 8.323 -0.747 1
1 1273 . 43 1 1 A 113 113 GLN HA H 113 3.562 4.132 -0.570 1
1 1278 . 43 1 1 A 113 113 GLN C C 113 176.756 178.651 -1.895 1
1 1279 . 43 1 1 A 113 113 GLN CA C 113 57.736 58.360 -0.624 1
1 1280 . 43 1 1 A 113 113 GLN CB C 113 29.110 27.979 1.131 1
1 1281 . 43 1 1 A 113 113 GLN N N 113 117.518 116.718 0.800 1
1 1283 . 43 1 1 A 114 114 MET H H 114 8.192 7.729 0.463 1
1 1284 . 43 1 1 A 114 114 MET HA H 114 4.231 4.096 0.135 1
1 1289 . 43 1 1 A 114 114 MET C C 114 175.648 178.217 -2.569 1
1 1290 . 43 1 1 A 114 114 MET CA C 114 57.446 58.283 -0.837 1
1 1291 . 43 1 1 A 114 114 MET CB C 114 33.570 31.997 1.573 1
1 1293 . 43 1 1 A 114 114 MET N N 114 111.509 119.876 -8.367 1
1 1294 . 43 1 1 A 115 115 GLN H H 115 6.940 7.483 -0.543 1
1 1295 . 43 1 1 A 115 115 GLN HA H 115 4.307 4.169 0.138 1
1 1302 . 43 1 1 A 115 115 GLN C C 115 176.270 176.025 0.245 1
1 1303 . 43 1 1 A 115 115 GLN CA C 115 54.680 57.518 -2.838 1
1 1304 . 43 1 1 A 115 115 GLN CB C 115 28.233 28.914 -0.681 1
1 1306 . 43 1 1 A 115 115 GLN N N 115 114.300 115.988 -1.688 1
1 1308 . 43 1 1 A 116 116 TYR H H 116 6.677 7.739 -1.062 1
1 1309 . 43 1 1 A 116 116 TYR HA H 116 4.193 4.252 -0.059 1
1 1312 . 43 1 1 A 116 116 TYR C C 116 175.268 173.325 1.943 1
1 1313 . 43 1 1 A 116 116 TYR CA C 116 54.357 58.443 -4.086 1
1 1314 . 43 1 1 A 116 116 TYR CB C 116 35.498 36.572 -1.074 1
1 1315 . 43 1 1 A 116 116 TYR N N 116 117.919 119.001 -1.082 1
1 1316 . 43 1 1 A 117 117 ASP H H 117 8.081 8.037 0.044 1
1 1317 . 43 1 1 A 117 117 ASP HA H 117 4.665 4.584 0.081 1
1 1320 . 43 1 1 A 117 117 ASP CA C 117 52.422 50.130 2.292 1
1 1321 . 43 1 1 A 117 117 ASP CB C 117 42.416 43.572 -1.156 1
1 1322 . 43 1 1 A 117 117 ASP N N 117 120.887 127.039 -6.152 1
1 1323 . 43 1 1 A 118 118 PRO C C 118 179.180 179.015 0.165 1
1 1324 . 43 1 1 A 118 118 PRO CA C 118 65.942 65.654 0.288 1
1 1325 . 43 1 1 A 118 118 PRO CB C 118 32.197 31.663 0.534 1
1 1326 . 43 1 1 A 119 119 GLY H H 119 9.742 8.463 1.279 1
1 1327 . 43 1 1 A 119 119 GLY C C 119 175.622 174.839 0.783 1
1 1328 . 43 1 1 A 119 119 GLY CA C 119 46.785 46.230 0.555 1
1 1329 . 43 1 1 A 119 119 GLY N N 119 106.412 106.047 0.365 1
1 1330 . 43 1 1 A 120 120 LEU H H 120 6.666 7.294 -0.628 1
1 1331 . 43 1 1 A 120 120 LEU HA H 120 3.365 3.525 -0.160 1
1 1341 . 43 1 1 A 120 120 LEU C C 120 179.262 178.312 0.950 1
1 1342 . 43 1 1 A 120 120 LEU CA C 120 56.605 56.794 -0.189 1
1 1343 . 43 1 1 A 120 120 LEU CB C 120 39.262 41.489 -2.227 1
1 1347 . 43 1 1 A 120 120 LEU N N 120 126.226 121.801 4.425 1
1 1348 . 43 1 1 A 121 121 PHE H H 121 7.356 8.317 -0.961 1
1 1349 . 43 1 1 A 121 121 PHE HA H 121 4.459 3.869 0.590 1
1 1352 . 43 1 1 A 121 121 PHE C C 121 179.716 178.102 1.614 1
1 1353 . 43 1 1 A 121 121 PHE CA C 121 62.838 61.987 0.851 1
1 1354 . 43 1 1 A 121 121 PHE CB C 121 37.603 39.302 -1.699 1
1 1355 . 43 1 1 A 121 121 PHE N N 121 117.437 119.274 -1.837 1
1 1356 . 43 1 1 A 122 122 ALA H H 122 7.926 8.682 -0.756 1
1 1357 . 43 1 1 A 122 122 ALA HA H 122 4.523 3.892 0.631 1
1 1361 . 43 1 1 A 122 122 ALA C C 122 180.435 179.326 1.109 1
1 1362 . 43 1 1 A 122 122 ALA CA C 122 55.527 55.275 0.252 1
1 1363 . 43 1 1 A 122 122 ALA CB C 122 17.814 18.354 -0.540 1
1 1364 . 43 1 1 A 122 122 ALA N N 122 121.068 121.150 -0.082 1
1 1365 . 43 1 1 A 123 123 GLN H H 123 7.507 7.541 -0.034 1
1 1366 . 43 1 1 A 123 123 GLN HA H 123 4.153 3.992 0.161 1
1 1371 . 43 1 1 A 123 123 GLN C C 123 180.561 178.746 1.815 1
1 1372 . 43 1 1 A 123 123 GLN CA C 123 59.948 58.595 1.353 1
1 1373 . 43 1 1 A 123 123 GLN CB C 123 29.135 28.241 0.894 1
1 1375 . 43 1 1 A 123 123 GLN N N 123 120.324 117.391 2.933 1
1 1376 . 43 1 1 A 124 124 ILE H H 124 8.318 7.760 0.558 1
1 1377 . 43 1 1 A 124 124 ILE HA H 124 3.635 3.829 -0.194 1
1 1387 . 43 1 1 A 124 124 ILE C C 124 176.481 178.038 -1.557 1
1 1388 . 43 1 1 A 124 124 ILE CA C 124 66.432 64.023 2.409 1
1 1389 . 43 1 1 A 124 124 ILE CB C 124 39.168 37.565 1.603 1
1 1393 . 43 1 1 A 124 124 ILE N N 124 123.747 117.924 5.823 1
1 1394 . 43 1 1 A 125 125 GLN H H 125 8.474 8.040 0.434 1
1 1395 . 43 1 1 A 125 125 GLN HA H 125 4.264 3.884 0.380 1
1 1402 . 43 1 1 A 125 125 GLN C C 125 178.947 177.769 1.178 1
1 1403 . 43 1 1 A 125 125 GLN CA C 125 59.651 58.449 1.202 1
1 1404 . 43 1 1 A 125 125 GLN CB C 125 28.880 28.449 0.431 1
1 1406 . 43 1 1 A 125 125 GLN N N 125 120.368 121.082 -0.714 1
1 1408 . 43 1 1 A 126 126 ALA H H 126 8.002 7.932 0.070 1
1 1409 . 43 1 1 A 126 126 ALA HA H 126 4.144 4.034 0.110 1
1 1413 . 43 1 1 A 126 126 ALA C C 126 179.316 179.694 -0.378 1
1 1414 . 43 1 1 A 126 126 ALA CA C 126 55.036 54.981 0.055 1
1 1415 . 43 1 1 A 126 126 ALA CB C 126 18.087 17.978 0.109 1
1 1416 . 43 1 1 A 126 126 ALA N N 126 121.661 121.356 0.305 1
1 1417 . 43 1 1 A 127 127 ALA H H 127 7.823 8.019 -0.196 1
1 1418 . 43 1 1 A 127 127 ALA HA H 127 4.162 4.077 0.085 1
1 1422 . 43 1 1 A 127 127 ALA C C 127 180.707 179.525 1.182 1
1 1423 . 43 1 1 A 127 127 ALA CA C 127 55.080 54.737 0.343 1
1 1424 . 43 1 1 A 127 127 ALA CB C 127 19.354 18.346 1.008 1
1 1425 . 43 1 1 A 127 127 ALA N N 127 119.853 119.609 0.244 1
1 1426 . 43 1 1 A 128 128 ALA H H 128 8.936 8.031 0.905 1
1 1427 . 43 1 1 A 128 128 ALA HA H 128 3.928 3.759 0.169 1
1 1431 . 43 1 1 A 128 128 ALA C C 128 181.031 179.285 1.746 1
1 1432 . 43 1 1 A 128 128 ALA CA C 128 55.502 54.617 0.885 1
1 1433 . 43 1 1 A 128 128 ALA CB C 128 16.609 17.769 -1.160 1
1 1434 . 43 1 1 A 128 128 ALA N N 128 121.355 120.512 0.843 1
1 1435 . 43 1 1 A 129 129 THR H H 129 8.543 7.936 0.607 1
1 1436 . 43 1 1 A 129 129 THR HA H 129 4.015 3.707 0.308 1
1 1441 . 43 1 1 A 129 129 THR C C 129 177.332 176.416 0.916 1
1 1442 . 43 1 1 A 129 129 THR CA C 129 65.893 65.615 0.278 1
1 1443 . 43 1 1 A 129 129 THR CB C 129 68.566 68.208 0.358 1
1 1445 . 43 1 1 A 129 129 THR N N 129 112.709 111.244 1.465 1
1 1446 . 43 1 1 A 130 130 LYS H H 130 8.126 7.283 0.843 1
1 1447 . 43 1 1 A 130 130 LYS HA H 130 4.000 4.033 -0.033 1
1 1456 . 43 1 1 A 130 130 LYS C C 130 179.082 178.712 0.370 1
1 1457 . 43 1 1 A 130 130 LYS CA C 130 60.299 58.478 1.821 1
1 1458 . 43 1 1 A 130 130 LYS CB C 130 32.767 31.757 1.010 1
1 1462 . 43 1 1 A 130 130 LYS N N 130 123.879 121.998 1.881 1
1 1463 . 43 1 1 A 131 131 ALA H H 131 7.184 7.743 -0.559 1
1 1464 . 43 1 1 A 131 131 ALA HA H 131 4.005 4.305 -0.300 1
1 1468 . 43 1 1 A 131 131 ALA C C 131 178.482 179.473 -0.991 1
1 1469 . 43 1 1 A 131 131 ALA CA C 131 55.027 55.064 -0.037 1
1 1470 . 43 1 1 A 131 131 ALA CB C 131 18.669 19.609 -0.940 1
1 1471 . 43 1 1 A 131 131 ALA N N 131 118.590 121.178 -2.588 1
1 1472 . 43 1 1 A 132 132 TRP H H 132 7.977 8.723 -0.746 1
1 1473 . 43 1 1 A 132 132 TRP HA H 132 4.001 4.254 -0.253 1
1 1480 . 43 1 1 A 132 132 TRP C C 132 177.332 175.817 1.515 1
1 1481 . 43 1 1 A 132 132 TRP CA C 132 60.431 57.392 3.039 1
1 1482 . 43 1 1 A 132 132 TRP CB C 132 27.786 27.585 0.201 1
1 1486 . 43 1 1 A 132 132 TRP N N 132 119.168 117.034 2.134 1
1 1488 . 43 1 1 A 133 133 ARG H H 133 8.006 8.043 -0.037 1
1 1489 . 43 1 1 A 133 133 ARG HA H 133 4.027 4.473 -0.446 1
1 1497 . 43 1 1 A 133 133 ARG C C 133 176.664 177.698 -1.034 1
1 1498 . 43 1 1 A 133 133 ARG CA C 133 59.355 57.263 2.092 1
1 1499 . 43 1 1 A 133 133 ARG CB C 133 30.451 32.374 -1.923 1
1 1502 . 43 1 1 A 133 133 ARG N N 133 113.062 120.724 -7.662 1
1 1504 . 43 1 1 A 134 134 LYS H H 134 7.322 7.620 -0.298 1
1 1505 . 43 1 1 A 134 134 LYS HA H 134 4.313 4.432 -0.119 1
1 1514 . 43 1 1 A 134 134 LYS C C 134 176.282 176.412 -0.130 1
1 1515 . 43 1 1 A 134 134 LYS CA C 134 54.922 56.420 -1.498 1
1 1516 . 43 1 1 A 134 134 LYS CB C 134 32.633 31.690 0.943 1
1 1520 . 43 1 1 A 134 134 LYS N N 134 118.170 117.948 0.222 1
1 1521 . 43 1 1 A 135 135 LEU H H 135 7.440 7.854 -0.414 1
1 1522 . 43 1 1 A 135 135 LEU HA H 135 4.174 4.582 -0.408 1
1 1532 . 43 1 1 A 135 135 LEU CA C 135 54.408 52.945 1.463 1
1 1533 . 43 1 1 A 135 135 LEU CB C 135 40.407 41.326 -0.919 1
1 1537 . 43 1 1 A 135 135 LEU N N 135 123.358 121.692 1.666 1
1 1538 . 43 1 1 A 136 136 PRO HA H 136 4.437 4.564 -0.127 1
1 1545 . 43 1 1 A 136 136 PRO C C 136 177.106 176.253 0.853 1
1 1546 . 43 1 1 A 136 136 PRO CA C 136 62.889 62.434 0.455 1
1 1547 . 43 1 1 A 136 136 PRO CB C 136 32.192 32.219 -0.027 1
1 1550 . 43 1 1 A 137 137 VAL H H 137 8.219 8.310 -0.091 1
1 1551 . 43 1 1 A 137 137 VAL HA H 137 4.077 4.255 -0.178 1
1 1559 . 43 1 1 A 137 137 VAL C C 137 176.305 176.073 0.232 1
1 1560 . 43 1 1 A 137 137 VAL CA C 137 61.958 62.134 -0.176 1
1 1561 . 43 1 1 A 137 137 VAL CB C 137 32.755 32.714 0.041 1
1 1564 . 43 1 1 A 137 137 VAL N N 137 120.079 121.518 -1.439 1
1 1565 . 43 1 1 A 138 138 LYS H H 138 8.444 8.318 0.126 1
1 1566 . 43 1 1 A 138 138 LYS HA H 138 4.316 4.556 -0.240 1
1 1575 . 43 1 1 A 138 138 LYS C C 138 176.790 176.708 0.082 1
1 1576 . 43 1 1 A 138 138 LYS CA C 138 56.792 55.369 1.423 1
1 1577 . 43 1 1 A 138 138 LYS CB C 138 33.205 33.981 -0.776 1
1 1581 . 43 1 1 A 138 138 LYS N N 138 126.449 125.653 0.796 1
1 1582 . 43 1 1 A 139 139 GLY H H 139 8.518 8.583 -0.065 1
1 1583 . 43 1 1 A 139 139 GLY HA2 H 139 4.070 3.993 0.077 1
1 1584 . 43 1 1 A 139 139 GLY HA3 H 139 3.897 4.004 -0.107 1
1 1585 . 43 1 1 A 139 139 GLY C C 139 172.874 174.001 -1.127 1
1 1586 . 43 1 1 A 139 139 GLY CA C 139 45.157 45.990 -0.833 1
1 1587 . 43 1 1 A 139 139 GLY N N 139 112.617 109.307 3.310 1
1 6 . 44 1 1 A 2 2 VAL H H 2 8.992 8.375 0.617 1
1 7 . 44 1 1 A 2 2 VAL HA H 2 5.370 4.882 0.488 1
1 15 . 44 1 1 A 2 2 VAL C C 2 174.325 174.087 0.238 1
1 16 . 44 1 1 A 2 2 VAL CA C 2 61.267 60.654 0.613 1
1 17 . 44 1 1 A 2 2 VAL CB C 2 33.890 35.928 -2.038 1
1 20 . 44 1 1 A 2 2 VAL N N 2 126.939 118.876 8.063 1
1 21 . 44 1 1 A 3 3 THR H H 3 8.912 8.860 0.052 1
1 22 . 44 1 1 A 3 3 THR HA H 3 4.505 5.336 -0.831 1
1 27 . 44 1 1 A 3 3 THR C C 3 172.710 172.639 0.071 1
1 28 . 44 1 1 A 3 3 THR CA C 3 59.689 59.826 -0.137 1
1 29 . 44 1 1 A 3 3 THR CB C 3 72.398 71.967 0.431 1
1 31 . 44 1 1 A 3 3 THR N N 3 118.091 121.974 -3.883 1
1 32 . 44 1 1 A 4 4 GLU H H 4 8.631 9.026 -0.395 1
1 33 . 44 1 1 A 4 4 GLU HA H 4 5.788 5.017 0.771 1
1 38 . 44 1 1 A 4 4 GLU C C 4 175.758 174.154 1.604 1
1 39 . 44 1 1 A 4 4 GLU CA C 4 54.902 54.523 0.379 1
1 40 . 44 1 1 A 4 4 GLU CB C 4 35.097 33.248 1.849 1
1 42 . 44 1 1 A 4 4 GLU N N 4 120.966 124.707 -3.741 1
1 43 . 44 1 1 A 5 5 THR H H 5 9.188 9.186 0.002 1
1 44 . 44 1 1 A 5 5 THR HA H 5 4.739 5.205 -0.466 1
1 49 . 44 1 1 A 5 5 THR C C 5 172.757 172.772 -0.015 1
1 50 . 44 1 1 A 5 5 THR CA C 5 60.382 59.519 0.863 1
1 51 . 44 1 1 A 5 5 THR CB C 5 71.558 72.209 -0.651 1
1 53 . 44 1 1 A 5 5 THR N N 5 119.366 117.305 2.061 1
1 54 . 44 1 1 A 6 6 VAL H H 6 8.476 8.809 -0.333 1
1 55 . 44 1 1 A 6 6 VAL HA H 6 5.026 5.244 -0.218 1
1 63 . 44 1 1 A 6 6 VAL C C 6 176.674 174.919 1.755 1
1 64 . 44 1 1 A 6 6 VAL CA C 6 61.008 61.008 0.000 1
1 65 . 44 1 1 A 6 6 VAL CB C 6 33.861 34.879 -1.018 1
1 68 . 44 1 1 A 6 6 VAL N N 6 121.384 123.155 -1.771 1
1 69 . 44 1 1 A 7 7 ASP H H 7 8.848 8.711 0.137 1
1 70 . 44 1 1 A 7 7 ASP HA H 7 4.797 4.899 -0.102 1
1 73 . 44 1 1 A 7 7 ASP CA C 7 52.834 54.659 -1.825 1
1 74 . 44 1 1 A 7 7 ASP CB C 7 42.219 42.257 -0.038 1
1 75 . 44 1 1 A 7 7 ASP N N 7 127.061 127.076 -0.015 1
1 76 . 44 1 1 A 8 8 GLY C C 8 175.143 176.400 -1.257 1
1 77 . 44 1 1 A 8 8 GLY CA C 8 46.553 47.414 -0.861 1
1 78 . 44 1 1 A 9 9 GLN H H 9 8.408 7.404 1.004 1
1 79 . 44 1 1 A 9 9 GLN HA H 9 4.541 4.458 0.083 1
1 86 . 44 1 1 A 9 9 GLN C C 9 176.463 176.202 0.261 1
1 87 . 44 1 1 A 9 9 GLN CA C 9 55.167 55.543 -0.376 1
1 88 . 44 1 1 A 9 9 GLN CB C 9 29.376 29.169 0.207 1
1 90 . 44 1 1 A 9 9 GLN N N 9 118.300 121.501 -3.201 1
1 92 . 44 1 1 A 10 10 GLY H H 10 8.162 7.910 0.252 1
1 93 . 44 1 1 A 10 10 GLY HA2 H 10 4.174 4.097 0.077 1
1 94 . 44 1 1 A 10 10 GLY HA3 H 10 3.521 4.111 -0.590 1
1 95 . 44 1 1 A 10 10 GLY C C 10 174.092 174.186 -0.094 1
1 96 . 44 1 1 A 10 10 GLY CA C 10 45.558 45.682 -0.124 1
1 97 . 44 1 1 A 10 10 GLY N N 10 108.747 109.690 -0.943 1
1 98 . 44 1 1 A 11 11 GLN H H 11 8.507 7.647 0.860 1
1 99 . 44 1 1 A 11 11 GLN HA H 11 4.202 4.425 -0.223 1
1 106 . 44 1 1 A 11 11 GLN C C 11 173.992 175.023 -1.031 1
1 107 . 44 1 1 A 11 11 GLN CA C 11 55.098 55.559 -0.461 1
1 108 . 44 1 1 A 11 11 GLN CB C 11 29.097 29.335 -0.238 1
1 110 . 44 1 1 A 11 11 GLN N N 11 122.979 119.062 3.917 1
1 112 . 44 1 1 A 12 12 ALA H H 12 8.259 8.784 -0.525 1
1 113 . 44 1 1 A 12 12 ALA HA H 12 5.156 6.081 -0.925 1
1 117 . 44 1 1 A 12 12 ALA C C 12 177.284 176.248 1.036 1
1 118 . 44 1 1 A 12 12 ALA CA C 12 51.087 50.417 0.670 1
1 119 . 44 1 1 A 12 12 ALA CB C 12 20.500 22.064 -1.564 1
1 120 . 44 1 1 A 12 12 ALA N N 12 127.100 125.317 1.783 1
1 121 . 44 1 1 A 13 13 TRP H H 13 9.245 9.253 -0.008 1
1 122 . 44 1 1 A 13 13 TRP HA H 13 4.717 5.445 -0.728 1
1 131 . 44 1 1 A 13 13 TRP C C 13 175.108 174.278 0.830 1
1 132 . 44 1 1 A 13 13 TRP CA C 13 55.966 55.525 0.441 1
1 133 . 44 1 1 A 13 13 TRP CB C 13 31.912 32.093 -0.181 1
1 139 . 44 1 1 A 13 13 TRP N N 13 123.088 118.965 4.123 1
1 141 . 44 1 1 A 14 14 ARG H H 14 8.575 8.766 -0.191 1
1 142 . 44 1 1 A 14 14 ARG HA H 14 5.335 4.512 0.823 1
1 150 . 44 1 1 A 14 14 ARG C C 14 175.191 174.105 1.086 1
1 151 . 44 1 1 A 14 14 ARG CA C 14 53.106 55.192 -2.086 1
1 152 . 44 1 1 A 14 14 ARG CB C 14 32.749 31.483 1.266 1
1 154 . 44 1 1 A 14 14 ARG N N 14 121.163 120.455 0.708 1
1 156 . 44 1 1 A 15 15 HIS H H 15 8.595 8.063 0.532 1
1 157 . 44 1 1 A 15 15 HIS HA H 15 4.790 5.132 -0.342 1
1 161 . 44 1 1 A 15 15 HIS C C 15 173.770 174.088 -0.318 1
1 162 . 44 1 1 A 15 15 HIS CA C 15 55.289 54.719 0.570 1
1 163 . 44 1 1 A 15 15 HIS CB C 15 33.208 33.263 -0.055 1
1 165 . 44 1 1 A 15 15 HIS N N 15 117.643 118.867 -1.224 1
1 166 . 44 1 1 A 16 16 HIS H H 16 8.993 8.650 0.343 1
1 167 . 44 1 1 A 16 16 HIS HA H 16 5.158 4.979 0.179 1
1 171 . 44 1 1 A 16 16 HIS C C 16 173.608 174.410 -0.802 1
1 172 . 44 1 1 A 16 16 HIS CA C 16 56.450 54.761 1.689 1
1 173 . 44 1 1 A 16 16 HIS CB C 16 34.171 30.734 3.437 1
1 175 . 44 1 1 A 16 16 HIS N N 16 123.520 119.451 4.069 1
1 176 . 44 1 1 A 17 17 ASN H H 17 7.829 8.816 -0.987 1
1 177 . 44 1 1 A 17 17 ASN HA H 17 4.713 5.087 -0.374 1
1 182 . 44 1 1 A 17 17 ASN C C 17 173.682 173.455 0.227 1
1 183 . 44 1 1 A 17 17 ASN CA C 17 51.822 52.903 -1.081 1
1 184 . 44 1 1 A 17 17 ASN CB C 17 43.176 41.860 1.316 1
1 185 . 44 1 1 A 17 17 ASN N N 17 122.213 121.214 0.999 1
1 187 . 44 1 1 A 18 18 GLY H H 18 8.423 8.430 -0.007 1
1 188 . 44 1 1 A 18 18 GLY HA2 H 18 3.931 3.943 -0.012 1
1 189 . 44 1 1 A 18 18 GLY HA3 H 18 3.707 4.041 -0.334 1
1 190 . 44 1 1 A 18 18 GLY C C 18 173.985 173.948 0.037 1
1 191 . 44 1 1 A 18 18 GLY CA C 18 43.949 45.066 -1.117 1
1 192 . 44 1 1 A 18 18 GLY N N 18 106.991 109.091 -2.100 1
1 193 . 44 1 1 A 19 19 PHE H H 19 8.338 7.745 0.593 1
1 194 . 44 1 1 A 19 19 PHE HA H 19 4.068 4.892 -0.824 1
1 197 . 44 1 1 A 19 19 PHE C C 19 176.568 174.558 2.010 1
1 198 . 44 1 1 A 19 19 PHE CA C 19 59.338 56.552 2.786 1
1 199 . 44 1 1 A 19 19 PHE CB C 19 40.201 37.757 2.444 1
1 200 . 44 1 1 A 19 19 PHE N N 19 116.857 119.006 -2.149 1
1 201 . 44 1 1 A 20 20 ASP H H 20 8.794 8.743 0.051 1
1 202 . 44 1 1 A 20 20 ASP HA H 20 4.485 4.914 -0.429 1
1 205 . 44 1 1 A 20 20 ASP C C 20 177.379 177.230 0.149 1
1 206 . 44 1 1 A 20 20 ASP CA C 20 54.140 54.750 -0.610 1
1 207 . 44 1 1 A 20 20 ASP CB C 20 41.915 41.148 0.767 1
1 208 . 44 1 1 A 20 20 ASP N N 20 123.025 123.787 -0.762 1
1 209 . 44 1 1 A 21 21 PHE H H 21 8.862 9.046 -0.184 1
1 210 . 44 1 1 A 21 21 PHE HA H 21 4.087 4.104 -0.017 1
1 218 . 44 1 1 A 21 21 PHE C C 21 176.952 177.304 -0.352 1
1 219 . 44 1 1 A 21 21 PHE CA C 21 61.095 62.478 -1.383 1
1 220 . 44 1 1 A 21 21 PHE CB C 21 38.678 39.382 -0.704 1
1 226 . 44 1 1 A 21 21 PHE N N 21 127.163 125.517 1.646 1
1 227 . 44 1 1 A 22 22 ALA H H 22 8.561 8.370 0.191 1
1 228 . 44 1 1 A 22 22 ALA HA H 22 3.878 4.064 -0.186 1
1 232 . 44 1 1 A 22 22 ALA C C 22 180.710 180.050 0.660 1
1 233 . 44 1 1 A 22 22 ALA CA C 22 55.211 55.277 -0.066 1
1 234 . 44 1 1 A 22 22 ALA CB C 22 18.321 18.417 -0.096 1
1 235 . 44 1 1 A 22 22 ALA N N 22 120.293 121.238 -0.945 1
1 236 . 44 1 1 A 23 23 VAL H H 23 7.241 7.735 -0.494 1
1 237 . 44 1 1 A 23 23 VAL HA H 23 3.684 3.519 0.165 1
1 245 . 44 1 1 A 23 23 VAL C C 23 177.101 178.195 -1.094 1
1 246 . 44 1 1 A 23 23 VAL CA C 23 65.237 66.952 -1.715 1
1 247 . 44 1 1 A 23 23 VAL CB C 23 31.780 31.634 0.146 1
1 250 . 44 1 1 A 23 23 VAL N N 23 118.775 117.676 1.099 1
1 251 . 44 1 1 A 24 24 ILE H H 24 6.761 8.256 -1.495 1
1 252 . 44 1 1 A 24 24 ILE HA H 24 3.196 3.553 -0.357 1
1 262 . 44 1 1 A 24 24 ILE C C 24 177.287 177.968 -0.681 1
1 263 . 44 1 1 A 24 24 ILE CA C 24 63.404 65.319 -1.915 1
1 264 . 44 1 1 A 24 24 ILE CB C 24 36.294 37.327 -1.033 1
1 268 . 44 1 1 A 24 24 ILE N N 24 119.036 118.994 0.042 1
1 269 . 44 1 1 A 25 25 LYS H H 25 8.032 8.081 -0.049 1
1 270 . 44 1 1 A 25 25 LYS HA H 25 3.809 3.761 0.048 1
1 279 . 44 1 1 A 25 25 LYS C C 25 179.450 178.787 0.663 1
1 280 . 44 1 1 A 25 25 LYS CA C 25 59.621 59.590 0.031 1
1 281 . 44 1 1 A 25 25 LYS CB C 25 32.259 31.964 0.295 1
1 285 . 44 1 1 A 25 25 LYS N N 25 118.368 120.393 -2.025 1
1 286 . 44 1 1 A 26 26 GLU H H 26 7.845 8.347 -0.502 1
1 287 . 44 1 1 A 26 26 GLU HA H 26 4.021 4.148 -0.127 1
1 292 . 44 1 1 A 26 26 GLU C C 26 179.191 178.705 0.486 1
1 293 . 44 1 1 A 26 26 GLU CA C 26 59.530 58.965 0.565 1
1 294 . 44 1 1 A 26 26 GLU CB C 26 29.449 29.399 0.050 1
1 296 . 44 1 1 A 26 26 GLU N N 26 120.522 118.957 1.565 1
1 297 . 44 1 1 A 27 27 LEU H H 27 8.165 7.926 0.239 1
1 298 . 44 1 1 A 27 27 LEU HA H 27 4.163 4.133 0.030 1
1 308 . 44 1 1 A 27 27 LEU C C 27 177.256 178.316 -1.060 1
1 309 . 44 1 1 A 27 27 LEU CA C 27 58.049 57.461 0.588 1
1 310 . 44 1 1 A 27 27 LEU CB C 27 41.365 41.163 0.202 1
1 314 . 44 1 1 A 27 27 LEU N N 27 120.879 120.899 -0.020 1
1 315 . 44 1 1 A 28 28 LYS H H 28 8.902 7.769 1.133 1
1 316 . 44 1 1 A 28 28 LYS HA H 28 4.199 4.597 -0.398 1
1 317 . 44 1 1 A 28 28 LYS C C 28 179.707 179.442 0.265 1
1 318 . 44 1 1 A 28 28 LYS CA C 28 60.097 59.065 1.032 1
1 319 . 44 1 1 A 28 28 LYS CB C 28 33.420 31.729 1.691 1
1 320 . 44 1 1 A 28 28 LYS N N 28 120.050 119.591 0.459 1
1 321 . 44 1 1 A 29 29 THR H H 29 8.294 8.392 -0.098 1
1 322 . 44 1 1 A 29 29 THR HA H 29 3.892 3.947 -0.055 1
1 327 . 44 1 1 A 29 29 THR C C 29 175.711 176.333 -0.622 1
1 328 . 44 1 1 A 29 29 THR CA C 29 66.846 66.448 0.398 1
1 329 . 44 1 1 A 29 29 THR CB C 29 68.794 68.753 0.041 1
1 331 . 44 1 1 A 29 29 THR N N 29 115.933 116.904 -0.971 1
1 332 . 44 1 1 A 30 30 ALA H H 30 8.244 8.797 -0.553 1
1 333 . 44 1 1 A 30 30 ALA HA H 30 4.241 4.258 -0.017 1
1 337 . 44 1 1 A 30 30 ALA C C 30 179.128 179.570 -0.442 1
1 338 . 44 1 1 A 30 30 ALA CA C 30 55.714 55.636 0.078 1
1 339 . 44 1 1 A 30 30 ALA CB C 30 18.955 18.288 0.667 1
1 340 . 44 1 1 A 30 30 ALA N N 30 124.617 123.182 1.435 1
1 341 . 44 1 1 A 31 31 ALA H H 31 8.968 8.429 0.539 1
1 342 . 44 1 1 A 31 31 ALA HA H 31 3.890 4.022 -0.132 1
1 346 . 44 1 1 A 31 31 ALA C C 31 180.352 179.337 1.015 1
1 347 . 44 1 1 A 31 31 ALA CA C 31 55.454 55.504 -0.050 1
1 348 . 44 1 1 A 31 31 ALA CB C 31 17.124 18.640 -1.516 1
1 349 . 44 1 1 A 31 31 ALA N N 31 119.327 120.507 -1.180 1
1 350 . 44 1 1 A 32 32 SER H H 32 7.995 7.896 0.099 1
1 351 . 44 1 1 A 32 32 SER HA H 32 4.238 4.280 -0.042 1
1 354 . 44 1 1 A 32 32 SER C C 32 175.612 176.249 -0.637 1
1 355 . 44 1 1 A 32 32 SER CA C 32 61.203 61.691 -0.488 1
1 356 . 44 1 1 A 32 32 SER CB C 32 63.406 63.341 0.065 1
1 357 . 44 1 1 A 32 32 SER N N 32 111.962 113.646 -1.684 1
1 358 . 44 1 1 A 33 33 GLN H H 33 8.333 7.970 0.363 1
1 359 . 44 1 1 A 33 33 GLN HA H 33 3.992 4.180 -0.188 1
1 366 . 44 1 1 A 33 33 GLN C C 33 177.486 177.541 -0.055 1
1 367 . 44 1 1 A 33 33 GLN CA C 33 58.277 58.381 -0.104 1
1 368 . 44 1 1 A 33 33 GLN CB C 33 29.140 29.499 -0.359 1
1 370 . 44 1 1 A 33 33 GLN N N 33 119.527 120.690 -1.163 1
1 372 . 44 1 1 A 34 34 TYR H H 34 8.587 8.321 0.266 1
1 373 . 44 1 1 A 34 34 TYR HA H 34 4.792 4.584 0.208 1
1 380 . 44 1 1 A 34 34 TYR C C 34 176.499 176.812 -0.313 1
1 381 . 44 1 1 A 34 34 TYR CA C 34 57.711 59.134 -1.423 1
1 382 . 44 1 1 A 34 34 TYR CB C 34 39.561 39.244 0.317 1
1 387 . 44 1 1 A 34 34 TYR N N 34 114.610 114.775 -0.165 1
1 388 . 44 1 1 A 35 35 GLY H H 35 7.346 8.404 -1.058 1
1 389 . 44 1 1 A 35 35 GLY HA2 H 35 4.785 4.106 0.679 1
1 390 . 44 1 1 A 35 35 GLY HA3 H 35 4.007 4.109 -0.102 1
1 391 . 44 1 1 A 35 35 GLY C C 35 175.796 173.058 2.738 1
1 392 . 44 1 1 A 35 35 GLY CA C 35 44.355 44.901 -0.546 1
1 393 . 44 1 1 A 35 35 GLY N N 35 108.501 106.517 1.984 1
1 394 . 44 1 1 A 36 36 ALA H H 36 9.363 8.258 1.105 1
1 395 . 44 1 1 A 36 36 ALA HA H 36 4.217 4.702 -0.485 1
1 399 . 44 1 1 A 36 36 ALA C C 36 178.039 177.167 0.872 1
1 400 . 44 1 1 A 36 36 ALA CA C 36 56.114 51.684 4.430 1
1 401 . 44 1 1 A 36 36 ALA CB C 36 19.179 19.336 -0.157 1
1 402 . 44 1 1 A 36 36 ALA N N 36 125.811 122.888 2.923 1
1 403 . 44 1 1 A 37 37 THR H H 37 8.070 8.599 -0.529 1
1 404 . 44 1 1 A 37 37 THR HA H 37 4.570 4.555 0.015 1
1 409 . 44 1 1 A 37 37 THR C C 37 173.685 174.637 -0.952 1
1 410 . 44 1 1 A 37 37 THR CA C 37 59.822 62.431 -2.609 1
1 411 . 44 1 1 A 37 37 THR CB C 37 68.267 70.855 -2.588 1
1 413 . 44 1 1 A 37 37 THR N N 37 129.410 113.956 15.454 1
1 414 . 44 1 1 A 38 38 ALA H H 38 6.853 7.405 -0.552 1
1 415 . 44 1 1 A 38 38 ALA HA H 38 4.601 4.587 0.014 1
1 419 . 44 1 1 A 38 38 ALA CA C 38 50.758 50.673 0.085 1
1 420 . 44 1 1 A 38 38 ALA CB C 38 18.325 19.762 -1.437 1
1 421 . 44 1 1 A 38 38 ALA N N 38 124.674 125.474 -0.800 1
1 422 . 44 1 1 A 40 40 TYR HA H 40 4.032 4.009 0.023 1
1 429 . 44 1 1 A 40 40 TYR C C 40 176.456 177.495 -1.039 1
1 430 . 44 1 1 A 40 40 TYR CA C 40 61.010 61.884 -0.874 1
1 431 . 44 1 1 A 40 40 TYR CB C 40 39.286 38.808 0.478 1
1 436 . 44 1 1 A 41 41 THR H H 41 6.874 7.903 -1.029 1
1 437 . 44 1 1 A 41 41 THR HA H 41 3.616 3.674 -0.058 1
1 442 . 44 1 1 A 41 41 THR C C 41 176.930 176.554 0.376 1
1 443 . 44 1 1 A 41 41 THR CA C 41 65.557 65.429 0.128 1
1 444 . 44 1 1 A 41 41 THR CB C 41 68.228 69.036 -0.808 1
1 446 . 44 1 1 A 41 41 THR N N 41 115.143 113.837 1.306 1
1 447 . 44 1 1 A 42 42 LEU H H 42 8.623 7.308 1.315 1
1 448 . 44 1 1 A 42 42 LEU HA H 42 3.708 4.013 -0.305 1
1 458 . 44 1 1 A 42 42 LEU C C 42 178.206 179.167 -0.961 1
1 459 . 44 1 1 A 42 42 LEU CA C 42 57.417 57.780 -0.363 1
1 460 . 44 1 1 A 42 42 LEU CB C 42 41.342 41.198 0.144 1
1 464 . 44 1 1 A 42 42 LEU N N 42 120.418 119.171 1.247 1
1 465 . 44 1 1 A 43 43 ALA H H 43 7.735 7.964 -0.229 1
1 466 . 44 1 1 A 43 43 ALA HA H 43 4.020 3.958 0.062 1
1 470 . 44 1 1 A 43 43 ALA C C 43 180.826 180.381 0.445 1
1 471 . 44 1 1 A 43 43 ALA CA C 43 54.925 55.061 -0.136 1
1 472 . 44 1 1 A 43 43 ALA CB C 43 17.506 18.184 -0.678 1
1 473 . 44 1 1 A 43 43 ALA N N 43 120.203 121.821 -1.618 1
1 474 . 44 1 1 A 44 44 ILE H H 44 7.149 7.322 -0.173 1
1 475 . 44 1 1 A 44 44 ILE HA H 44 3.603 3.555 0.048 1
1 485 . 44 1 1 A 44 44 ILE C C 44 178.594 177.797 0.797 1
1 486 . 44 1 1 A 44 44 ILE CA C 44 64.782 64.630 0.152 1
1 487 . 44 1 1 A 44 44 ILE CB C 44 37.472 37.623 -0.151 1
1 491 . 44 1 1 A 44 44 ILE N N 44 118.881 119.510 -0.629 1
1 492 . 44 1 1 A 45 45 VAL H H 45 7.968 7.660 0.308 1
1 493 . 44 1 1 A 45 45 VAL HA H 45 2.925 3.314 -0.389 1
1 501 . 44 1 1 A 45 45 VAL C C 45 177.023 177.920 -0.897 1
1 502 . 44 1 1 A 45 45 VAL CA C 45 67.081 67.055 0.026 1
1 503 . 44 1 1 A 45 45 VAL CB C 45 30.854 31.201 -0.347 1
1 506 . 44 1 1 A 45 45 VAL N N 45 120.764 119.955 0.809 1
1 507 . 44 1 1 A 46 46 GLU H H 46 8.399 8.429 -0.030 1
1 508 . 44 1 1 A 46 46 GLU HA H 46 3.848 3.897 -0.049 1
1 513 . 44 1 1 A 46 46 GLU C C 46 178.656 177.903 0.753 1
1 514 . 44 1 1 A 46 46 GLU CA C 46 59.491 58.935 0.556 1
1 515 . 44 1 1 A 46 46 GLU CB C 46 28.991 28.694 0.297 1
1 517 . 44 1 1 A 46 46 GLU N N 46 116.599 119.591 -2.992 1
1 518 . 44 1 1 A 47 47 SER H H 47 7.273 7.679 -0.406 1
1 519 . 44 1 1 A 47 47 SER HA H 47 4.287 4.268 0.019 1
1 521 . 44 1 1 A 47 47 SER CA C 47 61.047 61.369 -0.322 1
1 522 . 44 1 1 A 47 47 SER CB C 47 63.016 63.240 -0.224 1
1 523 . 44 1 1 A 47 47 SER N N 47 113.609 117.519 -3.910 1
1 524 . 44 1 1 A 48 48 VAL H H 48 8.006 7.710 0.296 1
1 525 . 44 1 1 A 48 48 VAL HA H 48 3.556 3.657 -0.101 1
1 533 . 44 1 1 A 48 48 VAL C C 48 177.257 176.693 0.564 1
1 534 . 44 1 1 A 48 48 VAL CA C 48 65.025 65.916 -0.891 1
1 535 . 44 1 1 A 48 48 VAL CB C 48 31.841 31.103 0.738 1
1 538 . 44 1 1 A 48 48 VAL N N 48 122.327 121.190 1.137 1
1 539 . 44 1 1 A 49 49 ALA H H 49 8.369 7.760 0.609 1
1 540 . 44 1 1 A 49 49 ALA HA H 49 4.115 4.209 -0.094 1
1 544 . 44 1 1 A 49 49 ALA C C 49 177.307 177.693 -0.386 1
1 545 . 44 1 1 A 49 49 ALA CA C 49 53.253 52.819 0.434 1
1 546 . 44 1 1 A 49 49 ALA CB C 49 20.131 18.526 1.605 1
1 547 . 44 1 1 A 49 49 ALA N N 49 118.050 120.547 -2.497 1
1 548 . 44 1 1 A 50 50 ASP H H 50 7.052 7.838 -0.786 1
1 549 . 44 1 1 A 50 50 ASP HA H 50 4.788 4.514 0.274 1
1 552 . 44 1 1 A 50 50 ASP C C 50 175.481 175.736 -0.255 1
1 553 . 44 1 1 A 50 50 ASP CA C 50 53.681 56.017 -2.336 1
1 554 . 44 1 1 A 50 50 ASP CB C 50 39.333 40.728 -1.395 1
1 555 . 44 1 1 A 50 50 ASP N N 50 116.997 117.773 -0.776 1
1 556 . 44 1 1 A 51 51 ASN H H 51 8.535 7.314 1.221 1
1 557 . 44 1 1 A 51 51 ASN HA H 51 4.628 4.899 -0.271 1
1 562 . 44 1 1 A 51 51 ASN C C 51 174.077 174.967 -0.890 1
1 563 . 44 1 1 A 51 51 ASN CA C 51 52.315 50.950 1.365 1
1 564 . 44 1 1 A 51 51 ASN CB C 51 41.928 40.130 1.798 1
1 565 . 44 1 1 A 51 51 ASN N N 51 118.626 114.085 4.541 1
1 567 . 44 1 1 A 52 52 TRP H H 52 8.555 8.431 0.124 1
1 574 . 44 1 1 A 52 52 TRP C C 52 173.269 176.466 -3.197 1
1 575 . 44 1 1 A 52 52 TRP CA C 52 55.031 58.215 -3.184 1
1 576 . 44 1 1 A 52 52 TRP CB C 52 26.801 29.394 -2.593 1
1 582 . 44 1 1 A 52 52 TRP N N 52 120.693 121.525 -0.832 1
1 584 . 44 1 1 A 53 53 LEU H H 53 7.847 8.916 -1.069 1
1 585 . 44 1 1 A 53 53 LEU HA H 53 4.859 4.965 -0.106 1
1 595 . 44 1 1 A 53 53 LEU C C 53 177.397 175.780 1.617 1
1 596 . 44 1 1 A 53 53 LEU CA C 53 53.619 53.537 0.082 1
1 597 . 44 1 1 A 53 53 LEU CB C 53 41.812 45.111 -3.299 1
1 601 . 44 1 1 A 53 53 LEU N N 53 124.741 124.997 -0.256 1
1 602 . 44 1 1 A 54 54 THR H H 54 8.850 8.698 0.152 1
1 603 . 44 1 1 A 54 54 THR HA H 54 4.598 4.737 -0.139 1
1 608 . 44 1 1 A 54 54 THR CA C 54 60.531 58.334 2.197 1
1 609 . 44 1 1 A 54 54 THR CB C 54 67.183 69.619 -2.436 1
1 611 . 44 1 1 A 54 54 THR N N 54 113.407 114.350 -0.943 1
1 612 . 44 1 1 A 55 55 PRO HA H 55 4.511 4.331 0.180 1
1 619 . 44 1 1 A 55 55 PRO C C 55 179.383 178.818 0.565 1
1 620 . 44 1 1 A 55 55 PRO CA C 55 67.159 65.678 1.481 1
1 621 . 44 1 1 A 55 55 PRO CB C 55 32.095 31.971 0.124 1
1 622 . 44 1 1 A 56 56 THR H H 56 8.575 7.800 0.775 1
1 623 . 44 1 1 A 56 56 THR HA H 56 4.229 4.077 0.152 1
1 628 . 44 1 1 A 56 56 THR C C 56 176.668 176.462 0.206 1
1 629 . 44 1 1 A 56 56 THR CA C 56 66.943 65.643 1.300 1
1 630 . 44 1 1 A 56 56 THR CB C 56 68.129 68.768 -0.639 1
1 632 . 44 1 1 A 56 56 THR N N 56 114.855 110.258 4.597 1
1 633 . 44 1 1 A 57 57 ASP H H 57 8.730 8.364 0.366 1
1 634 . 44 1 1 A 57 57 ASP HA H 57 4.425 4.647 -0.222 1
1 637 . 44 1 1 A 57 57 ASP C C 57 178.351 178.874 -0.523 1
1 638 . 44 1 1 A 57 57 ASP CA C 57 57.963 56.904 1.059 1
1 639 . 44 1 1 A 57 57 ASP CB C 57 40.134 39.924 0.210 1
1 640 . 44 1 1 A 57 57 ASP N N 57 126.239 119.646 6.593 1
1 641 . 44 1 1 A 58 58 TRP H H 58 8.244 8.469 -0.225 1
1 642 . 44 1 1 A 58 58 TRP HA H 58 4.030 4.601 -0.571 1
1 650 . 44 1 1 A 58 58 TRP C C 58 177.432 179.015 -1.583 1
1 651 . 44 1 1 A 58 58 TRP CA C 58 62.731 59.995 2.736 1
1 652 . 44 1 1 A 58 58 TRP CB C 58 29.122 29.399 -0.277 1
1 657 . 44 1 1 A 58 58 TRP N N 58 119.241 120.005 -0.764 1
1 659 . 44 1 1 A 59 59 ASN H H 59 8.098 8.512 -0.414 1
1 660 . 44 1 1 A 59 59 ASN HA H 59 4.424 4.500 -0.076 1
1 663 . 44 1 1 A 59 59 ASN C C 59 176.952 178.181 -1.229 1
1 664 . 44 1 1 A 59 59 ASN CA C 59 58.135 56.550 1.585 1
1 665 . 44 1 1 A 59 59 ASN CB C 59 40.168 39.912 0.256 1
1 666 . 44 1 1 A 59 59 ASN N N 59 115.747 118.013 -2.266 1
1 667 . 44 1 1 A 60 60 THR H H 60 8.712 7.940 0.772 1
1 668 . 44 1 1 A 60 60 THR HA H 60 3.717 4.117 -0.400 1
1 673 . 44 1 1 A 60 60 THR C C 60 176.044 176.760 -0.716 1
1 674 . 44 1 1 A 60 60 THR CA C 60 66.576 67.345 -0.769 1
1 675 . 44 1 1 A 60 60 THR CB C 60 69.251 68.027 1.224 1
1 677 . 44 1 1 A 60 60 THR N N 60 114.896 116.382 -1.486 1
1 678 . 44 1 1 A 61 61 LEU H H 61 8.485 8.797 -0.312 1
1 679 . 44 1 1 A 61 61 LEU HA H 61 3.391 4.134 -0.743 1
1 689 . 44 1 1 A 61 61 LEU C C 61 177.433 178.750 -1.317 1
1 690 . 44 1 1 A 61 61 LEU CA C 61 58.354 58.782 -0.428 1
1 691 . 44 1 1 A 61 61 LEU CB C 61 41.761 42.373 -0.612 1
1 695 . 44 1 1 A 61 61 LEU N N 61 123.433 122.085 1.348 1
1 696 . 44 1 1 A 62 62 VAL H H 62 8.073 8.393 -0.320 1
1 697 . 44 1 1 A 62 62 VAL HA H 62 3.207 3.784 -0.577 1
1 705 . 44 1 1 A 62 62 VAL C C 62 177.585 177.428 0.157 1
1 706 . 44 1 1 A 62 62 VAL CA C 62 67.345 65.178 2.167 1
1 707 . 44 1 1 A 62 62 VAL CB C 62 30.905 30.606 0.299 1
1 710 . 44 1 1 A 62 62 VAL N N 62 116.018 118.454 -2.436 1
1 711 . 44 1 1 A 63 63 ARG H H 63 7.765 8.000 -0.235 1
1 712 . 44 1 1 A 63 63 ARG HA H 63 3.602 4.127 -0.525 1
1 719 . 44 1 1 A 63 63 ARG C C 63 177.818 178.130 -0.312 1
1 720 . 44 1 1 A 63 63 ARG CA C 63 58.049 57.942 0.107 1
1 721 . 44 1 1 A 63 63 ARG CB C 63 29.955 29.127 0.828 1
1 724 . 44 1 1 A 63 63 ARG N N 63 116.700 120.649 -3.949 1
1 725 . 44 1 1 A 64 64 ALA H H 64 7.574 7.514 0.060 1
1 726 . 44 1 1 A 64 64 ALA HA H 64 4.158 4.389 -0.231 1
1 730 . 44 1 1 A 64 64 ALA C C 64 179.886 179.056 0.830 1
1 731 . 44 1 1 A 64 64 ALA CA C 64 54.007 53.764 0.243 1
1 732 . 44 1 1 A 64 64 ALA CB C 64 19.147 19.914 -0.767 1
1 733 . 44 1 1 A 64 64 ALA N N 64 117.555 121.983 -4.428 1
1 734 . 44 1 1 A 65 65 VAL H H 65 7.554 8.068 -0.514 1
1 735 . 44 1 1 A 65 65 VAL HA H 65 4.253 3.862 0.391 1
1 743 . 44 1 1 A 65 65 VAL C C 65 174.180 176.366 -2.186 1
1 744 . 44 1 1 A 65 65 VAL CA C 65 62.683 65.432 -2.749 1
1 745 . 44 1 1 A 65 65 VAL CB C 65 33.458 31.360 2.098 1
1 748 . 44 1 1 A 65 65 VAL N N 65 110.013 115.829 -5.816 1
1 749 . 44 1 1 A 66 66 LEU H H 66 7.792 7.170 0.622 1
1 750 . 44 1 1 A 66 66 LEU HA H 66 4.790 4.809 -0.019 1
1 760 . 44 1 1 A 66 66 LEU C C 66 177.537 175.677 1.860 1
1 761 . 44 1 1 A 66 66 LEU CA C 66 52.823 52.714 0.109 1
1 762 . 44 1 1 A 66 66 LEU CB C 66 44.071 45.297 -1.226 1
1 766 . 44 1 1 A 66 66 LEU N N 66 118.967 121.454 -2.487 1
1 767 . 44 1 1 A 67 67 SER H H 67 9.208 8.400 0.808 1
1 768 . 44 1 1 A 67 67 SER HA H 67 4.414 5.107 -0.693 1
1 771 . 44 1 1 A 67 67 SER CA C 67 57.943 57.292 0.651 1
1 772 . 44 1 1 A 67 67 SER CB C 67 64.743 66.713 -1.970 1
1 773 . 44 1 1 A 67 67 SER N N 67 116.378 116.009 0.369 1
1 774 . 44 1 1 A 69 69 GLY HA2 H 69 3.916 3.786 0.130 1
1 775 . 44 1 1 A 69 69 GLY HA3 H 69 3.867 3.811 0.056 1
1 776 . 44 1 1 A 69 69 GLY C C 69 176.783 175.558 1.225 1
1 777 . 44 1 1 A 69 69 GLY CA C 69 46.977 46.468 0.509 1
1 778 . 44 1 1 A 70 70 ASP H H 70 7.674 8.149 -0.475 1
1 779 . 44 1 1 A 70 70 ASP HA H 70 4.511 3.646 0.865 1
1 782 . 44 1 1 A 70 70 ASP C C 70 178.096 178.220 -0.124 1
1 783 . 44 1 1 A 70 70 ASP CA C 70 57.262 56.589 0.673 1
1 784 . 44 1 1 A 70 70 ASP CB C 70 40.594 39.827 0.767 1
1 785 . 44 1 1 A 70 70 ASP N N 70 123.930 121.750 2.180 1
1 786 . 44 1 1 A 71 71 HIS H H 71 8.729 7.951 0.778 1
1 787 . 44 1 1 A 71 71 HIS HA H 71 4.235 4.165 0.070 1
1 790 . 44 1 1 A 71 71 HIS C C 71 176.769 176.963 -0.194 1
1 791 . 44 1 1 A 71 71 HIS CA C 71 60.041 59.790 0.251 1
1 792 . 44 1 1 A 71 71 HIS CB C 71 30.682 29.816 0.866 1
1 793 . 44 1 1 A 71 71 HIS N N 71 121.003 119.411 1.592 1
1 794 . 44 1 1 A 72 72 LEU H H 72 7.620 7.915 -0.295 1
1 795 . 44 1 1 A 72 72 LEU HA H 72 3.769 3.842 -0.073 1
1 805 . 44 1 1 A 72 72 LEU C C 72 180.275 178.959 1.316 1
1 806 . 44 1 1 A 72 72 LEU CA C 72 58.192 57.916 0.276 1
1 807 . 44 1 1 A 72 72 LEU CB C 72 41.381 41.426 -0.045 1
1 811 . 44 1 1 A 72 72 LEU N N 72 118.569 118.690 -0.121 1
1 812 . 44 1 1 A 73 73 LEU H H 73 7.542 7.438 0.104 1
1 813 . 44 1 1 A 73 73 LEU HA H 73 4.107 4.232 -0.125 1
1 823 . 44 1 1 A 73 73 LEU C C 73 179.436 179.104 0.332 1
1 824 . 44 1 1 A 73 73 LEU CA C 73 58.026 57.203 0.823 1
1 825 . 44 1 1 A 73 73 LEU CB C 73 41.638 42.063 -0.425 1
1 829 . 44 1 1 A 73 73 LEU N N 73 121.418 120.105 1.313 1
1 830 . 44 1 1 A 74 74 TRP H H 74 8.786 7.933 0.853 1
1 831 . 44 1 1 A 74 74 TRP HA H 74 3.589 5.174 -1.585 1
1 840 . 44 1 1 A 74 74 TRP C C 74 176.816 178.668 -1.852 1
1 841 . 44 1 1 A 74 74 TRP CA C 74 63.046 59.951 3.095 1
1 842 . 44 1 1 A 74 74 TRP CB C 74 28.065 29.012 -0.947 1
1 848 . 44 1 1 A 74 74 TRP N N 74 121.111 118.155 2.956 1
1 850 . 44 1 1 A 75 75 LYS H H 75 8.939 7.833 1.106 1
1 851 . 44 1 1 A 75 75 LYS HA H 75 3.055 4.128 -1.073 1
1 860 . 44 1 1 A 75 75 LYS C C 75 177.967 179.375 -1.408 1
1 861 . 44 1 1 A 75 75 LYS CA C 75 60.029 58.514 1.515 1
1 862 . 44 1 1 A 75 75 LYS CB C 75 32.533 32.827 -0.294 1
1 866 . 44 1 1 A 75 75 LYS N N 75 119.783 118.534 1.249 1
1 867 . 44 1 1 A 76 76 SER H H 76 7.832 7.989 -0.157 1
1 868 . 44 1 1 A 76 76 SER HA H 76 4.040 4.349 -0.309 1
1 871 . 44 1 1 A 76 76 SER C C 76 177.816 176.957 0.859 1
1 872 . 44 1 1 A 76 76 SER CA C 76 62.105 61.983 0.122 1
1 873 . 44 1 1 A 76 76 SER CB C 76 62.679 63.013 -0.334 1
1 874 . 44 1 1 A 76 76 SER N N 76 113.395 117.164 -3.769 1
1 875 . 44 1 1 A 77 77 GLU H H 77 7.590 7.587 0.003 1
1 876 . 44 1 1 A 77 77 GLU HA H 77 4.042 4.222 -0.180 1
1 881 . 44 1 1 A 77 77 GLU C C 77 177.809 178.529 -0.720 1
1 882 . 44 1 1 A 77 77 GLU CA C 77 58.270 58.621 -0.351 1
1 883 . 44 1 1 A 77 77 GLU CB C 77 29.208 29.448 -0.240 1
1 885 . 44 1 1 A 77 77 GLU N N 77 121.574 122.562 -0.988 1
1 886 . 44 1 1 A 78 78 PHE H H 78 9.081 7.712 1.369 1
1 887 . 44 1 1 A 78 78 PHE HA H 78 3.778 4.225 -0.447 1
1 895 . 44 1 1 A 78 78 PHE C C 78 178.114 177.444 0.670 1
1 896 . 44 1 1 A 78 78 PHE CA C 78 60.629 61.124 -0.495 1
1 897 . 44 1 1 A 78 78 PHE CB C 78 38.295 38.759 -0.464 1
1 902 . 44 1 1 A 78 78 PHE N N 78 122.682 121.879 0.803 1
1 903 . 44 1 1 A 79 79 PHE H H 79 8.890 7.969 0.921 1
1 904 . 44 1 1 A 79 79 PHE HA H 79 3.800 3.776 0.024 1
1 912 . 44 1 1 A 79 79 PHE C C 79 178.354 178.073 0.281 1
1 913 . 44 1 1 A 79 79 PHE CA C 79 60.704 62.202 -1.498 1
1 914 . 44 1 1 A 79 79 PHE CB C 79 37.184 38.252 -1.068 1
1 920 . 44 1 1 A 79 79 PHE N N 79 121.056 117.543 3.513 1
1 921 . 44 1 1 A 80 80 GLU H H 80 7.793 7.959 -0.166 1
1 922 . 44 1 1 A 80 80 GLU HA H 80 4.082 4.057 0.025 1
1 927 . 44 1 1 A 80 80 GLU C C 80 179.068 179.185 -0.117 1
1 928 . 44 1 1 A 80 80 GLU CA C 80 59.735 59.668 0.067 1
1 929 . 44 1 1 A 80 80 GLU CB C 80 28.722 29.491 -0.769 1
1 931 . 44 1 1 A 80 80 GLU N N 80 120.312 118.723 1.589 1
1 932 . 44 1 1 A 81 81 ASN H H 81 8.624 8.658 -0.034 1
1 933 . 44 1 1 A 81 81 ASN HA H 81 4.521 4.470 0.051 1
1 938 . 44 1 1 A 81 81 ASN C C 81 179.262 178.099 1.163 1
1 939 . 44 1 1 A 81 81 ASN CA C 81 55.504 56.965 -1.461 1
1 940 . 44 1 1 A 81 81 ASN CB C 81 37.517 38.230 -0.713 1
1 941 . 44 1 1 A 81 81 ASN N N 81 119.338 118.392 0.946 1
1 943 . 44 1 1 A 82 82 CYS H H 82 8.554 8.390 0.164 1
1 944 . 44 1 1 A 82 82 CYS HA H 82 3.792 4.025 -0.233 1
1 947 . 44 1 1 A 82 82 CYS C C 82 176.478 176.648 -0.170 1
1 948 . 44 1 1 A 82 82 CYS CA C 82 65.232 62.031 3.201 1
1 949 . 44 1 1 A 82 82 CYS CB C 82 26.762 26.941 -0.179 1
1 950 . 44 1 1 A 82 82 CYS N N 82 120.576 118.635 1.941 1
1 951 . 44 1 1 A 83 83 ARG H H 83 8.522 7.674 0.848 1
1 952 . 44 1 1 A 83 83 ARG HA H 83 3.932 4.197 -0.265 1
1 960 . 44 1 1 A 83 83 ARG C C 83 179.138 177.916 1.222 1
1 961 . 44 1 1 A 83 83 ARG CA C 83 60.443 58.943 1.500 1
1 962 . 44 1 1 A 83 83 ARG CB C 83 29.550 29.883 -0.333 1
1 965 . 44 1 1 A 83 83 ARG N N 83 123.035 121.316 1.719 1
1 967 . 44 1 1 A 84 84 ASP H H 84 7.791 8.241 -0.450 1
1 968 . 44 1 1 A 84 84 ASP HA H 84 4.353 4.395 -0.042 1
1 971 . 44 1 1 A 84 84 ASP C C 84 178.649 178.952 -0.303 1
1 972 . 44 1 1 A 84 84 ASP CA C 84 57.767 57.641 0.126 1
1 973 . 44 1 1 A 84 84 ASP CB C 84 41.305 41.862 -0.557 1
1 974 . 44 1 1 A 84 84 ASP N N 84 120.332 119.652 0.680 1
1 975 . 44 1 1 A 85 85 THR H H 85 8.370 8.058 0.312 1
1 976 . 44 1 1 A 85 85 THR HA H 85 3.730 3.878 -0.148 1
1 981 . 44 1 1 A 85 85 THR C C 85 175.198 176.161 -0.963 1
1 982 . 44 1 1 A 85 85 THR CA C 85 66.830 66.370 0.460 1
1 983 . 44 1 1 A 85 85 THR CB C 85 68.533 68.209 0.324 1
1 985 . 44 1 1 A 85 85 THR N N 85 117.360 115.507 1.853 1
1 986 . 44 1 1 A 86 86 ALA H H 86 8.845 8.271 0.574 1
1 987 . 44 1 1 A 86 86 ALA HA H 86 3.991 3.985 0.006 1
1 991 . 44 1 1 A 86 86 ALA C C 86 179.980 179.772 0.208 1
1 992 . 44 1 1 A 86 86 ALA CA C 86 55.769 55.536 0.233 1
1 993 . 44 1 1 A 86 86 ALA CB C 86 17.881 18.217 -0.336 1
1 994 . 44 1 1 A 86 86 ALA N N 86 123.613 123.629 -0.016 1
1 995 . 44 1 1 A 87 87 LYS H H 87 7.686 8.316 -0.630 1
1 996 . 44 1 1 A 87 87 LYS HA H 87 4.099 3.999 0.100 1
1 1005 . 44 1 1 A 87 87 LYS C C 87 179.592 179.340 0.252 1
1 1006 . 44 1 1 A 87 87 LYS CA C 87 59.708 59.787 -0.079 1
1 1007 . 44 1 1 A 87 87 LYS CB C 87 32.054 32.201 -0.147 1
1 1011 . 44 1 1 A 87 87 LYS N N 87 119.623 117.407 2.216 1
1 1012 . 44 1 1 A 88 88 ARG H H 88 7.683 7.739 -0.056 1
1 1013 . 44 1 1 A 88 88 ARG HA H 88 4.051 4.069 -0.018 1
1 1020 . 44 1 1 A 88 88 ARG C C 88 180.053 179.110 0.943 1
1 1021 . 44 1 1 A 88 88 ARG CA C 88 59.558 59.444 0.114 1
1 1022 . 44 1 1 A 88 88 ARG CB C 88 29.684 30.229 -0.545 1
1 1025 . 44 1 1 A 88 88 ARG N N 88 120.788 119.745 1.043 1
1 1026 . 44 1 1 A 89 89 ASN H H 89 8.973 8.083 0.890 1
1 1027 . 44 1 1 A 89 89 ASN HA H 89 4.354 4.664 -0.310 1
1 1032 . 44 1 1 A 89 89 ASN C C 89 178.382 178.470 -0.088 1
1 1033 . 44 1 1 A 89 89 ASN CA C 89 55.334 55.882 -0.548 1
1 1034 . 44 1 1 A 89 89 ASN CB C 89 37.864 38.413 -0.549 1
1 1035 . 44 1 1 A 89 89 ASN N N 89 121.012 117.912 3.100 1
1 1037 . 44 1 1 A 90 90 GLN H H 90 8.152 7.945 0.207 1
1 1038 . 44 1 1 A 90 90 GLN HA H 90 4.020 4.202 -0.182 1
1 1045 . 44 1 1 A 90 90 GLN C C 90 179.075 178.765 0.310 1
1 1046 . 44 1 1 A 90 90 GLN CA C 90 59.318 58.795 0.523 1
1 1047 . 44 1 1 A 90 90 GLN CB C 90 28.049 28.329 -0.280 1
1 1049 . 44 1 1 A 90 90 GLN N N 90 122.122 120.212 1.910 1
1 1051 . 44 1 1 A 91 91 GLN H H 91 7.514 8.477 -0.963 1
1 1052 . 44 1 1 A 91 91 GLN HA H 91 4.053 4.068 -0.015 1
1 1059 . 44 1 1 A 91 91 GLN C C 91 177.081 177.448 -0.367 1
1 1060 . 44 1 1 A 91 91 GLN CA C 91 58.031 58.447 -0.416 1
1 1061 . 44 1 1 A 91 91 GLN CB C 91 28.365 27.785 0.580 1
1 1063 . 44 1 1 A 91 91 GLN N N 91 118.124 118.117 0.007 1
1 1065 . 44 1 1 A 92 92 ALA H H 92 7.704 7.342 0.362 1
1 1066 . 44 1 1 A 92 92 ALA HA H 92 4.246 4.338 -0.092 1
1 1070 . 44 1 1 A 92 92 ALA C C 92 178.450 177.951 0.499 1
1 1071 . 44 1 1 A 92 92 ALA CA C 92 52.671 52.195 0.476 1
1 1072 . 44 1 1 A 92 92 ALA CB C 92 19.316 19.581 -0.265 1
1 1073 . 44 1 1 A 92 92 ALA N N 92 119.880 120.544 -0.664 1
1 1074 . 44 1 1 A 93 93 GLY H H 93 7.693 7.904 -0.211 1
1 1075 . 44 1 1 A 93 93 GLY HA2 H 93 3.941 3.972 -0.031 1
1 1076 . 44 1 1 A 93 93 GLY HA3 H 93 3.744 3.983 -0.239 1
1 1077 . 44 1 1 A 93 93 GLY C C 93 174.344 175.310 -0.966 1
1 1078 . 44 1 1 A 93 93 GLY CA C 93 45.949 46.448 -0.499 1
1 1079 . 44 1 1 A 93 93 GLY N N 93 105.347 106.897 -1.550 1
1 1080 . 44 1 1 A 94 94 ASN H H 94 7.076 8.833 -1.757 1
1 1081 . 44 1 1 A 94 94 ASN HA H 94 4.115 4.790 -0.675 1
1 1085 . 44 1 1 A 94 94 ASN C C 94 175.410 176.251 -0.841 1
1 1086 . 44 1 1 A 94 94 ASN CA C 94 52.651 52.867 -0.216 1
1 1087 . 44 1 1 A 94 94 ASN CB C 94 38.330 39.666 -1.336 1
1 1088 . 44 1 1 A 94 94 ASN N N 94 115.747 116.648 -0.901 1
1 1090 . 44 1 1 A 95 95 GLY H H 95 8.236 8.587 -0.351 1
1 1091 . 44 1 1 A 95 95 GLY HA2 H 95 3.633 4.005 -0.372 1
1 1092 . 44 1 1 A 95 95 GLY HA3 H 95 3.633 4.033 -0.400 1
1 1093 . 44 1 1 A 95 95 GLY C C 95 174.450 173.709 0.741 1
1 1094 . 44 1 1 A 95 95 GLY CA C 95 45.522 46.786 -1.264 1
1 1095 . 44 1 1 A 95 95 GLY N N 95 109.166 108.226 0.940 1
1 1096 . 44 1 1 A 96 96 TRP H H 96 7.899 7.865 0.034 1
1 1097 . 44 1 1 A 96 96 TRP HA H 96 5.241 4.848 0.393 1
1 1106 . 44 1 1 A 96 96 TRP C C 96 175.661 175.007 0.654 1
1 1107 . 44 1 1 A 96 96 TRP CA C 96 55.090 56.786 -1.696 1
1 1108 . 44 1 1 A 96 96 TRP CB C 96 27.138 32.364 -5.226 1
1 1114 . 44 1 1 A 96 96 TRP N N 96 122.840 120.162 2.678 1
1 1116 . 44 1 1 A 97 97 ASP H H 97 7.344 8.581 -1.237 1
1 1117 . 44 1 1 A 97 97 ASP HA H 97 4.829 4.052 0.777 1
1 1120 . 44 1 1 A 97 97 ASP C C 97 175.019 176.717 -1.698 1
1 1121 . 44 1 1 A 97 97 ASP CA C 97 52.149 56.298 -4.149 1
1 1122 . 44 1 1 A 97 97 ASP CB C 97 42.697 39.406 3.291 1
1 1123 . 44 1 1 A 97 97 ASP N N 97 126.861 123.142 3.719 1
1 1124 . 44 1 1 A 98 98 PHE H H 98 8.566 8.494 0.072 1
1 1125 . 44 1 1 A 98 98 PHE HA H 98 3.727 4.020 -0.293 1
1 1133 . 44 1 1 A 98 98 PHE C C 98 177.443 177.649 -0.206 1
1 1134 . 44 1 1 A 98 98 PHE CA C 98 62.471 61.962 0.509 1
1 1135 . 44 1 1 A 98 98 PHE CB C 98 39.919 39.302 0.617 1
1 1141 . 44 1 1 A 98 98 PHE N N 98 117.781 119.613 -1.832 1
1 1142 . 44 1 1 A 99 99 ASP H H 99 8.259 8.549 -0.290 1
1 1143 . 44 1 1 A 99 99 ASP HA H 99 3.960 4.811 -0.851 1
1 1146 . 44 1 1 A 99 99 ASP C C 99 178.132 178.723 -0.591 1
1 1147 . 44 1 1 A 99 99 ASP CA C 99 57.658 56.991 0.667 1
1 1148 . 44 1 1 A 99 99 ASP CB C 99 38.572 40.626 -2.054 1
1 1149 . 44 1 1 A 99 99 ASP N N 99 121.709 118.841 2.868 1
1 1150 . 44 1 1 A 100 100 MET H H 100 8.008 8.219 -0.211 1
1 1151 . 44 1 1 A 100 100 MET HA H 100 3.644 4.095 -0.451 1
1 1156 . 44 1 1 A 100 100 MET C C 100 180.008 176.896 3.112 1
1 1157 . 44 1 1 A 100 100 MET CA C 100 58.598 58.307 0.291 1
1 1158 . 44 1 1 A 100 100 MET CB C 100 33.423 32.462 0.961 1
1 1160 . 44 1 1 A 100 100 MET N N 100 119.668 118.313 1.355 1
1 1161 . 44 1 1 A 101 101 LEU H H 101 7.961 8.341 -0.380 1
1 1162 . 44 1 1 A 101 101 LEU HA H 101 3.523 4.251 -0.728 1
1 1172 . 44 1 1 A 101 101 LEU C C 101 173.873 176.231 -2.358 1
1 1173 . 44 1 1 A 101 101 LEU CA C 101 58.743 54.926 3.817 1
1 1174 . 44 1 1 A 101 101 LEU CB C 101 42.632 42.588 0.044 1
1 1178 . 44 1 1 A 101 101 LEU N N 101 119.752 119.558 0.194 1
1 1179 . 44 1 1 A 102 102 THR H H 102 6.955 8.762 -1.807 1
1 1180 . 44 1 1 A 102 102 THR HA H 102 4.134 4.618 -0.484 1
1 1185 . 44 1 1 A 102 102 THR C C 102 176.513 174.057 2.456 1
1 1186 . 44 1 1 A 102 102 THR CA C 102 61.125 62.420 -1.295 1
1 1187 . 44 1 1 A 102 102 THR CB C 102 71.415 69.329 2.086 1
1 1189 . 44 1 1 A 102 102 THR N N 102 124.665 121.745 2.920 1
1 1190 . 44 1 1 A 103 103 GLY H H 103 7.816 8.922 -1.106 1
1 1191 . 44 1 1 A 103 103 GLY HA2 H 103 3.824 3.943 -0.119 1
1 1192 . 44 1 1 A 103 103 GLY HA3 H 103 3.824 4.029 -0.205 1
1 1193 . 44 1 1 A 103 103 GLY C C 103 174.126 174.609 -0.483 1
1 1194 . 44 1 1 A 103 103 GLY CA C 103 47.805 47.293 0.512 1
1 1195 . 44 1 1 A 103 103 GLY N N 103 114.191 111.558 2.633 1
1 1196 . 44 1 1 A 104 104 SER H H 104 8.860 7.935 0.925 1
1 1197 . 44 1 1 A 104 104 SER HA H 104 4.758 4.617 0.141 1
1 1200 . 44 1 1 A 104 104 SER C C 104 174.591 172.838 1.753 1
1 1201 . 44 1 1 A 104 104 SER CA C 104 56.755 57.382 -0.627 1
1 1202 . 44 1 1 A 104 104 SER CB C 104 65.050 63.695 1.355 1
1 1203 . 44 1 1 A 104 104 SER N N 104 114.771 115.429 -0.658 1
1 1204 . 44 1 1 A 105 105 GLY H H 105 8.788 8.118 0.670 1
1 1205 . 44 1 1 A 105 105 GLY HA2 H 105 3.733 4.166 -0.433 1
1 1206 . 44 1 1 A 105 105 GLY HA3 H 105 3.733 4.208 -0.475 1
1 1207 . 44 1 1 A 105 105 GLY CA C 105 47.247 44.828 2.419 1
1 1208 . 44 1 1 A 105 105 GLY N N 105 110.394 108.785 1.609 1
1 1209 . 44 1 1 A 106 106 ASN HA H 106 4.454 4.518 -0.064 1
1 1212 . 44 1 1 A 106 106 ASN C C 106 175.180 176.326 -1.146 1
1 1213 . 44 1 1 A 106 106 ASN CA C 106 54.492 55.875 -1.383 1
1 1214 . 44 1 1 A 106 106 ASN CB C 106 37.282 38.945 -1.663 1
1 1215 . 44 1 1 A 107 107 TYR H H 107 8.241 8.261 -0.020 1
1 1216 . 44 1 1 A 107 107 TYR HA H 107 4.335 4.476 -0.141 1
1 1223 . 44 1 1 A 107 107 TYR C C 107 173.954 178.356 -4.402 1
1 1224 . 44 1 1 A 107 107 TYR CA C 107 57.727 60.041 -2.314 1
1 1225 . 44 1 1 A 107 107 TYR CB C 107 37.063 38.692 -1.629 1
1 1230 . 44 1 1 A 107 107 TYR N N 107 120.708 118.918 1.790 1
1 1231 . 44 1 1 A 108 108 SER H H 108 7.117 7.145 -0.028 1
1 1232 . 44 1 1 A 108 108 SER HA H 108 4.221 3.791 0.430 1
1 1235 . 44 1 1 A 108 108 SER C C 108 174.834 174.803 0.031 1
1 1236 . 44 1 1 A 108 108 SER CA C 108 59.859 62.036 -2.177 1
1 1237 . 44 1 1 A 108 108 SER CB C 108 63.846 62.475 1.371 1
1 1238 . 44 1 1 A 108 108 SER N N 108 113.362 116.884 -3.522 1
1 1239 . 44 1 1 A 109 109 SER H H 109 8.053 7.607 0.446 1
1 1240 . 44 1 1 A 109 109 SER HA H 109 4.560 4.207 0.353 1
1 1243 . 44 1 1 A 109 109 SER CA C 109 57.141 60.796 -3.655 1
1 1244 . 44 1 1 A 109 109 SER CB C 109 64.874 61.815 3.059 1
1 1245 . 44 1 1 A 109 109 SER N N 109 116.657 114.367 2.290 1
1 1246 . 44 1 1 A 110 110 THR HA H 110 3.541 4.128 -0.587 1
1 1251 . 44 1 1 A 110 110 THR C C 110 175.477 175.953 -0.476 1
1 1252 . 44 1 1 A 110 110 THR CA C 110 66.443 66.965 -0.522 1
1 1253 . 44 1 1 A 110 110 THR CB C 110 68.091 68.911 -0.820 1
1 1255 . 44 1 1 A 111 111 ASP H H 111 8.224 8.327 -0.103 1
1 1256 . 44 1 1 A 111 111 ASP HA H 111 4.237 4.201 0.036 1
1 1259 . 44 1 1 A 111 111 ASP C C 111 177.520 178.583 -1.063 1
1 1260 . 44 1 1 A 111 111 ASP CA C 111 57.559 57.401 0.158 1
1 1261 . 44 1 1 A 111 111 ASP CB C 111 40.292 40.392 -0.100 1
1 1262 . 44 1 1 A 111 111 ASP N N 111 119.490 119.515 -0.025 1
1 1263 . 44 1 1 A 112 112 ALA H H 112 7.431 7.584 -0.153 1
1 1264 . 44 1 1 A 112 112 ALA HA H 112 4.191 4.108 0.083 1
1 1268 . 44 1 1 A 112 112 ALA C C 112 180.646 179.809 0.837 1
1 1269 . 44 1 1 A 112 112 ALA CA C 112 54.534 55.035 -0.501 1
1 1270 . 44 1 1 A 112 112 ALA CB C 112 18.992 18.183 0.809 1
1 1271 . 44 1 1 A 112 112 ALA N N 112 119.710 122.668 -2.958 1
1 1272 . 44 1 1 A 113 113 GLN H H 113 7.576 7.692 -0.116 1
1 1273 . 44 1 1 A 113 113 GLN HA H 113 3.562 4.139 -0.577 1
1 1278 . 44 1 1 A 113 113 GLN C C 113 176.756 178.399 -1.643 1
1 1279 . 44 1 1 A 113 113 GLN CA C 113 57.736 58.631 -0.895 1
1 1280 . 44 1 1 A 113 113 GLN CB C 113 29.110 27.966 1.144 1
1 1281 . 44 1 1 A 113 113 GLN N N 113 117.518 115.957 1.561 1
1 1283 . 44 1 1 A 114 114 MET H H 114 8.192 8.244 -0.052 1
1 1284 . 44 1 1 A 114 114 MET HA H 114 4.231 4.204 0.027 1
1 1289 . 44 1 1 A 114 114 MET C C 114 175.648 178.341 -2.693 1
1 1290 . 44 1 1 A 114 114 MET CA C 114 57.446 58.057 -0.611 1
1 1291 . 44 1 1 A 114 114 MET CB C 114 33.570 32.075 1.495 1
1 1293 . 44 1 1 A 114 114 MET N N 114 111.509 120.000 -8.491 1
1 1294 . 44 1 1 A 115 115 GLN H H 115 6.940 7.457 -0.517 1
1 1295 . 44 1 1 A 115 115 GLN HA H 115 4.307 4.249 0.058 1
1 1302 . 44 1 1 A 115 115 GLN C C 115 176.270 175.932 0.338 1
1 1303 . 44 1 1 A 115 115 GLN CA C 115 54.680 56.723 -2.043 1
1 1304 . 44 1 1 A 115 115 GLN CB C 115 28.233 29.058 -0.825 1
1 1306 . 44 1 1 A 115 115 GLN N N 115 114.300 116.187 -1.887 1
1 1308 . 44 1 1 A 116 116 TYR H H 116 6.677 8.157 -1.480 1
1 1309 . 44 1 1 A 116 116 TYR HA H 116 4.193 4.328 -0.135 1
1 1312 . 44 1 1 A 116 116 TYR C C 116 175.268 174.513 0.755 1
1 1313 . 44 1 1 A 116 116 TYR CA C 116 54.357 58.937 -4.580 1
1 1314 . 44 1 1 A 116 116 TYR CB C 116 35.498 36.738 -1.240 1
1 1315 . 44 1 1 A 116 116 TYR N N 116 117.919 119.111 -1.192 1
1 1316 . 44 1 1 A 117 117 ASP H H 117 8.081 8.398 -0.317 1
1 1317 . 44 1 1 A 117 117 ASP HA H 117 4.665 4.986 -0.321 1
1 1320 . 44 1 1 A 117 117 ASP CA C 117 52.422 51.018 1.404 1
1 1321 . 44 1 1 A 117 117 ASP CB C 117 42.416 41.179 1.237 1
1 1322 . 44 1 1 A 117 117 ASP N N 117 120.887 123.647 -2.760 1
1 1323 . 44 1 1 A 118 118 PRO C C 118 179.180 179.608 -0.428 1
1 1324 . 44 1 1 A 118 118 PRO CA C 118 65.942 65.755 0.187 1
1 1325 . 44 1 1 A 118 118 PRO CB C 118 32.197 31.662 0.535 1
1 1326 . 44 1 1 A 119 119 GLY H H 119 9.742 8.672 1.070 1
1 1327 . 44 1 1 A 119 119 GLY C C 119 175.622 175.805 -0.183 1
1 1328 . 44 1 1 A 119 119 GLY CA C 119 46.785 46.835 -0.050 1
1 1329 . 44 1 1 A 119 119 GLY N N 119 106.412 106.710 -0.298 1
1 1330 . 44 1 1 A 120 120 LEU H H 120 6.666 7.830 -1.164 1
1 1331 . 44 1 1 A 120 120 LEU HA H 120 3.365 3.621 -0.256 1
1 1341 . 44 1 1 A 120 120 LEU C C 120 179.262 178.428 0.834 1
1 1342 . 44 1 1 A 120 120 LEU CA C 120 56.605 56.801 -0.196 1
1 1343 . 44 1 1 A 120 120 LEU CB C 120 39.262 41.299 -2.037 1
1 1347 . 44 1 1 A 120 120 LEU N N 120 126.226 123.831 2.395 1
1 1348 . 44 1 1 A 121 121 PHE H H 121 7.356 8.504 -1.148 1
1 1349 . 44 1 1 A 121 121 PHE HA H 121 4.459 3.973 0.486 1
1 1352 . 44 1 1 A 121 121 PHE C C 121 179.716 177.859 1.857 1
1 1353 . 44 1 1 A 121 121 PHE CA C 121 62.838 62.084 0.754 1
1 1354 . 44 1 1 A 121 121 PHE CB C 121 37.603 39.359 -1.756 1
1 1355 . 44 1 1 A 121 121 PHE N N 121 117.437 119.312 -1.875 1
1 1356 . 44 1 1 A 122 122 ALA H H 122 7.926 8.343 -0.417 1
1 1357 . 44 1 1 A 122 122 ALA HA H 122 4.523 3.892 0.631 1
1 1361 . 44 1 1 A 122 122 ALA C C 122 180.435 179.724 0.711 1
1 1362 . 44 1 1 A 122 122 ALA CA C 122 55.527 55.380 0.147 1
1 1363 . 44 1 1 A 122 122 ALA CB C 122 17.814 18.036 -0.222 1
1 1364 . 44 1 1 A 122 122 ALA N N 122 121.068 121.290 -0.222 1
1 1365 . 44 1 1 A 123 123 GLN H H 123 7.507 8.268 -0.761 1
1 1366 . 44 1 1 A 123 123 GLN HA H 123 4.153 3.899 0.254 1
1 1371 . 44 1 1 A 123 123 GLN C C 123 180.561 178.553 2.008 1
1 1372 . 44 1 1 A 123 123 GLN CA C 123 59.948 59.042 0.906 1
1 1373 . 44 1 1 A 123 123 GLN CB C 123 29.135 28.038 1.097 1
1 1375 . 44 1 1 A 123 123 GLN N N 123 120.324 117.774 2.550 1
1 1376 . 44 1 1 A 124 124 ILE H H 124 8.318 7.937 0.381 1
1 1377 . 44 1 1 A 124 124 ILE HA H 124 3.635 3.817 -0.182 1
1 1387 . 44 1 1 A 124 124 ILE C C 124 176.481 178.110 -1.629 1
1 1388 . 44 1 1 A 124 124 ILE CA C 124 66.432 64.475 1.957 1
1 1389 . 44 1 1 A 124 124 ILE CB C 124 39.168 37.770 1.398 1
1 1393 . 44 1 1 A 124 124 ILE N N 124 123.747 118.275 5.472 1
1 1394 . 44 1 1 A 125 125 GLN H H 125 8.474 8.082 0.392 1
1 1395 . 44 1 1 A 125 125 GLN HA H 125 4.264 3.877 0.387 1
1 1402 . 44 1 1 A 125 125 GLN C C 125 178.947 177.894 1.053 1
1 1403 . 44 1 1 A 125 125 GLN CA C 125 59.651 58.488 1.163 1
1 1404 . 44 1 1 A 125 125 GLN CB C 125 28.880 28.433 0.447 1
1 1406 . 44 1 1 A 125 125 GLN N N 125 120.368 121.095 -0.727 1
1 1408 . 44 1 1 A 126 126 ALA H H 126 8.002 8.040 -0.038 1
1 1409 . 44 1 1 A 126 126 ALA HA H 126 4.144 4.029 0.115 1
1 1413 . 44 1 1 A 126 126 ALA C C 126 179.316 179.688 -0.372 1
1 1414 . 44 1 1 A 126 126 ALA CA C 126 55.036 54.891 0.145 1
1 1415 . 44 1 1 A 126 126 ALA CB C 126 18.087 17.975 0.112 1
1 1416 . 44 1 1 A 126 126 ALA N N 126 121.661 121.164 0.497 1
1 1417 . 44 1 1 A 127 127 ALA H H 127 7.823 8.167 -0.344 1
1 1418 . 44 1 1 A 127 127 ALA HA H 127 4.162 3.971 0.191 1
1 1422 . 44 1 1 A 127 127 ALA C C 127 180.707 179.469 1.238 1
1 1423 . 44 1 1 A 127 127 ALA CA C 127 55.080 54.903 0.177 1
1 1424 . 44 1 1 A 127 127 ALA CB C 127 19.354 18.269 1.085 1
1 1425 . 44 1 1 A 127 127 ALA N N 127 119.853 119.667 0.186 1
1 1426 . 44 1 1 A 128 128 ALA H H 128 8.936 7.869 1.067 1
1 1427 . 44 1 1 A 128 128 ALA HA H 128 3.928 3.769 0.159 1
1 1431 . 44 1 1 A 128 128 ALA C C 128 181.031 179.428 1.603 1
1 1432 . 44 1 1 A 128 128 ALA CA C 128 55.502 54.608 0.894 1
1 1433 . 44 1 1 A 128 128 ALA CB C 128 16.609 17.708 -1.099 1
1 1434 . 44 1 1 A 128 128 ALA N N 128 121.355 120.444 0.911 1
1 1435 . 44 1 1 A 129 129 THR H H 129 8.543 7.481 1.062 1
1 1436 . 44 1 1 A 129 129 THR HA H 129 4.015 3.618 0.397 1
1 1441 . 44 1 1 A 129 129 THR C C 129 177.332 176.353 0.979 1
1 1442 . 44 1 1 A 129 129 THR CA C 129 65.893 65.082 0.811 1
1 1443 . 44 1 1 A 129 129 THR CB C 129 68.566 68.503 0.063 1
1 1445 . 44 1 1 A 129 129 THR N N 129 112.709 112.201 0.508 1
1 1446 . 44 1 1 A 130 130 LYS H H 130 8.126 7.401 0.725 1
1 1447 . 44 1 1 A 130 130 LYS HA H 130 4.000 3.977 0.023 1
1 1456 . 44 1 1 A 130 130 LYS C C 130 179.082 178.444 0.638 1
1 1457 . 44 1 1 A 130 130 LYS CA C 130 60.299 58.675 1.624 1
1 1458 . 44 1 1 A 130 130 LYS CB C 130 32.767 32.150 0.617 1
1 1462 . 44 1 1 A 130 130 LYS N N 130 123.879 120.442 3.437 1
1 1463 . 44 1 1 A 131 131 ALA H H 131 7.184 7.816 -0.632 1
1 1464 . 44 1 1 A 131 131 ALA HA H 131 4.005 4.239 -0.234 1
1 1468 . 44 1 1 A 131 131 ALA C C 131 178.482 179.548 -1.066 1
1 1469 . 44 1 1 A 131 131 ALA CA C 131 55.027 55.074 -0.047 1
1 1470 . 44 1 1 A 131 131 ALA CB C 131 18.669 19.634 -0.965 1
1 1471 . 44 1 1 A 131 131 ALA N N 131 118.590 120.781 -2.191 1
1 1472 . 44 1 1 A 132 132 TRP H H 132 7.977 8.644 -0.667 1
1 1473 . 44 1 1 A 132 132 TRP HA H 132 4.001 4.175 -0.174 1
1 1480 . 44 1 1 A 132 132 TRP C C 132 177.332 175.850 1.482 1
1 1481 . 44 1 1 A 132 132 TRP CA C 132 60.431 57.737 2.694 1
1 1482 . 44 1 1 A 132 132 TRP CB C 132 27.786 27.541 0.245 1
1 1486 . 44 1 1 A 132 132 TRP N N 132 119.168 117.239 1.929 1
1 1488 . 44 1 1 A 133 133 ARG H H 133 8.006 8.154 -0.148 1
1 1489 . 44 1 1 A 133 133 ARG HA H 133 4.027 4.378 -0.351 1
1 1497 . 44 1 1 A 133 133 ARG C C 133 176.664 177.785 -1.121 1
1 1498 . 44 1 1 A 133 133 ARG CA C 133 59.355 57.366 1.989 1
1 1499 . 44 1 1 A 133 133 ARG CB C 133 30.451 32.314 -1.863 1
1 1502 . 44 1 1 A 133 133 ARG N N 133 113.062 120.695 -7.633 1
1 1504 . 44 1 1 A 134 134 LYS H H 134 7.322 7.607 -0.285 1
1 1505 . 44 1 1 A 134 134 LYS HA H 134 4.313 4.465 -0.152 1
1 1514 . 44 1 1 A 134 134 LYS C C 134 176.282 176.342 -0.060 1
1 1515 . 44 1 1 A 134 134 LYS CA C 134 54.922 56.661 -1.739 1
1 1516 . 44 1 1 A 134 134 LYS CB C 134 32.633 31.394 1.239 1
1 1520 . 44 1 1 A 134 134 LYS N N 134 118.170 118.311 -0.141 1
1 1521 . 44 1 1 A 135 135 LEU H H 135 7.440 7.859 -0.419 1
1 1522 . 44 1 1 A 135 135 LEU HA H 135 4.174 4.558 -0.384 1
1 1532 . 44 1 1 A 135 135 LEU CA C 135 54.408 53.052 1.356 1
1 1533 . 44 1 1 A 135 135 LEU CB C 135 40.407 41.066 -0.659 1
1 1537 . 44 1 1 A 135 135 LEU N N 135 123.358 121.348 2.010 1
1 1538 . 44 1 1 A 136 136 PRO HA H 136 4.437 4.601 -0.164 1
1 1545 . 44 1 1 A 136 136 PRO C C 136 177.106 176.209 0.897 1
1 1546 . 44 1 1 A 136 136 PRO CA C 136 62.889 62.280 0.609 1
1 1547 . 44 1 1 A 136 136 PRO CB C 136 32.192 33.283 -1.091 1
1 1550 . 44 1 1 A 137 137 VAL H H 137 8.219 8.303 -0.084 1
1 1551 . 44 1 1 A 137 137 VAL HA H 137 4.077 4.269 -0.192 1
1 1559 . 44 1 1 A 137 137 VAL C C 137 176.305 176.372 -0.067 1
1 1560 . 44 1 1 A 137 137 VAL CA C 137 61.958 62.705 -0.747 1
1 1561 . 44 1 1 A 137 137 VAL CB C 137 32.755 32.203 0.552 1
1 1564 . 44 1 1 A 137 137 VAL N N 137 120.079 118.542 1.537 1
1 1565 . 44 1 1 A 138 138 LYS H H 138 8.444 7.641 0.803 1
1 1566 . 44 1 1 A 138 138 LYS HA H 138 4.316 4.580 -0.264 1
1 1575 . 44 1 1 A 138 138 LYS C C 138 176.790 176.510 0.280 1
1 1576 . 44 1 1 A 138 138 LYS CA C 138 56.792 57.591 -0.799 1
1 1577 . 44 1 1 A 138 138 LYS CB C 138 33.205 35.046 -1.841 1
1 1581 . 44 1 1 A 138 138 LYS N N 138 126.449 121.249 5.200 1
1 1582 . 44 1 1 A 139 139 GLY H H 139 8.518 7.616 0.902 1
1 1583 . 44 1 1 A 139 139 GLY HA2 H 139 4.070 4.003 0.067 1
1 1584 . 44 1 1 A 139 139 GLY HA3 H 139 3.897 4.005 -0.108 1
1 1585 . 44 1 1 A 139 139 GLY C C 139 172.874 173.438 -0.564 1
1 1586 . 44 1 1 A 139 139 GLY CA C 139 45.157 45.461 -0.304 1
1 1587 . 44 1 1 A 139 139 GLY N N 139 112.617 107.134 5.483 1
1 6 . 45 1 1 A 2 2 VAL H H 2 8.992 8.894 0.098 1
1 7 . 45 1 1 A 2 2 VAL HA H 2 5.370 4.811 0.559 1
1 15 . 45 1 1 A 2 2 VAL C C 2 174.325 174.579 -0.254 1
1 16 . 45 1 1 A 2 2 VAL CA C 2 61.267 60.258 1.009 1
1 17 . 45 1 1 A 2 2 VAL CB C 2 33.890 35.548 -1.658 1
1 20 . 45 1 1 A 2 2 VAL N N 2 126.939 120.175 6.764 1
1 21 . 45 1 1 A 3 3 THR H H 3 8.912 8.784 0.128 1
1 22 . 45 1 1 A 3 3 THR HA H 3 4.505 5.315 -0.810 1
1 27 . 45 1 1 A 3 3 THR C C 3 172.710 172.900 -0.190 1
1 28 . 45 1 1 A 3 3 THR CA C 3 59.689 59.731 -0.042 1
1 29 . 45 1 1 A 3 3 THR CB C 3 72.398 71.979 0.419 1
1 31 . 45 1 1 A 3 3 THR N N 3 118.091 121.507 -3.416 1
1 32 . 45 1 1 A 4 4 GLU H H 4 8.631 8.910 -0.279 1
1 33 . 45 1 1 A 4 4 GLU HA H 4 5.788 5.061 0.727 1
1 38 . 45 1 1 A 4 4 GLU C C 4 175.758 174.420 1.338 1
1 39 . 45 1 1 A 4 4 GLU CA C 4 54.902 54.059 0.843 1
1 40 . 45 1 1 A 4 4 GLU CB C 4 35.097 33.340 1.757 1
1 42 . 45 1 1 A 4 4 GLU N N 4 120.966 125.295 -4.329 1
1 43 . 45 1 1 A 5 5 THR H H 5 9.188 8.881 0.307 1
1 44 . 45 1 1 A 5 5 THR HA H 5 4.739 5.004 -0.265 1
1 49 . 45 1 1 A 5 5 THR C C 5 172.757 172.293 0.464 1
1 50 . 45 1 1 A 5 5 THR CA C 5 60.382 59.897 0.485 1
1 51 . 45 1 1 A 5 5 THR CB C 5 71.558 71.784 -0.226 1
1 53 . 45 1 1 A 5 5 THR N N 5 119.366 114.796 4.570 1
1 54 . 45 1 1 A 6 6 VAL H H 6 8.476 8.703 -0.227 1
1 55 . 45 1 1 A 6 6 VAL HA H 6 5.026 5.831 -0.805 1
1 63 . 45 1 1 A 6 6 VAL C C 6 176.674 174.780 1.894 1
1 64 . 45 1 1 A 6 6 VAL CA C 6 61.008 60.981 0.027 1
1 65 . 45 1 1 A 6 6 VAL CB C 6 33.861 34.530 -0.669 1
1 68 . 45 1 1 A 6 6 VAL N N 6 121.384 124.414 -3.030 1
1 69 . 45 1 1 A 7 7 ASP H H 7 8.848 8.681 0.167 1
1 70 . 45 1 1 A 7 7 ASP HA H 7 4.797 4.809 -0.012 1
1 73 . 45 1 1 A 7 7 ASP CA C 7 52.834 53.517 -0.683 1
1 74 . 45 1 1 A 7 7 ASP CB C 7 42.219 42.741 -0.522 1
1 75 . 45 1 1 A 7 7 ASP N N 7 127.061 127.080 -0.019 1
1 76 . 45 1 1 A 8 8 GLY C C 8 175.143 173.585 1.558 1
1 77 . 45 1 1 A 8 8 GLY CA C 8 46.553 46.895 -0.342 1
1 78 . 45 1 1 A 9 9 GLN H H 9 8.408 8.033 0.375 1
1 79 . 45 1 1 A 9 9 GLN HA H 9 4.541 4.832 -0.291 1
1 86 . 45 1 1 A 9 9 GLN C C 9 176.463 174.551 1.912 1
1 87 . 45 1 1 A 9 9 GLN CA C 9 55.167 53.909 1.258 1
1 88 . 45 1 1 A 9 9 GLN CB C 9 29.376 32.059 -2.683 1
1 90 . 45 1 1 A 9 9 GLN N N 9 118.300 117.577 0.723 1
1 92 . 45 1 1 A 10 10 GLY H H 10 8.162 8.329 -0.167 1
1 93 . 45 1 1 A 10 10 GLY HA2 H 10 4.174 4.032 0.142 1
1 94 . 45 1 1 A 10 10 GLY HA3 H 10 3.521 4.047 -0.526 1
1 95 . 45 1 1 A 10 10 GLY C C 10 174.092 173.052 1.040 1
1 96 . 45 1 1 A 10 10 GLY CA C 10 45.558 46.067 -0.509 1
1 97 . 45 1 1 A 10 10 GLY N N 10 108.747 108.352 0.395 1
1 98 . 45 1 1 A 11 11 GLN H H 11 8.507 7.861 0.646 1
1 99 . 45 1 1 A 11 11 GLN HA H 11 4.202 4.628 -0.426 1
1 106 . 45 1 1 A 11 11 GLN C C 11 173.992 174.894 -0.902 1
1 107 . 45 1 1 A 11 11 GLN CA C 11 55.098 55.101 -0.003 1
1 108 . 45 1 1 A 11 11 GLN CB C 11 29.097 29.911 -0.814 1
1 110 . 45 1 1 A 11 11 GLN N N 11 122.979 121.771 1.208 1
1 112 . 45 1 1 A 12 12 ALA H H 12 8.259 8.902 -0.643 1
1 113 . 45 1 1 A 12 12 ALA HA H 12 5.156 5.621 -0.465 1
1 117 . 45 1 1 A 12 12 ALA C C 12 177.284 176.510 0.774 1
1 118 . 45 1 1 A 12 12 ALA CA C 12 51.087 50.486 0.601 1
1 119 . 45 1 1 A 12 12 ALA CB C 12 20.500 20.683 -0.183 1
1 120 . 45 1 1 A 12 12 ALA N N 12 127.100 127.465 -0.365 1
1 121 . 45 1 1 A 13 13 TRP H H 13 9.245 8.809 0.436 1
1 122 . 45 1 1 A 13 13 TRP HA H 13 4.717 5.391 -0.674 1
1 131 . 45 1 1 A 13 13 TRP C C 13 175.108 174.291 0.817 1
1 132 . 45 1 1 A 13 13 TRP CA C 13 55.966 55.465 0.501 1
1 133 . 45 1 1 A 13 13 TRP CB C 13 31.912 32.215 -0.303 1
1 139 . 45 1 1 A 13 13 TRP N N 13 123.088 120.133 2.955 1
1 141 . 45 1 1 A 14 14 ARG H H 14 8.575 8.640 -0.065 1
1 142 . 45 1 1 A 14 14 ARG HA H 14 5.335 4.367 0.968 1
1 150 . 45 1 1 A 14 14 ARG C C 14 175.191 173.997 1.194 1
1 151 . 45 1 1 A 14 14 ARG CA C 14 53.106 55.064 -1.958 1
1 152 . 45 1 1 A 14 14 ARG CB C 14 32.749 31.555 1.194 1
1 154 . 45 1 1 A 14 14 ARG N N 14 121.163 119.969 1.194 1
1 156 . 45 1 1 A 15 15 HIS H H 15 8.595 7.917 0.678 1
1 157 . 45 1 1 A 15 15 HIS HA H 15 4.790 4.907 -0.117 1
1 161 . 45 1 1 A 15 15 HIS C C 15 173.770 174.333 -0.563 1
1 162 . 45 1 1 A 15 15 HIS CA C 15 55.289 54.494 0.795 1
1 163 . 45 1 1 A 15 15 HIS CB C 15 33.208 33.171 0.037 1
1 165 . 45 1 1 A 15 15 HIS N N 15 117.643 119.320 -1.677 1
1 166 . 45 1 1 A 16 16 HIS H H 16 8.993 8.773 0.220 1
1 167 . 45 1 1 A 16 16 HIS HA H 16 5.158 4.671 0.487 1
1 171 . 45 1 1 A 16 16 HIS C C 16 173.608 174.711 -1.103 1
1 172 . 45 1 1 A 16 16 HIS CA C 16 56.450 56.498 -0.048 1
1 173 . 45 1 1 A 16 16 HIS CB C 16 34.171 30.438 3.733 1
1 175 . 45 1 1 A 16 16 HIS N N 16 123.520 120.537 2.983 1
1 176 . 45 1 1 A 17 17 ASN H H 17 7.829 9.172 -1.343 1
1 177 . 45 1 1 A 17 17 ASN HA H 17 4.713 5.252 -0.539 1
1 182 . 45 1 1 A 17 17 ASN C C 17 173.682 174.877 -1.195 1
1 183 . 45 1 1 A 17 17 ASN CA C 17 51.822 51.276 0.546 1
1 184 . 45 1 1 A 17 17 ASN CB C 17 43.176 42.353 0.823 1
1 185 . 45 1 1 A 17 17 ASN N N 17 122.213 120.450 1.763 1
1 187 . 45 1 1 A 18 18 GLY H H 18 8.423 8.450 -0.027 1
1 188 . 45 1 1 A 18 18 GLY HA2 H 18 3.931 3.986 -0.055 1
1 189 . 45 1 1 A 18 18 GLY HA3 H 18 3.707 4.119 -0.412 1
1 190 . 45 1 1 A 18 18 GLY C C 18 173.985 172.775 1.210 1
1 191 . 45 1 1 A 18 18 GLY CA C 18 43.949 44.197 -0.248 1
1 192 . 45 1 1 A 18 18 GLY N N 18 106.991 110.787 -3.796 1
1 193 . 45 1 1 A 19 19 PHE H H 19 8.338 8.801 -0.463 1
1 194 . 45 1 1 A 19 19 PHE HA H 19 4.068 4.919 -0.851 1
1 197 . 45 1 1 A 19 19 PHE C C 19 176.568 175.009 1.559 1
1 198 . 45 1 1 A 19 19 PHE CA C 19 59.338 57.986 1.352 1
1 199 . 45 1 1 A 19 19 PHE CB C 19 40.201 40.492 -0.291 1
1 200 . 45 1 1 A 19 19 PHE N N 19 116.857 118.746 -1.889 1
1 201 . 45 1 1 A 20 20 ASP H H 20 8.794 9.014 -0.220 1
1 202 . 45 1 1 A 20 20 ASP HA H 20 4.485 4.992 -0.507 1
1 205 . 45 1 1 A 20 20 ASP C C 20 177.379 177.249 0.130 1
1 206 . 45 1 1 A 20 20 ASP CA C 20 54.140 54.683 -0.543 1
1 207 . 45 1 1 A 20 20 ASP CB C 20 41.915 41.397 0.518 1
1 208 . 45 1 1 A 20 20 ASP N N 20 123.025 123.788 -0.763 1
1 209 . 45 1 1 A 21 21 PHE H H 21 8.862 9.003 -0.141 1
1 210 . 45 1 1 A 21 21 PHE HA H 21 4.087 4.084 0.003 1
1 218 . 45 1 1 A 21 21 PHE C C 21 176.952 177.234 -0.282 1
1 219 . 45 1 1 A 21 21 PHE CA C 21 61.095 62.472 -1.377 1
1 220 . 45 1 1 A 21 21 PHE CB C 21 38.678 39.378 -0.700 1
1 226 . 45 1 1 A 21 21 PHE N N 21 127.163 125.776 1.387 1
1 227 . 45 1 1 A 22 22 ALA H H 22 8.561 8.390 0.171 1
1 228 . 45 1 1 A 22 22 ALA HA H 22 3.878 4.069 -0.191 1
1 232 . 45 1 1 A 22 22 ALA C C 22 180.710 179.991 0.719 1
1 233 . 45 1 1 A 22 22 ALA CA C 22 55.211 55.266 -0.055 1
1 234 . 45 1 1 A 22 22 ALA CB C 22 18.321 18.689 -0.368 1
1 235 . 45 1 1 A 22 22 ALA N N 22 120.293 121.234 -0.941 1
1 236 . 45 1 1 A 23 23 VAL H H 23 7.241 7.765 -0.524 1
1 237 . 45 1 1 A 23 23 VAL HA H 23 3.684 3.535 0.149 1
1 245 . 45 1 1 A 23 23 VAL C C 23 177.101 177.976 -0.875 1
1 246 . 45 1 1 A 23 23 VAL CA C 23 65.237 67.013 -1.776 1
1 247 . 45 1 1 A 23 23 VAL CB C 23 31.780 31.598 0.182 1
1 250 . 45 1 1 A 23 23 VAL N N 23 118.775 117.590 1.185 1
1 251 . 45 1 1 A 24 24 ILE H H 24 6.761 7.852 -1.091 1
1 252 . 45 1 1 A 24 24 ILE HA H 24 3.196 3.513 -0.317 1
1 262 . 45 1 1 A 24 24 ILE C C 24 177.287 178.102 -0.815 1
1 263 . 45 1 1 A 24 24 ILE CA C 24 63.404 65.780 -2.376 1
1 264 . 45 1 1 A 24 24 ILE CB C 24 36.294 37.661 -1.367 1
1 268 . 45 1 1 A 24 24 ILE N N 24 119.036 119.470 -0.434 1
1 269 . 45 1 1 A 25 25 LYS H H 25 8.032 8.213 -0.181 1
1 270 . 45 1 1 A 25 25 LYS HA H 25 3.809 3.728 0.081 1
1 279 . 45 1 1 A 25 25 LYS C C 25 179.450 178.578 0.872 1
1 280 . 45 1 1 A 25 25 LYS CA C 25 59.621 59.516 0.105 1
1 281 . 45 1 1 A 25 25 LYS CB C 25 32.259 32.044 0.215 1
1 285 . 45 1 1 A 25 25 LYS N N 25 118.368 119.869 -1.501 1
1 286 . 45 1 1 A 26 26 GLU H H 26 7.845 8.044 -0.199 1
1 287 . 45 1 1 A 26 26 GLU HA H 26 4.021 4.067 -0.046 1
1 292 . 45 1 1 A 26 26 GLU C C 26 179.191 178.795 0.396 1
1 293 . 45 1 1 A 26 26 GLU CA C 26 59.530 59.217 0.313 1
1 294 . 45 1 1 A 26 26 GLU CB C 26 29.449 29.392 0.057 1
1 296 . 45 1 1 A 26 26 GLU N N 26 120.522 119.180 1.342 1
1 297 . 45 1 1 A 27 27 LEU H H 27 8.165 8.227 -0.062 1
1 298 . 45 1 1 A 27 27 LEU HA H 27 4.163 4.119 0.044 1
1 308 . 45 1 1 A 27 27 LEU C C 27 177.256 178.449 -1.193 1
1 309 . 45 1 1 A 27 27 LEU CA C 27 58.049 57.779 0.270 1
1 310 . 45 1 1 A 27 27 LEU CB C 27 41.365 41.901 -0.536 1
1 314 . 45 1 1 A 27 27 LEU N N 27 120.879 121.095 -0.216 1
1 315 . 45 1 1 A 28 28 LYS H H 28 8.902 8.341 0.561 1
1 316 . 45 1 1 A 28 28 LYS HA H 28 4.199 4.283 -0.084 1
1 317 . 45 1 1 A 28 28 LYS C C 28 179.707 179.188 0.519 1
1 318 . 45 1 1 A 28 28 LYS CA C 28 60.097 59.229 0.868 1
1 319 . 45 1 1 A 28 28 LYS CB C 28 33.420 31.946 1.474 1
1 320 . 45 1 1 A 28 28 LYS N N 28 120.050 119.400 0.650 1
1 321 . 45 1 1 A 29 29 THR H H 29 8.294 8.159 0.135 1
1 322 . 45 1 1 A 29 29 THR HA H 29 3.892 3.940 -0.048 1
1 327 . 45 1 1 A 29 29 THR C C 29 175.711 176.926 -1.215 1
1 328 . 45 1 1 A 29 29 THR CA C 29 66.846 66.557 0.289 1
1 329 . 45 1 1 A 29 29 THR CB C 29 68.794 68.773 0.021 1
1 331 . 45 1 1 A 29 29 THR N N 29 115.933 116.570 -0.637 1
1 332 . 45 1 1 A 30 30 ALA H H 30 8.244 8.415 -0.171 1
1 333 . 45 1 1 A 30 30 ALA HA H 30 4.241 4.310 -0.069 1
1 337 . 45 1 1 A 30 30 ALA C C 30 179.128 179.730 -0.602 1
1 338 . 45 1 1 A 30 30 ALA CA C 30 55.714 55.202 0.512 1
1 339 . 45 1 1 A 30 30 ALA CB C 30 18.955 18.475 0.480 1
1 340 . 45 1 1 A 30 30 ALA N N 30 124.617 123.883 0.734 1
1 341 . 45 1 1 A 31 31 ALA H H 31 8.968 8.560 0.408 1
1 342 . 45 1 1 A 31 31 ALA HA H 31 3.890 4.178 -0.288 1
1 346 . 45 1 1 A 31 31 ALA C C 31 180.352 179.670 0.682 1
1 347 . 45 1 1 A 31 31 ALA CA C 31 55.454 55.322 0.132 1
1 348 . 45 1 1 A 31 31 ALA CB C 31 17.124 18.345 -1.221 1
1 349 . 45 1 1 A 31 31 ALA N N 31 119.327 120.880 -1.553 1
1 350 . 45 1 1 A 32 32 SER H H 32 7.995 7.939 0.056 1
1 351 . 45 1 1 A 32 32 SER HA H 32 4.238 4.322 -0.084 1
1 354 . 45 1 1 A 32 32 SER C C 32 175.612 176.410 -0.798 1
1 355 . 45 1 1 A 32 32 SER CA C 32 61.203 61.086 0.117 1
1 356 . 45 1 1 A 32 32 SER CB C 32 63.406 63.258 0.148 1
1 357 . 45 1 1 A 32 32 SER N N 32 111.962 112.310 -0.348 1
1 358 . 45 1 1 A 33 33 GLN H H 33 8.333 7.903 0.430 1
1 359 . 45 1 1 A 33 33 GLN HA H 33 3.992 4.200 -0.208 1
1 366 . 45 1 1 A 33 33 GLN C C 33 177.486 177.194 0.292 1
1 367 . 45 1 1 A 33 33 GLN CA C 33 58.277 57.967 0.310 1
1 368 . 45 1 1 A 33 33 GLN CB C 33 29.140 29.372 -0.232 1
1 370 . 45 1 1 A 33 33 GLN N N 33 119.527 121.187 -1.660 1
1 372 . 45 1 1 A 34 34 TYR H H 34 8.587 8.339 0.248 1
1 373 . 45 1 1 A 34 34 TYR HA H 34 4.792 4.647 0.145 1
1 380 . 45 1 1 A 34 34 TYR C C 34 176.499 176.810 -0.311 1
1 381 . 45 1 1 A 34 34 TYR CA C 34 57.711 58.604 -0.893 1
1 382 . 45 1 1 A 34 34 TYR CB C 34 39.561 39.357 0.204 1
1 387 . 45 1 1 A 34 34 TYR N N 34 114.610 115.900 -1.290 1
1 388 . 45 1 1 A 35 35 GLY H H 35 7.346 7.945 -0.599 1
1 389 . 45 1 1 A 35 35 GLY HA2 H 35 4.785 4.106 0.679 1
1 390 . 45 1 1 A 35 35 GLY HA3 H 35 4.007 4.107 -0.100 1
1 391 . 45 1 1 A 35 35 GLY C C 35 175.796 173.351 2.445 1
1 392 . 45 1 1 A 35 35 GLY CA C 35 44.355 44.734 -0.379 1
1 393 . 45 1 1 A 35 35 GLY N N 35 108.501 106.525 1.976 1
1 394 . 45 1 1 A 36 36 ALA H H 36 9.363 8.425 0.938 1
1 395 . 45 1 1 A 36 36 ALA HA H 36 4.217 4.644 -0.427 1
1 399 . 45 1 1 A 36 36 ALA C C 36 178.039 177.435 0.604 1
1 400 . 45 1 1 A 36 36 ALA CA C 36 56.114 51.780 4.334 1
1 401 . 45 1 1 A 36 36 ALA CB C 36 19.179 18.499 0.680 1
1 402 . 45 1 1 A 36 36 ALA N N 36 125.811 123.247 2.564 1
1 403 . 45 1 1 A 37 37 THR H H 37 8.070 8.340 -0.270 1
1 404 . 45 1 1 A 37 37 THR HA H 37 4.570 4.526 0.044 1
1 409 . 45 1 1 A 37 37 THR C C 37 173.685 174.065 -0.380 1
1 410 . 45 1 1 A 37 37 THR CA C 37 59.822 62.933 -3.111 1
1 411 . 45 1 1 A 37 37 THR CB C 37 68.267 71.732 -3.465 1
1 413 . 45 1 1 A 37 37 THR N N 37 129.410 118.510 10.900 1
1 414 . 45 1 1 A 38 38 ALA H H 38 6.853 7.532 -0.679 1
1 415 . 45 1 1 A 38 38 ALA HA H 38 4.601 4.603 -0.002 1
1 419 . 45 1 1 A 38 38 ALA CA C 38 50.758 50.558 0.200 1
1 420 . 45 1 1 A 38 38 ALA CB C 38 18.325 19.606 -1.281 1
1 421 . 45 1 1 A 38 38 ALA N N 38 124.674 124.839 -0.165 1
1 422 . 45 1 1 A 40 40 TYR HA H 40 4.032 3.980 0.052 1
1 429 . 45 1 1 A 40 40 TYR C C 40 176.456 177.315 -0.859 1
1 430 . 45 1 1 A 40 40 TYR CA C 40 61.010 61.901 -0.891 1
1 431 . 45 1 1 A 40 40 TYR CB C 40 39.286 38.523 0.763 1
1 436 . 45 1 1 A 41 41 THR H H 41 6.874 7.811 -0.937 1
1 437 . 45 1 1 A 41 41 THR HA H 41 3.616 3.801 -0.185 1
1 442 . 45 1 1 A 41 41 THR C C 41 176.930 176.703 0.227 1
1 443 . 45 1 1 A 41 41 THR CA C 41 65.557 65.502 0.055 1
1 444 . 45 1 1 A 41 41 THR CB C 41 68.228 68.911 -0.683 1
1 446 . 45 1 1 A 41 41 THR N N 41 115.143 113.868 1.275 1
1 447 . 45 1 1 A 42 42 LEU H H 42 8.623 7.305 1.318 1
1 448 . 45 1 1 A 42 42 LEU HA H 42 3.708 4.139 -0.431 1
1 458 . 45 1 1 A 42 42 LEU C C 42 178.206 179.132 -0.926 1
1 459 . 45 1 1 A 42 42 LEU CA C 42 57.417 57.491 -0.074 1
1 460 . 45 1 1 A 42 42 LEU CB C 42 41.342 41.271 0.071 1
1 464 . 45 1 1 A 42 42 LEU N N 42 120.418 119.509 0.909 1
1 465 . 45 1 1 A 43 43 ALA H H 43 7.735 8.153 -0.418 1
1 466 . 45 1 1 A 43 43 ALA HA H 43 4.020 3.982 0.038 1
1 470 . 45 1 1 A 43 43 ALA C C 43 180.826 180.560 0.266 1
1 471 . 45 1 1 A 43 43 ALA CA C 43 54.925 55.066 -0.141 1
1 472 . 45 1 1 A 43 43 ALA CB C 43 17.506 18.257 -0.751 1
1 473 . 45 1 1 A 43 43 ALA N N 43 120.203 121.850 -1.647 1
1 474 . 45 1 1 A 44 44 ILE H H 44 7.149 7.357 -0.208 1
1 475 . 45 1 1 A 44 44 ILE HA H 44 3.603 3.573 0.030 1
1 485 . 45 1 1 A 44 44 ILE C C 44 178.594 178.260 0.334 1
1 486 . 45 1 1 A 44 44 ILE CA C 44 64.782 64.586 0.196 1
1 487 . 45 1 1 A 44 44 ILE CB C 44 37.472 37.777 -0.305 1
1 491 . 45 1 1 A 44 44 ILE N N 44 118.881 119.399 -0.518 1
1 492 . 45 1 1 A 45 45 VAL H H 45 7.968 7.757 0.211 1
1 493 . 45 1 1 A 45 45 VAL HA H 45 2.925 3.374 -0.449 1
1 501 . 45 1 1 A 45 45 VAL C C 45 177.023 177.601 -0.578 1
1 502 . 45 1 1 A 45 45 VAL CA C 45 67.081 66.873 0.208 1
1 503 . 45 1 1 A 45 45 VAL CB C 45 30.854 31.454 -0.600 1
1 506 . 45 1 1 A 45 45 VAL N N 45 120.764 119.800 0.964 1
1 507 . 45 1 1 A 46 46 GLU H H 46 8.399 8.832 -0.433 1
1 508 . 45 1 1 A 46 46 GLU HA H 46 3.848 3.853 -0.005 1
1 513 . 45 1 1 A 46 46 GLU C C 46 178.656 179.214 -0.558 1
1 514 . 45 1 1 A 46 46 GLU CA C 46 59.491 59.709 -0.218 1
1 515 . 45 1 1 A 46 46 GLU CB C 46 28.991 29.094 -0.103 1
1 517 . 45 1 1 A 46 46 GLU N N 46 116.599 119.422 -2.823 1
1 518 . 45 1 1 A 47 47 SER H H 47 7.273 7.984 -0.711 1
1 519 . 45 1 1 A 47 47 SER HA H 47 4.287 4.143 0.144 1
1 521 . 45 1 1 A 47 47 SER CA C 47 61.047 62.235 -1.188 1
1 522 . 45 1 1 A 47 47 SER CB C 47 63.016 62.813 0.203 1
1 523 . 45 1 1 A 47 47 SER N N 47 113.609 117.375 -3.766 1
1 524 . 45 1 1 A 48 48 VAL H H 48 8.006 8.019 -0.013 1
1 525 . 45 1 1 A 48 48 VAL HA H 48 3.556 3.533 0.023 1
1 533 . 45 1 1 A 48 48 VAL C C 48 177.257 176.626 0.631 1
1 534 . 45 1 1 A 48 48 VAL CA C 48 65.025 66.397 -1.372 1
1 535 . 45 1 1 A 48 48 VAL CB C 48 31.841 31.444 0.397 1
1 538 . 45 1 1 A 48 48 VAL N N 48 122.327 121.617 0.710 1
1 539 . 45 1 1 A 49 49 ALA H H 49 8.369 7.905 0.464 1
1 540 . 45 1 1 A 49 49 ALA HA H 49 4.115 4.290 -0.175 1
1 544 . 45 1 1 A 49 49 ALA C C 49 177.307 178.048 -0.741 1
1 545 . 45 1 1 A 49 49 ALA CA C 49 53.253 52.864 0.389 1
1 546 . 45 1 1 A 49 49 ALA CB C 49 20.131 18.523 1.608 1
1 547 . 45 1 1 A 49 49 ALA N N 49 118.050 120.412 -2.362 1
1 548 . 45 1 1 A 50 50 ASP H H 50 7.052 7.616 -0.564 1
1 549 . 45 1 1 A 50 50 ASP HA H 50 4.788 4.343 0.445 1
1 552 . 45 1 1 A 50 50 ASP C C 50 175.481 175.649 -0.168 1
1 553 . 45 1 1 A 50 50 ASP CA C 50 53.681 56.506 -2.825 1
1 554 . 45 1 1 A 50 50 ASP CB C 50 39.333 40.593 -1.260 1
1 555 . 45 1 1 A 50 50 ASP N N 50 116.997 117.743 -0.746 1
1 556 . 45 1 1 A 51 51 ASN H H 51 8.535 7.219 1.316 1
1 557 . 45 1 1 A 51 51 ASN HA H 51 4.628 4.675 -0.047 1
1 562 . 45 1 1 A 51 51 ASN C C 51 174.077 174.619 -0.542 1
1 563 . 45 1 1 A 51 51 ASN CA C 51 52.315 51.300 1.015 1
1 564 . 45 1 1 A 51 51 ASN CB C 51 41.928 41.353 0.575 1
1 565 . 45 1 1 A 51 51 ASN N N 51 118.626 113.787 4.839 1
1 567 . 45 1 1 A 52 52 TRP H H 52 8.555 8.100 0.455 1
1 574 . 45 1 1 A 52 52 TRP C C 52 173.269 176.413 -3.144 1
1 575 . 45 1 1 A 52 52 TRP CA C 52 55.031 57.154 -2.123 1
1 576 . 45 1 1 A 52 52 TRP CB C 52 26.801 30.011 -3.210 1
1 582 . 45 1 1 A 52 52 TRP N N 52 120.693 121.886 -1.193 1
1 584 . 45 1 1 A 53 53 LEU H H 53 7.847 8.685 -0.838 1
1 585 . 45 1 1 A 53 53 LEU HA H 53 4.859 4.980 -0.121 1
1 595 . 45 1 1 A 53 53 LEU C C 53 177.397 175.464 1.933 1
1 596 . 45 1 1 A 53 53 LEU CA C 53 53.619 53.045 0.574 1
1 597 . 45 1 1 A 53 53 LEU CB C 53 41.812 44.819 -3.007 1
1 601 . 45 1 1 A 53 53 LEU N N 53 124.741 124.596 0.145 1
1 602 . 45 1 1 A 54 54 THR H H 54 8.850 8.382 0.468 1
1 603 . 45 1 1 A 54 54 THR HA H 54 4.598 4.502 0.096 1
1 608 . 45 1 1 A 54 54 THR CA C 54 60.531 60.550 -0.019 1
1 609 . 45 1 1 A 54 54 THR CB C 54 67.183 68.518 -1.335 1
1 611 . 45 1 1 A 54 54 THR N N 54 113.407 117.627 -4.220 1
1 612 . 45 1 1 A 55 55 PRO HA H 55 4.511 4.673 -0.162 1
1 619 . 45 1 1 A 55 55 PRO C C 55 179.383 178.381 1.002 1
1 620 . 45 1 1 A 55 55 PRO CA C 55 67.159 66.322 0.837 1
1 621 . 45 1 1 A 55 55 PRO CB C 55 32.095 32.023 0.072 1
1 622 . 45 1 1 A 56 56 THR H H 56 8.575 7.795 0.780 1
1 623 . 45 1 1 A 56 56 THR HA H 56 4.229 4.219 0.010 1
1 628 . 45 1 1 A 56 56 THR C C 56 176.668 176.322 0.346 1
1 629 . 45 1 1 A 56 56 THR CA C 56 66.943 64.968 1.975 1
1 630 . 45 1 1 A 56 56 THR CB C 56 68.129 69.033 -0.904 1
1 632 . 45 1 1 A 56 56 THR N N 56 114.855 110.448 4.407 1
1 633 . 45 1 1 A 57 57 ASP H H 57 8.730 8.161 0.569 1
1 634 . 45 1 1 A 57 57 ASP HA H 57 4.425 4.680 -0.255 1
1 637 . 45 1 1 A 57 57 ASP C C 57 178.351 178.804 -0.453 1
1 638 . 45 1 1 A 57 57 ASP CA C 57 57.963 57.348 0.615 1
1 639 . 45 1 1 A 57 57 ASP CB C 57 40.134 40.904 -0.770 1
1 640 . 45 1 1 A 57 57 ASP N N 57 126.239 121.331 4.908 1
1 641 . 45 1 1 A 58 58 TRP H H 58 8.244 8.799 -0.555 1
1 642 . 45 1 1 A 58 58 TRP HA H 58 4.030 4.620 -0.590 1
1 650 . 45 1 1 A 58 58 TRP C C 58 177.432 179.426 -1.994 1
1 651 . 45 1 1 A 58 58 TRP CA C 58 62.731 60.296 2.435 1
1 652 . 45 1 1 A 58 58 TRP CB C 58 29.122 29.389 -0.267 1
1 657 . 45 1 1 A 58 58 TRP N N 58 119.241 121.078 -1.837 1
1 659 . 45 1 1 A 59 59 ASN H H 59 8.098 8.861 -0.763 1
1 660 . 45 1 1 A 59 59 ASN HA H 59 4.424 4.415 0.009 1
1 663 . 45 1 1 A 59 59 ASN C C 59 176.952 178.212 -1.260 1
1 664 . 45 1 1 A 59 59 ASN CA C 59 58.135 56.547 1.588 1
1 665 . 45 1 1 A 59 59 ASN CB C 59 40.168 38.442 1.726 1
1 666 . 45 1 1 A 59 59 ASN N N 59 115.747 117.873 -2.126 1
1 667 . 45 1 1 A 60 60 THR H H 60 8.712 8.012 0.700 1
1 668 . 45 1 1 A 60 60 THR HA H 60 3.717 4.055 -0.338 1
1 673 . 45 1 1 A 60 60 THR C C 60 176.044 176.686 -0.642 1
1 674 . 45 1 1 A 60 60 THR CA C 60 66.576 67.115 -0.539 1
1 675 . 45 1 1 A 60 60 THR CB C 60 69.251 67.936 1.315 1
1 677 . 45 1 1 A 60 60 THR N N 60 114.896 118.289 -3.393 1
1 678 . 45 1 1 A 61 61 LEU H H 61 8.485 8.213 0.272 1
1 679 . 45 1 1 A 61 61 LEU HA H 61 3.391 4.128 -0.737 1
1 689 . 45 1 1 A 61 61 LEU C C 61 177.433 178.747 -1.314 1
1 690 . 45 1 1 A 61 61 LEU CA C 61 58.354 58.434 -0.080 1
1 691 . 45 1 1 A 61 61 LEU CB C 61 41.761 42.140 -0.379 1
1 695 . 45 1 1 A 61 61 LEU N N 61 123.433 122.030 1.403 1
1 696 . 45 1 1 A 62 62 VAL H H 62 8.073 8.508 -0.435 1
1 697 . 45 1 1 A 62 62 VAL HA H 62 3.207 3.832 -0.625 1
1 705 . 45 1 1 A 62 62 VAL C C 62 177.585 177.541 0.044 1
1 706 . 45 1 1 A 62 62 VAL CA C 62 67.345 65.275 2.070 1
1 707 . 45 1 1 A 62 62 VAL CB C 62 30.905 30.487 0.418 1
1 710 . 45 1 1 A 62 62 VAL N N 62 116.018 118.645 -2.627 1
1 711 . 45 1 1 A 63 63 ARG H H 63 7.765 7.991 -0.226 1
1 712 . 45 1 1 A 63 63 ARG HA H 63 3.602 4.054 -0.452 1
1 719 . 45 1 1 A 63 63 ARG C C 63 177.818 178.247 -0.429 1
1 720 . 45 1 1 A 63 63 ARG CA C 63 58.049 57.964 0.085 1
1 721 . 45 1 1 A 63 63 ARG CB C 63 29.955 29.109 0.846 1
1 724 . 45 1 1 A 63 63 ARG N N 63 116.700 121.099 -4.399 1
1 725 . 45 1 1 A 64 64 ALA H H 64 7.574 7.487 0.087 1
1 726 . 45 1 1 A 64 64 ALA HA H 64 4.158 4.361 -0.203 1
1 730 . 45 1 1 A 64 64 ALA C C 64 179.886 179.422 0.464 1
1 731 . 45 1 1 A 64 64 ALA CA C 64 54.007 53.995 0.012 1
1 732 . 45 1 1 A 64 64 ALA CB C 64 19.147 19.625 -0.478 1
1 733 . 45 1 1 A 64 64 ALA N N 64 117.555 122.162 -4.607 1
1 734 . 45 1 1 A 65 65 VAL H H 65 7.554 8.096 -0.542 1
1 735 . 45 1 1 A 65 65 VAL HA H 65 4.253 3.757 0.496 1
1 743 . 45 1 1 A 65 65 VAL C C 65 174.180 176.320 -2.140 1
1 744 . 45 1 1 A 65 65 VAL CA C 65 62.683 65.391 -2.708 1
1 745 . 45 1 1 A 65 65 VAL CB C 65 33.458 31.409 2.049 1
1 748 . 45 1 1 A 65 65 VAL N N 65 110.013 115.808 -5.795 1
1 749 . 45 1 1 A 66 66 LEU H H 66 7.792 7.305 0.487 1
1 750 . 45 1 1 A 66 66 LEU HA H 66 4.790 4.798 -0.008 1
1 760 . 45 1 1 A 66 66 LEU C C 66 177.537 175.644 1.893 1
1 761 . 45 1 1 A 66 66 LEU CA C 66 52.823 52.698 0.125 1
1 762 . 45 1 1 A 66 66 LEU CB C 66 44.071 45.611 -1.540 1
1 766 . 45 1 1 A 66 66 LEU N N 66 118.967 120.731 -1.764 1
1 767 . 45 1 1 A 67 67 SER H H 67 9.208 8.420 0.788 1
1 768 . 45 1 1 A 67 67 SER HA H 67 4.414 4.763 -0.349 1
1 771 . 45 1 1 A 67 67 SER CA C 67 57.943 57.386 0.557 1
1 772 . 45 1 1 A 67 67 SER CB C 67 64.743 65.415 -0.672 1
1 773 . 45 1 1 A 67 67 SER N N 67 116.378 115.993 0.385 1
1 774 . 45 1 1 A 69 69 GLY HA2 H 69 3.916 3.734 0.182 1
1 775 . 45 1 1 A 69 69 GLY HA3 H 69 3.867 3.778 0.089 1
1 776 . 45 1 1 A 69 69 GLY C C 69 176.783 175.371 1.412 1
1 777 . 45 1 1 A 69 69 GLY CA C 69 46.977 46.961 0.016 1
1 778 . 45 1 1 A 70 70 ASP H H 70 7.674 8.153 -0.479 1
1 779 . 45 1 1 A 70 70 ASP HA H 70 4.511 3.654 0.857 1
1 782 . 45 1 1 A 70 70 ASP C C 70 178.096 178.134 -0.038 1
1 783 . 45 1 1 A 70 70 ASP CA C 70 57.262 56.248 1.014 1
1 784 . 45 1 1 A 70 70 ASP CB C 70 40.594 39.561 1.033 1
1 785 . 45 1 1 A 70 70 ASP N N 70 123.930 122.158 1.772 1
1 786 . 45 1 1 A 71 71 HIS H H 71 8.729 7.923 0.806 1
1 787 . 45 1 1 A 71 71 HIS HA H 71 4.235 4.154 0.081 1
1 790 . 45 1 1 A 71 71 HIS C C 71 176.769 176.732 0.037 1
1 791 . 45 1 1 A 71 71 HIS CA C 71 60.041 59.931 0.110 1
1 792 . 45 1 1 A 71 71 HIS CB C 71 30.682 30.038 0.644 1
1 793 . 45 1 1 A 71 71 HIS N N 71 121.003 119.891 1.112 1
1 794 . 45 1 1 A 72 72 LEU H H 72 7.620 7.633 -0.013 1
1 795 . 45 1 1 A 72 72 LEU HA H 72 3.769 4.004 -0.235 1
1 805 . 45 1 1 A 72 72 LEU C C 72 180.275 179.301 0.974 1
1 806 . 45 1 1 A 72 72 LEU CA C 72 58.192 58.084 0.108 1
1 807 . 45 1 1 A 72 72 LEU CB C 72 41.381 41.265 0.116 1
1 811 . 45 1 1 A 72 72 LEU N N 72 118.569 117.940 0.629 1
1 812 . 45 1 1 A 73 73 LEU H H 73 7.542 7.799 -0.257 1
1 813 . 45 1 1 A 73 73 LEU HA H 73 4.107 4.272 -0.165 1
1 823 . 45 1 1 A 73 73 LEU C C 73 179.436 179.305 0.131 1
1 824 . 45 1 1 A 73 73 LEU CA C 73 58.026 57.252 0.774 1
1 825 . 45 1 1 A 73 73 LEU CB C 73 41.638 42.107 -0.469 1
1 829 . 45 1 1 A 73 73 LEU N N 73 121.418 120.552 0.866 1
1 830 . 45 1 1 A 74 74 TRP H H 74 8.786 8.006 0.780 1
1 831 . 45 1 1 A 74 74 TRP HA H 74 3.589 5.405 -1.816 1
1 840 . 45 1 1 A 74 74 TRP C C 74 176.816 178.792 -1.976 1
1 841 . 45 1 1 A 74 74 TRP CA C 74 63.046 59.840 3.206 1
1 842 . 45 1 1 A 74 74 TRP CB C 74 28.065 28.896 -0.831 1
1 848 . 45 1 1 A 74 74 TRP N N 74 121.111 118.151 2.960 1
1 850 . 45 1 1 A 75 75 LYS H H 75 8.939 7.734 1.205 1
1 851 . 45 1 1 A 75 75 LYS HA H 75 3.055 4.166 -1.111 1
1 860 . 45 1 1 A 75 75 LYS C C 75 177.967 179.396 -1.429 1
1 861 . 45 1 1 A 75 75 LYS CA C 75 60.029 58.597 1.432 1
1 862 . 45 1 1 A 75 75 LYS CB C 75 32.533 32.881 -0.348 1
1 866 . 45 1 1 A 75 75 LYS N N 75 119.783 118.634 1.149 1
1 867 . 45 1 1 A 76 76 SER H H 76 7.832 8.042 -0.210 1
1 868 . 45 1 1 A 76 76 SER HA H 76 4.040 4.378 -0.338 1
1 871 . 45 1 1 A 76 76 SER C C 76 177.816 177.323 0.493 1
1 872 . 45 1 1 A 76 76 SER CA C 76 62.105 62.496 -0.391 1
1 873 . 45 1 1 A 76 76 SER CB C 76 62.679 62.928 -0.249 1
1 874 . 45 1 1 A 76 76 SER N N 76 113.395 117.369 -3.974 1
1 875 . 45 1 1 A 77 77 GLU H H 77 7.590 7.640 -0.050 1
1 876 . 45 1 1 A 77 77 GLU HA H 77 4.042 4.173 -0.131 1
1 881 . 45 1 1 A 77 77 GLU C C 77 177.809 178.863 -1.054 1
1 882 . 45 1 1 A 77 77 GLU CA C 77 58.270 58.998 -0.728 1
1 883 . 45 1 1 A 77 77 GLU CB C 77 29.208 29.433 -0.225 1
1 885 . 45 1 1 A 77 77 GLU N N 77 121.574 122.505 -0.931 1
1 886 . 45 1 1 A 78 78 PHE H H 78 9.081 7.805 1.276 1
1 887 . 45 1 1 A 78 78 PHE HA H 78 3.778 4.205 -0.427 1
1 895 . 45 1 1 A 78 78 PHE C C 78 178.114 177.394 0.720 1
1 896 . 45 1 1 A 78 78 PHE CA C 78 60.629 61.344 -0.715 1
1 897 . 45 1 1 A 78 78 PHE CB C 78 38.295 38.637 -0.342 1
1 902 . 45 1 1 A 78 78 PHE N N 78 122.682 121.340 1.342 1
1 903 . 45 1 1 A 79 79 PHE H H 79 8.890 8.160 0.730 1
1 904 . 45 1 1 A 79 79 PHE HA H 79 3.800 3.998 -0.198 1
1 912 . 45 1 1 A 79 79 PHE C C 79 178.354 178.303 0.051 1
1 913 . 45 1 1 A 79 79 PHE CA C 79 60.704 61.779 -1.075 1
1 914 . 45 1 1 A 79 79 PHE CB C 79 37.184 38.369 -1.185 1
1 920 . 45 1 1 A 79 79 PHE N N 79 121.056 118.212 2.844 1
1 921 . 45 1 1 A 80 80 GLU H H 80 7.793 8.300 -0.507 1
1 922 . 45 1 1 A 80 80 GLU HA H 80 4.082 3.970 0.112 1
1 927 . 45 1 1 A 80 80 GLU C C 80 179.068 179.170 -0.102 1
1 928 . 45 1 1 A 80 80 GLU CA C 80 59.735 59.652 0.083 1
1 929 . 45 1 1 A 80 80 GLU CB C 80 28.722 29.043 -0.321 1
1 931 . 45 1 1 A 80 80 GLU N N 80 120.312 118.388 1.924 1
1 932 . 45 1 1 A 81 81 ASN H H 81 8.624 8.932 -0.308 1
1 933 . 45 1 1 A 81 81 ASN HA H 81 4.521 4.429 0.092 1
1 938 . 45 1 1 A 81 81 ASN C C 81 179.262 177.557 1.705 1
1 939 . 45 1 1 A 81 81 ASN CA C 81 55.504 55.839 -0.335 1
1 940 . 45 1 1 A 81 81 ASN CB C 81 37.517 37.339 0.178 1
1 941 . 45 1 1 A 81 81 ASN N N 81 119.338 117.050 2.288 1
1 943 . 45 1 1 A 82 82 CYS H H 82 8.554 7.891 0.663 1
1 944 . 45 1 1 A 82 82 CYS HA H 82 3.792 4.100 -0.308 1
1 947 . 45 1 1 A 82 82 CYS C C 82 176.478 176.728 -0.250 1
1 948 . 45 1 1 A 82 82 CYS CA C 82 65.232 61.911 3.321 1
1 949 . 45 1 1 A 82 82 CYS CB C 82 26.762 26.801 -0.039 1
1 950 . 45 1 1 A 82 82 CYS N N 82 120.576 117.863 2.713 1
1 951 . 45 1 1 A 83 83 ARG H H 83 8.522 7.878 0.644 1
1 952 . 45 1 1 A 83 83 ARG HA H 83 3.932 4.235 -0.303 1
1 960 . 45 1 1 A 83 83 ARG C C 83 179.138 178.725 0.413 1
1 961 . 45 1 1 A 83 83 ARG CA C 83 60.443 59.661 0.782 1
1 962 . 45 1 1 A 83 83 ARG CB C 83 29.550 29.906 -0.356 1
1 965 . 45 1 1 A 83 83 ARG N N 83 123.035 120.295 2.740 1
1 967 . 45 1 1 A 84 84 ASP H H 84 7.791 8.316 -0.525 1
1 968 . 45 1 1 A 84 84 ASP HA H 84 4.353 4.368 -0.015 1
1 971 . 45 1 1 A 84 84 ASP C C 84 178.649 178.937 -0.288 1
1 972 . 45 1 1 A 84 84 ASP CA C 84 57.767 57.704 0.063 1
1 973 . 45 1 1 A 84 84 ASP CB C 84 41.305 41.868 -0.563 1
1 974 . 45 1 1 A 84 84 ASP N N 84 120.332 119.484 0.848 1
1 975 . 45 1 1 A 85 85 THR H H 85 8.370 8.011 0.359 1
1 976 . 45 1 1 A 85 85 THR HA H 85 3.730 3.932 -0.202 1
1 981 . 45 1 1 A 85 85 THR C C 85 175.198 176.422 -1.224 1
1 982 . 45 1 1 A 85 85 THR CA C 85 66.830 66.322 0.508 1
1 983 . 45 1 1 A 85 85 THR CB C 85 68.533 68.532 0.001 1
1 985 . 45 1 1 A 85 85 THR N N 85 117.360 115.764 1.596 1
1 986 . 45 1 1 A 86 86 ALA H H 86 8.845 8.354 0.491 1
1 987 . 45 1 1 A 86 86 ALA HA H 86 3.991 4.085 -0.094 1
1 991 . 45 1 1 A 86 86 ALA C C 86 179.980 179.569 0.411 1
1 992 . 45 1 1 A 86 86 ALA CA C 86 55.769 55.731 0.038 1
1 993 . 45 1 1 A 86 86 ALA CB C 86 17.881 18.706 -0.825 1
1 994 . 45 1 1 A 86 86 ALA N N 86 123.613 123.640 -0.027 1
1 995 . 45 1 1 A 87 87 LYS H H 87 7.686 8.202 -0.516 1
1 996 . 45 1 1 A 87 87 LYS HA H 87 4.099 4.026 0.073 1
1 1005 . 45 1 1 A 87 87 LYS C C 87 179.592 178.797 0.795 1
1 1006 . 45 1 1 A 87 87 LYS CA C 87 59.708 59.200 0.508 1
1 1007 . 45 1 1 A 87 87 LYS CB C 87 32.054 31.826 0.228 1
1 1011 . 45 1 1 A 87 87 LYS N N 87 119.623 116.578 3.045 1
1 1012 . 45 1 1 A 88 88 ARG H H 88 7.683 7.660 0.023 1
1 1013 . 45 1 1 A 88 88 ARG HA H 88 4.051 4.163 -0.112 1
1 1020 . 45 1 1 A 88 88 ARG C C 88 180.053 178.832 1.221 1
1 1021 . 45 1 1 A 88 88 ARG CA C 88 59.558 59.048 0.510 1
1 1022 . 45 1 1 A 88 88 ARG CB C 88 29.684 29.956 -0.272 1
1 1025 . 45 1 1 A 88 88 ARG N N 88 120.788 119.576 1.212 1
1 1026 . 45 1 1 A 89 89 ASN H H 89 8.973 8.383 0.590 1
1 1027 . 45 1 1 A 89 89 ASN HA H 89 4.354 4.618 -0.264 1
1 1032 . 45 1 1 A 89 89 ASN C C 89 178.382 178.665 -0.283 1
1 1033 . 45 1 1 A 89 89 ASN CA C 89 55.334 55.857 -0.523 1
1 1034 . 45 1 1 A 89 89 ASN CB C 89 37.864 37.862 0.002 1
1 1035 . 45 1 1 A 89 89 ASN N N 89 121.012 117.743 3.269 1
1 1037 . 45 1 1 A 90 90 GLN H H 90 8.152 7.977 0.175 1
1 1038 . 45 1 1 A 90 90 GLN HA H 90 4.020 4.127 -0.107 1
1 1045 . 45 1 1 A 90 90 GLN C C 90 179.075 178.701 0.374 1
1 1046 . 45 1 1 A 90 90 GLN CA C 90 59.318 58.906 0.412 1
1 1047 . 45 1 1 A 90 90 GLN CB C 90 28.049 28.256 -0.207 1
1 1049 . 45 1 1 A 90 90 GLN N N 90 122.122 120.970 1.152 1
1 1051 . 45 1 1 A 91 91 GLN H H 91 7.514 8.495 -0.981 1
1 1052 . 45 1 1 A 91 91 GLN HA H 91 4.053 4.053 0.000 1
1 1059 . 45 1 1 A 91 91 GLN C C 91 177.081 177.135 -0.054 1
1 1060 . 45 1 1 A 91 91 GLN CA C 91 58.031 58.450 -0.419 1
1 1061 . 45 1 1 A 91 91 GLN CB C 91 28.365 27.828 0.537 1
1 1063 . 45 1 1 A 91 91 GLN N N 91 118.124 118.074 0.050 1
1 1065 . 45 1 1 A 92 92 ALA H H 92 7.704 7.248 0.456 1
1 1066 . 45 1 1 A 92 92 ALA HA H 92 4.246 4.382 -0.136 1
1 1070 . 45 1 1 A 92 92 ALA C C 92 178.450 177.691 0.759 1
1 1071 . 45 1 1 A 92 92 ALA CA C 92 52.671 51.927 0.744 1
1 1072 . 45 1 1 A 92 92 ALA CB C 92 19.316 19.659 -0.343 1
1 1073 . 45 1 1 A 92 92 ALA N N 92 119.880 119.983 -0.103 1
1 1074 . 45 1 1 A 93 93 GLY H H 93 7.693 7.828 -0.135 1
1 1075 . 45 1 1 A 93 93 GLY HA2 H 93 3.941 3.888 0.053 1
1 1076 . 45 1 1 A 93 93 GLY HA3 H 93 3.744 3.894 -0.150 1
1 1077 . 45 1 1 A 93 93 GLY C C 93 174.344 174.519 -0.175 1
1 1078 . 45 1 1 A 93 93 GLY CA C 93 45.949 46.598 -0.649 1
1 1079 . 45 1 1 A 93 93 GLY N N 93 105.347 107.707 -2.360 1
1 1080 . 45 1 1 A 94 94 ASN H H 94 7.076 8.597 -1.521 1
1 1081 . 45 1 1 A 94 94 ASN HA H 94 4.115 4.845 -0.730 1
1 1085 . 45 1 1 A 94 94 ASN C C 94 175.410 175.716 -0.306 1
1 1086 . 45 1 1 A 94 94 ASN CA C 94 52.651 52.068 0.583 1
1 1087 . 45 1 1 A 94 94 ASN CB C 94 38.330 40.061 -1.731 1
1 1088 . 45 1 1 A 94 94 ASN N N 94 115.747 117.766 -2.019 1
1 1090 . 45 1 1 A 95 95 GLY H H 95 8.236 8.243 -0.007 1
1 1091 . 45 1 1 A 95 95 GLY HA2 H 95 3.633 3.626 0.007 1
1 1092 . 45 1 1 A 95 95 GLY HA3 H 95 3.633 3.761 -0.128 1
1 1093 . 45 1 1 A 95 95 GLY C C 95 174.450 173.984 0.466 1
1 1094 . 45 1 1 A 95 95 GLY CA C 95 45.522 45.345 0.177 1
1 1095 . 45 1 1 A 95 95 GLY N N 95 109.166 110.112 -0.946 1
1 1096 . 45 1 1 A 96 96 TRP H H 96 7.899 7.516 0.383 1
1 1097 . 45 1 1 A 96 96 TRP HA H 96 5.241 4.817 0.424 1
1 1106 . 45 1 1 A 96 96 TRP C C 96 175.661 175.348 0.313 1
1 1107 . 45 1 1 A 96 96 TRP CA C 96 55.090 56.607 -1.517 1
1 1108 . 45 1 1 A 96 96 TRP CB C 96 27.138 28.043 -0.905 1
1 1114 . 45 1 1 A 96 96 TRP N N 96 122.840 121.991 0.849 1
1 1116 . 45 1 1 A 97 97 ASP H H 97 7.344 8.462 -1.118 1
1 1117 . 45 1 1 A 97 97 ASP HA H 97 4.829 5.011 -0.182 1
1 1120 . 45 1 1 A 97 97 ASP C C 97 175.019 176.782 -1.763 1
1 1121 . 45 1 1 A 97 97 ASP CA C 97 52.149 54.045 -1.896 1
1 1122 . 45 1 1 A 97 97 ASP CB C 97 42.697 42.888 -0.191 1
1 1123 . 45 1 1 A 97 97 ASP N N 97 126.861 125.533 1.328 1
1 1124 . 45 1 1 A 98 98 PHE H H 98 8.566 9.329 -0.763 1
1 1125 . 45 1 1 A 98 98 PHE HA H 98 3.727 4.129 -0.402 1
1 1133 . 45 1 1 A 98 98 PHE C C 98 177.443 177.409 0.034 1
1 1134 . 45 1 1 A 98 98 PHE CA C 98 62.471 61.338 1.133 1
1 1135 . 45 1 1 A 98 98 PHE CB C 98 39.919 39.566 0.353 1
1 1141 . 45 1 1 A 98 98 PHE N N 98 117.781 127.398 -9.617 1
1 1142 . 45 1 1 A 99 99 ASP H H 99 8.259 8.895 -0.636 1
1 1143 . 45 1 1 A 99 99 ASP HA H 99 3.960 4.615 -0.655 1
1 1146 . 45 1 1 A 99 99 ASP C C 99 178.132 178.406 -0.274 1
1 1147 . 45 1 1 A 99 99 ASP CA C 99 57.658 56.518 1.140 1
1 1148 . 45 1 1 A 99 99 ASP CB C 99 38.572 41.094 -2.522 1
1 1149 . 45 1 1 A 99 99 ASP N N 99 121.709 119.333 2.376 1
1 1150 . 45 1 1 A 100 100 MET H H 100 8.008 8.237 -0.229 1
1 1151 . 45 1 1 A 100 100 MET HA H 100 3.644 4.222 -0.578 1
1 1156 . 45 1 1 A 100 100 MET C C 100 180.008 177.170 2.838 1
1 1157 . 45 1 1 A 100 100 MET CA C 100 58.598 58.850 -0.252 1
1 1158 . 45 1 1 A 100 100 MET CB C 100 33.423 32.917 0.506 1
1 1160 . 45 1 1 A 100 100 MET N N 100 119.668 117.938 1.730 1
1 1161 . 45 1 1 A 101 101 LEU H H 101 7.961 8.691 -0.730 1
1 1162 . 45 1 1 A 101 101 LEU HA H 101 3.523 4.518 -0.995 1
1 1172 . 45 1 1 A 101 101 LEU C C 101 173.873 176.185 -2.312 1
1 1173 . 45 1 1 A 101 101 LEU CA C 101 58.743 54.404 4.339 1
1 1174 . 45 1 1 A 101 101 LEU CB C 101 42.632 42.477 0.155 1
1 1178 . 45 1 1 A 101 101 LEU N N 101 119.752 119.523 0.229 1
1 1179 . 45 1 1 A 102 102 THR H H 102 6.955 8.034 -1.079 1
1 1180 . 45 1 1 A 102 102 THR HA H 102 4.134 4.525 -0.391 1
1 1185 . 45 1 1 A 102 102 THR C C 102 176.513 173.632 2.881 1
1 1186 . 45 1 1 A 102 102 THR CA C 102 61.125 62.946 -1.821 1
1 1187 . 45 1 1 A 102 102 THR CB C 102 71.415 69.414 2.001 1
1 1189 . 45 1 1 A 102 102 THR N N 102 124.665 121.095 3.570 1
1 1190 . 45 1 1 A 103 103 GLY H H 103 7.816 8.699 -0.883 1
1 1191 . 45 1 1 A 103 103 GLY HA2 H 103 3.824 3.974 -0.150 1
1 1192 . 45 1 1 A 103 103 GLY HA3 H 103 3.824 4.023 -0.199 1
1 1193 . 45 1 1 A 103 103 GLY C C 103 174.126 173.094 1.032 1
1 1194 . 45 1 1 A 103 103 GLY CA C 103 47.805 47.104 0.701 1
1 1195 . 45 1 1 A 103 103 GLY N N 103 114.191 111.676 2.515 1
1 1196 . 45 1 1 A 104 104 SER H H 104 8.860 7.980 0.880 1
1 1197 . 45 1 1 A 104 104 SER HA H 104 4.758 4.721 0.037 1
1 1200 . 45 1 1 A 104 104 SER C C 104 174.591 172.728 1.863 1
1 1201 . 45 1 1 A 104 104 SER CA C 104 56.755 56.815 -0.060 1
1 1202 . 45 1 1 A 104 104 SER CB C 104 65.050 63.042 2.008 1
1 1203 . 45 1 1 A 104 104 SER N N 104 114.771 118.692 -3.921 1
1 1204 . 45 1 1 A 105 105 GLY H H 105 8.788 7.790 0.998 1
1 1205 . 45 1 1 A 105 105 GLY HA2 H 105 3.733 3.945 -0.212 1
1 1206 . 45 1 1 A 105 105 GLY HA3 H 105 3.733 4.040 -0.307 1
1 1207 . 45 1 1 A 105 105 GLY CA C 105 47.247 45.744 1.503 1
1 1208 . 45 1 1 A 105 105 GLY N N 105 110.394 113.522 -3.128 1
1 1209 . 45 1 1 A 106 106 ASN HA H 106 4.454 4.741 -0.287 1
1 1212 . 45 1 1 A 106 106 ASN C C 106 175.180 175.422 -0.242 1
1 1213 . 45 1 1 A 106 106 ASN CA C 106 54.492 53.480 1.012 1
1 1214 . 45 1 1 A 106 106 ASN CB C 106 37.282 40.218 -2.936 1
1 1215 . 45 1 1 A 107 107 TYR H H 107 8.241 7.254 0.987 1
1 1216 . 45 1 1 A 107 107 TYR HA H 107 4.335 4.863 -0.528 1
1 1223 . 45 1 1 A 107 107 TYR C C 107 173.954 176.340 -2.386 1
1 1224 . 45 1 1 A 107 107 TYR CA C 107 57.727 57.245 0.482 1
1 1225 . 45 1 1 A 107 107 TYR CB C 107 37.063 39.386 -2.323 1
1 1230 . 45 1 1 A 107 107 TYR N N 107 120.708 114.610 6.098 1
1 1231 . 45 1 1 A 108 108 SER H H 108 7.117 7.885 -0.768 1
1 1232 . 45 1 1 A 108 108 SER HA H 108 4.221 4.512 -0.291 1
1 1235 . 45 1 1 A 108 108 SER C C 108 174.834 174.716 0.118 1
1 1236 . 45 1 1 A 108 108 SER CA C 108 59.859 58.573 1.286 1
1 1237 . 45 1 1 A 108 108 SER CB C 108 63.846 63.535 0.311 1
1 1238 . 45 1 1 A 108 108 SER N N 108 113.362 114.220 -0.858 1
1 1239 . 45 1 1 A 109 109 SER H H 109 8.053 7.537 0.516 1
1 1240 . 45 1 1 A 109 109 SER HA H 109 4.560 4.536 0.024 1
1 1243 . 45 1 1 A 109 109 SER CA C 109 57.141 58.300 -1.159 1
1 1244 . 45 1 1 A 109 109 SER CB C 109 64.874 64.797 0.077 1
1 1245 . 45 1 1 A 109 109 SER N N 109 116.657 118.298 -1.641 1
1 1246 . 45 1 1 A 110 110 THR HA H 110 3.541 3.868 -0.327 1
1 1251 . 45 1 1 A 110 110 THR C C 110 175.477 175.805 -0.328 1
1 1252 . 45 1 1 A 110 110 THR CA C 110 66.443 66.658 -0.215 1
1 1253 . 45 1 1 A 110 110 THR CB C 110 68.091 68.628 -0.537 1
1 1255 . 45 1 1 A 111 111 ASP H H 111 8.224 8.280 -0.056 1
1 1256 . 45 1 1 A 111 111 ASP HA H 111 4.237 4.336 -0.099 1
1 1259 . 45 1 1 A 111 111 ASP C C 111 177.520 178.422 -0.902 1
1 1260 . 45 1 1 A 111 111 ASP CA C 111 57.559 57.443 0.116 1
1 1261 . 45 1 1 A 111 111 ASP CB C 111 40.292 41.423 -1.131 1
1 1262 . 45 1 1 A 111 111 ASP N N 111 119.490 121.247 -1.757 1
1 1263 . 45 1 1 A 112 112 ALA H H 112 7.431 7.779 -0.348 1
1 1264 . 45 1 1 A 112 112 ALA HA H 112 4.191 4.099 0.092 1
1 1268 . 45 1 1 A 112 112 ALA C C 112 180.646 179.869 0.777 1
1 1269 . 45 1 1 A 112 112 ALA CA C 112 54.534 55.034 -0.500 1
1 1270 . 45 1 1 A 112 112 ALA CB C 112 18.992 18.520 0.472 1
1 1271 . 45 1 1 A 112 112 ALA N N 112 119.710 121.147 -1.437 1
1 1272 . 45 1 1 A 113 113 GLN H H 113 7.576 7.497 0.079 1
1 1273 . 45 1 1 A 113 113 GLN HA H 113 3.562 4.255 -0.693 1
1 1278 . 45 1 1 A 113 113 GLN C C 113 176.756 178.477 -1.721 1
1 1279 . 45 1 1 A 113 113 GLN CA C 113 57.736 58.396 -0.660 1
1 1280 . 45 1 1 A 113 113 GLN CB C 113 29.110 28.272 0.838 1
1 1281 . 45 1 1 A 113 113 GLN N N 113 117.518 117.286 0.232 1
1 1283 . 45 1 1 A 114 114 MET H H 114 8.192 8.220 -0.028 1
1 1284 . 45 1 1 A 114 114 MET HA H 114 4.231 4.252 -0.021 1
1 1289 . 45 1 1 A 114 114 MET C C 114 175.648 178.287 -2.639 1
1 1290 . 45 1 1 A 114 114 MET CA C 114 57.446 57.841 -0.395 1
1 1291 . 45 1 1 A 114 114 MET CB C 114 33.570 32.444 1.126 1
1 1293 . 45 1 1 A 114 114 MET N N 114 111.509 119.095 -7.586 1
1 1294 . 45 1 1 A 115 115 GLN H H 115 6.940 7.421 -0.481 1
1 1295 . 45 1 1 A 115 115 GLN HA H 115 4.307 4.199 0.108 1
1 1302 . 45 1 1 A 115 115 GLN C C 115 176.270 175.924 0.346 1
1 1303 . 45 1 1 A 115 115 GLN CA C 115 54.680 58.601 -3.921 1
1 1304 . 45 1 1 A 115 115 GLN CB C 115 28.233 29.045 -0.812 1
1 1306 . 45 1 1 A 115 115 GLN N N 115 114.300 117.455 -3.155 1
1 1308 . 45 1 1 A 116 116 TYR H H 116 6.677 7.866 -1.189 1
1 1309 . 45 1 1 A 116 116 TYR HA H 116 4.193 4.204 -0.011 1
1 1312 . 45 1 1 A 116 116 TYR C C 116 175.268 174.747 0.521 1
1 1313 . 45 1 1 A 116 116 TYR CA C 116 54.357 58.754 -4.397 1
1 1314 . 45 1 1 A 116 116 TYR CB C 116 35.498 36.745 -1.247 1
1 1315 . 45 1 1 A 116 116 TYR N N 116 117.919 119.129 -1.210 1
1 1316 . 45 1 1 A 117 117 ASP H H 117 8.081 8.230 -0.149 1
1 1317 . 45 1 1 A 117 117 ASP HA H 117 4.665 4.782 -0.117 1
1 1320 . 45 1 1 A 117 117 ASP CA C 117 52.422 50.049 2.373 1
1 1321 . 45 1 1 A 117 117 ASP CB C 117 42.416 42.642 -0.226 1
1 1322 . 45 1 1 A 117 117 ASP N N 117 120.887 128.113 -7.226 1
1 1323 . 45 1 1 A 118 118 PRO C C 118 179.180 177.438 1.742 1
1 1324 . 45 1 1 A 118 118 PRO CA C 118 65.942 64.018 1.924 1
1 1325 . 45 1 1 A 118 118 PRO CB C 118 32.197 31.952 0.245 1
1 1326 . 45 1 1 A 119 119 GLY H H 119 9.742 8.326 1.416 1
1 1327 . 45 1 1 A 119 119 GLY C C 119 175.622 174.754 0.868 1
1 1328 . 45 1 1 A 119 119 GLY CA C 119 46.785 45.910 0.875 1
1 1329 . 45 1 1 A 119 119 GLY N N 119 106.412 106.419 -0.007 1
1 1330 . 45 1 1 A 120 120 LEU H H 120 6.666 7.532 -0.866 1
1 1331 . 45 1 1 A 120 120 LEU HA H 120 3.365 3.400 -0.035 1
1 1341 . 45 1 1 A 120 120 LEU C C 120 179.262 178.480 0.782 1
1 1342 . 45 1 1 A 120 120 LEU CA C 120 56.605 57.397 -0.792 1
1 1343 . 45 1 1 A 120 120 LEU CB C 120 39.262 41.718 -2.456 1
1 1347 . 45 1 1 A 120 120 LEU N N 120 126.226 122.097 4.129 1
1 1348 . 45 1 1 A 121 121 PHE H H 121 7.356 8.385 -1.029 1
1 1349 . 45 1 1 A 121 121 PHE HA H 121 4.459 4.157 0.302 1
1 1352 . 45 1 1 A 121 121 PHE C C 121 179.716 177.844 1.872 1
1 1353 . 45 1 1 A 121 121 PHE CA C 121 62.838 62.270 0.568 1
1 1354 . 45 1 1 A 121 121 PHE CB C 121 37.603 39.256 -1.653 1
1 1355 . 45 1 1 A 121 121 PHE N N 121 117.437 119.556 -2.119 1
1 1356 . 45 1 1 A 122 122 ALA H H 122 7.926 7.911 0.015 1
1 1357 . 45 1 1 A 122 122 ALA HA H 122 4.523 3.888 0.635 1
1 1361 . 45 1 1 A 122 122 ALA C C 122 180.435 179.487 0.948 1
1 1362 . 45 1 1 A 122 122 ALA CA C 122 55.527 55.215 0.312 1
1 1363 . 45 1 1 A 122 122 ALA CB C 122 17.814 18.158 -0.344 1
1 1364 . 45 1 1 A 122 122 ALA N N 122 121.068 120.911 0.157 1
1 1365 . 45 1 1 A 123 123 GLN H H 123 7.507 7.589 -0.082 1
1 1366 . 45 1 1 A 123 123 GLN HA H 123 4.153 3.998 0.155 1
1 1371 . 45 1 1 A 123 123 GLN C C 123 180.561 178.494 2.067 1
1 1372 . 45 1 1 A 123 123 GLN CA C 123 59.948 58.558 1.390 1
1 1373 . 45 1 1 A 123 123 GLN CB C 123 29.135 28.378 0.757 1
1 1375 . 45 1 1 A 123 123 GLN N N 123 120.324 117.123 3.201 1
1 1376 . 45 1 1 A 124 124 ILE H H 124 8.318 7.470 0.848 1
1 1377 . 45 1 1 A 124 124 ILE HA H 124 3.635 3.772 -0.137 1
1 1387 . 45 1 1 A 124 124 ILE C C 124 176.481 177.924 -1.443 1
1 1388 . 45 1 1 A 124 124 ILE CA C 124 66.432 63.728 2.704 1
1 1389 . 45 1 1 A 124 124 ILE CB C 124 39.168 37.412 1.756 1
1 1393 . 45 1 1 A 124 124 ILE N N 124 123.747 117.851 5.896 1
1 1394 . 45 1 1 A 125 125 GLN H H 125 8.474 8.408 0.066 1
1 1395 . 45 1 1 A 125 125 GLN HA H 125 4.264 3.880 0.384 1
1 1402 . 45 1 1 A 125 125 GLN C C 125 178.947 177.844 1.103 1
1 1403 . 45 1 1 A 125 125 GLN CA C 125 59.651 58.390 1.261 1
1 1404 . 45 1 1 A 125 125 GLN CB C 125 28.880 28.297 0.583 1
1 1406 . 45 1 1 A 125 125 GLN N N 125 120.368 121.006 -0.638 1
1 1408 . 45 1 1 A 126 126 ALA H H 126 8.002 7.692 0.310 1
1 1409 . 45 1 1 A 126 126 ALA HA H 126 4.144 4.019 0.125 1
1 1413 . 45 1 1 A 126 126 ALA C C 126 179.316 179.980 -0.664 1
1 1414 . 45 1 1 A 126 126 ALA CA C 126 55.036 54.938 0.098 1
1 1415 . 45 1 1 A 126 126 ALA CB C 126 18.087 17.849 0.238 1
1 1416 . 45 1 1 A 126 126 ALA N N 126 121.661 121.239 0.422 1
1 1417 . 45 1 1 A 127 127 ALA H H 127 7.823 7.916 -0.093 1
1 1418 . 45 1 1 A 127 127 ALA HA H 127 4.162 3.995 0.167 1
1 1422 . 45 1 1 A 127 127 ALA C C 127 180.707 179.535 1.172 1
1 1423 . 45 1 1 A 127 127 ALA CA C 127 55.080 54.915 0.165 1
1 1424 . 45 1 1 A 127 127 ALA CB C 127 19.354 18.181 1.173 1
1 1425 . 45 1 1 A 127 127 ALA N N 127 119.853 119.883 -0.030 1
1 1426 . 45 1 1 A 128 128 ALA H H 128 8.936 8.009 0.927 1
1 1427 . 45 1 1 A 128 128 ALA HA H 128 3.928 3.664 0.264 1
1 1431 . 45 1 1 A 128 128 ALA C C 128 181.031 179.432 1.599 1
1 1432 . 45 1 1 A 128 128 ALA CA C 128 55.502 54.651 0.851 1
1 1433 . 45 1 1 A 128 128 ALA CB C 128 16.609 17.652 -1.043 1
1 1434 . 45 1 1 A 128 128 ALA N N 128 121.355 120.137 1.218 1
1 1435 . 45 1 1 A 129 129 THR H H 129 8.543 7.522 1.021 1
1 1436 . 45 1 1 A 129 129 THR HA H 129 4.015 3.654 0.361 1
1 1441 . 45 1 1 A 129 129 THR C C 129 177.332 176.637 0.695 1
1 1442 . 45 1 1 A 129 129 THR CA C 129 65.893 65.277 0.616 1
1 1443 . 45 1 1 A 129 129 THR CB C 129 68.566 68.434 0.132 1
1 1445 . 45 1 1 A 129 129 THR N N 129 112.709 112.253 0.456 1
1 1446 . 45 1 1 A 130 130 LYS H H 130 8.126 7.744 0.382 1
1 1447 . 45 1 1 A 130 130 LYS HA H 130 4.000 4.040 -0.040 1
1 1456 . 45 1 1 A 130 130 LYS C C 130 179.082 178.397 0.685 1
1 1457 . 45 1 1 A 130 130 LYS CA C 130 60.299 59.327 0.972 1
1 1458 . 45 1 1 A 130 130 LYS CB C 130 32.767 32.122 0.645 1
1 1462 . 45 1 1 A 130 130 LYS N N 130 123.879 120.915 2.964 1
1 1463 . 45 1 1 A 131 131 ALA H H 131 7.184 7.794 -0.610 1
1 1464 . 45 1 1 A 131 131 ALA HA H 131 4.005 4.269 -0.264 1
1 1468 . 45 1 1 A 131 131 ALA C C 131 178.482 179.540 -1.058 1
1 1469 . 45 1 1 A 131 131 ALA CA C 131 55.027 55.185 -0.158 1
1 1470 . 45 1 1 A 131 131 ALA CB C 131 18.669 19.293 -0.624 1
1 1471 . 45 1 1 A 131 131 ALA N N 131 118.590 121.450 -2.860 1
1 1472 . 45 1 1 A 132 132 TRP H H 132 7.977 8.659 -0.682 1
1 1473 . 45 1 1 A 132 132 TRP HA H 132 4.001 4.273 -0.272 1
1 1480 . 45 1 1 A 132 132 TRP C C 132 177.332 175.730 1.602 1
1 1481 . 45 1 1 A 132 132 TRP CA C 132 60.431 57.410 3.021 1
1 1482 . 45 1 1 A 132 132 TRP CB C 132 27.786 27.643 0.143 1
1 1486 . 45 1 1 A 132 132 TRP N N 132 119.168 117.102 2.066 1
1 1488 . 45 1 1 A 133 133 ARG H H 133 8.006 8.045 -0.039 1
1 1489 . 45 1 1 A 133 133 ARG HA H 133 4.027 4.396 -0.369 1
1 1497 . 45 1 1 A 133 133 ARG C C 133 176.664 177.829 -1.165 1
1 1498 . 45 1 1 A 133 133 ARG CA C 133 59.355 57.363 1.992 1
1 1499 . 45 1 1 A 133 133 ARG CB C 133 30.451 32.365 -1.914 1
1 1502 . 45 1 1 A 133 133 ARG N N 133 113.062 120.677 -7.615 1
1 1504 . 45 1 1 A 134 134 LYS H H 134 7.322 7.629 -0.307 1
1 1505 . 45 1 1 A 134 134 LYS HA H 134 4.313 4.460 -0.147 1
1 1514 . 45 1 1 A 134 134 LYS C C 134 176.282 176.213 0.069 1
1 1515 . 45 1 1 A 134 134 LYS CA C 134 54.922 56.574 -1.652 1
1 1516 . 45 1 1 A 134 134 LYS CB C 134 32.633 31.401 1.232 1
1 1520 . 45 1 1 A 134 134 LYS N N 134 118.170 118.707 -0.537 1
1 1521 . 45 1 1 A 135 135 LEU H H 135 7.440 8.106 -0.666 1
1 1522 . 45 1 1 A 135 135 LEU HA H 135 4.174 4.591 -0.417 1
1 1532 . 45 1 1 A 135 135 LEU CA C 135 54.408 52.853 1.555 1
1 1533 . 45 1 1 A 135 135 LEU CB C 135 40.407 41.240 -0.833 1
1 1537 . 45 1 1 A 135 135 LEU N N 135 123.358 121.270 2.088 1
1 1538 . 45 1 1 A 136 136 PRO HA H 136 4.437 4.718 -0.281 1
1 1545 . 45 1 1 A 136 136 PRO C C 136 177.106 175.363 1.743 1
1 1546 . 45 1 1 A 136 136 PRO CA C 136 62.889 62.345 0.544 1
1 1547 . 45 1 1 A 136 136 PRO CB C 136 32.192 33.073 -0.881 1
1 1550 . 45 1 1 A 137 137 VAL H H 137 8.219 8.296 -0.077 1
1 1551 . 45 1 1 A 137 137 VAL HA H 137 4.077 4.572 -0.495 1
1 1559 . 45 1 1 A 137 137 VAL C C 137 176.305 175.976 0.329 1
1 1560 . 45 1 1 A 137 137 VAL CA C 137 61.958 60.637 1.321 1
1 1561 . 45 1 1 A 137 137 VAL CB C 137 32.755 35.463 -2.708 1
1 1564 . 45 1 1 A 137 137 VAL N N 137 120.079 119.429 0.650 1
1 1565 . 45 1 1 A 138 138 LYS H H 138 8.444 9.261 -0.817 1
1 1566 . 45 1 1 A 138 138 LYS HA H 138 4.316 4.268 0.048 1
1 1575 . 45 1 1 A 138 138 LYS C C 138 176.790 176.980 -0.190 1
1 1576 . 45 1 1 A 138 138 LYS CA C 138 56.792 57.541 -0.749 1
1 1577 . 45 1 1 A 138 138 LYS CB C 138 33.205 33.071 0.134 1
1 1581 . 45 1 1 A 138 138 LYS N N 138 126.449 126.063 0.386 1
1 1582 . 45 1 1 A 139 139 GLY H H 139 8.518 7.578 0.940 1
1 1583 . 45 1 1 A 139 139 GLY HA2 H 139 4.070 4.191 -0.121 1
1 1584 . 45 1 1 A 139 139 GLY HA3 H 139 3.897 4.194 -0.297 1
1 1585 . 45 1 1 A 139 139 GLY C C 139 172.874 172.265 0.609 1
1 1586 . 45 1 1 A 139 139 GLY CA C 139 45.157 44.262 0.895 1
1 1587 . 45 1 1 A 139 139 GLY N N 139 112.617 105.391 7.226 1
1 6 . 46 1 1 A 2 2 VAL H H 2 8.992 8.883 0.109 1
1 7 . 46 1 1 A 2 2 VAL HA H 2 5.370 4.918 0.452 1
1 15 . 46 1 1 A 2 2 VAL C C 2 174.325 174.514 -0.189 1
1 16 . 46 1 1 A 2 2 VAL CA C 2 61.267 60.548 0.719 1
1 17 . 46 1 1 A 2 2 VAL CB C 2 33.890 35.074 -1.184 1
1 20 . 46 1 1 A 2 2 VAL N N 2 126.939 119.967 6.972 1
1 21 . 46 1 1 A 3 3 THR H H 3 8.912 9.208 -0.296 1
1 22 . 46 1 1 A 3 3 THR HA H 3 4.505 5.100 -0.595 1
1 27 . 46 1 1 A 3 3 THR C C 3 172.710 172.888 -0.178 1
1 28 . 46 1 1 A 3 3 THR CA C 3 59.689 59.322 0.367 1
1 29 . 46 1 1 A 3 3 THR CB C 3 72.398 72.438 -0.040 1
1 31 . 46 1 1 A 3 3 THR N N 3 118.091 121.798 -3.707 1
1 32 . 46 1 1 A 4 4 GLU H H 4 8.631 8.832 -0.201 1
1 33 . 46 1 1 A 4 4 GLU HA H 4 5.788 5.250 0.538 1
1 38 . 46 1 1 A 4 4 GLU C C 4 175.758 174.752 1.006 1
1 39 . 46 1 1 A 4 4 GLU CA C 4 54.902 54.343 0.559 1
1 40 . 46 1 1 A 4 4 GLU CB C 4 35.097 33.561 1.536 1
1 42 . 46 1 1 A 4 4 GLU N N 4 120.966 120.580 0.386 1
1 43 . 46 1 1 A 5 5 THR H H 5 9.188 8.524 0.664 1
1 44 . 46 1 1 A 5 5 THR HA H 5 4.739 4.696 0.043 1
1 49 . 46 1 1 A 5 5 THR C C 5 172.757 172.483 0.274 1
1 50 . 46 1 1 A 5 5 THR CA C 5 60.382 61.313 -0.931 1
1 51 . 46 1 1 A 5 5 THR CB C 5 71.558 71.378 0.180 1
1 53 . 46 1 1 A 5 5 THR N N 5 119.366 114.073 5.293 1
1 54 . 46 1 1 A 6 6 VAL H H 6 8.476 8.750 -0.274 1
1 55 . 46 1 1 A 6 6 VAL HA H 6 5.026 5.068 -0.042 1
1 63 . 46 1 1 A 6 6 VAL C C 6 176.674 174.571 2.103 1
1 64 . 46 1 1 A 6 6 VAL CA C 6 61.008 59.695 1.313 1
1 65 . 46 1 1 A 6 6 VAL CB C 6 33.861 33.707 0.154 1
1 68 . 46 1 1 A 6 6 VAL N N 6 121.384 122.979 -1.595 1
1 69 . 46 1 1 A 7 7 ASP H H 7 8.848 8.592 0.256 1
1 70 . 46 1 1 A 7 7 ASP HA H 7 4.797 4.676 0.121 1
1 73 . 46 1 1 A 7 7 ASP CA C 7 52.834 53.074 -0.240 1
1 74 . 46 1 1 A 7 7 ASP CB C 7 42.219 40.753 1.466 1
1 75 . 46 1 1 A 7 7 ASP N N 7 127.061 124.014 3.047 1
1 76 . 46 1 1 A 8 8 GLY C C 8 175.143 174.645 0.498 1
1 77 . 46 1 1 A 8 8 GLY CA C 8 46.553 46.561 -0.008 1
1 78 . 46 1 1 A 9 9 GLN H H 9 8.408 9.024 -0.616 1
1 79 . 46 1 1 A 9 9 GLN HA H 9 4.541 3.920 0.621 1
1 86 . 46 1 1 A 9 9 GLN C C 9 176.463 175.915 0.548 1
1 87 . 46 1 1 A 9 9 GLN CA C 9 55.167 58.272 -3.105 1
1 88 . 46 1 1 A 9 9 GLN CB C 9 29.376 26.846 2.530 1
1 90 . 46 1 1 A 9 9 GLN N N 9 118.300 120.268 -1.968 1
1 92 . 46 1 1 A 10 10 GLY H H 10 8.162 9.379 -1.217 1
1 93 . 46 1 1 A 10 10 GLY HA2 H 10 4.174 4.071 0.103 1
1 94 . 46 1 1 A 10 10 GLY HA3 H 10 3.521 4.078 -0.557 1
1 95 . 46 1 1 A 10 10 GLY C C 10 174.092 173.827 0.265 1
1 96 . 46 1 1 A 10 10 GLY CA C 10 45.558 45.013 0.545 1
1 97 . 46 1 1 A 10 10 GLY N N 10 108.747 106.960 1.787 1
1 98 . 46 1 1 A 11 11 GLN H H 11 8.507 7.503 1.004 1
1 99 . 46 1 1 A 11 11 GLN HA H 11 4.202 4.946 -0.744 1
1 106 . 46 1 1 A 11 11 GLN C C 11 173.992 174.399 -0.407 1
1 107 . 46 1 1 A 11 11 GLN CA C 11 55.098 53.845 1.253 1
1 108 . 46 1 1 A 11 11 GLN CB C 11 29.097 32.017 -2.920 1
1 110 . 46 1 1 A 11 11 GLN N N 11 122.979 116.111 6.868 1
1 112 . 46 1 1 A 12 12 ALA H H 12 8.259 8.889 -0.630 1
1 113 . 46 1 1 A 12 12 ALA HA H 12 5.156 5.729 -0.573 1
1 117 . 46 1 1 A 12 12 ALA C C 12 177.284 176.592 0.692 1
1 118 . 46 1 1 A 12 12 ALA CA C 12 51.087 50.201 0.886 1
1 119 . 46 1 1 A 12 12 ALA CB C 12 20.500 22.690 -2.190 1
1 120 . 46 1 1 A 12 12 ALA N N 12 127.100 123.348 3.752 1
1 121 . 46 1 1 A 13 13 TRP H H 13 9.245 9.648 -0.403 1
1 122 . 46 1 1 A 13 13 TRP HA H 13 4.717 5.402 -0.685 1
1 131 . 46 1 1 A 13 13 TRP C C 13 175.108 175.263 -0.155 1
1 132 . 46 1 1 A 13 13 TRP CA C 13 55.966 55.889 0.077 1
1 133 . 46 1 1 A 13 13 TRP CB C 13 31.912 33.994 -2.082 1
1 139 . 46 1 1 A 13 13 TRP N N 13 123.088 120.824 2.264 1
1 141 . 46 1 1 A 14 14 ARG H H 14 8.575 8.895 -0.320 1
1 142 . 46 1 1 A 14 14 ARG HA H 14 5.335 4.953 0.382 1
1 150 . 46 1 1 A 14 14 ARG C C 14 175.191 174.429 0.762 1
1 151 . 46 1 1 A 14 14 ARG CA C 14 53.106 55.341 -2.235 1
1 152 . 46 1 1 A 14 14 ARG CB C 14 32.749 34.114 -1.365 1
1 154 . 46 1 1 A 14 14 ARG N N 14 121.163 121.669 -0.506 1
1 156 . 46 1 1 A 15 15 HIS H H 15 8.595 9.369 -0.774 1
1 157 . 46 1 1 A 15 15 HIS HA H 15 4.790 5.511 -0.721 1
1 161 . 46 1 1 A 15 15 HIS C C 15 173.770 174.220 -0.450 1
1 162 . 46 1 1 A 15 15 HIS CA C 15 55.289 53.848 1.441 1
1 163 . 46 1 1 A 15 15 HIS CB C 15 33.208 32.776 0.432 1
1 165 . 46 1 1 A 15 15 HIS N N 15 117.643 123.789 -6.146 1
1 166 . 46 1 1 A 16 16 HIS H H 16 8.993 9.076 -0.083 1
1 167 . 46 1 1 A 16 16 HIS HA H 16 5.158 4.892 0.266 1
1 171 . 46 1 1 A 16 16 HIS C C 16 173.608 174.505 -0.897 1
1 172 . 46 1 1 A 16 16 HIS CA C 16 56.450 55.131 1.319 1
1 173 . 46 1 1 A 16 16 HIS CB C 16 34.171 31.419 2.752 1
1 175 . 46 1 1 A 16 16 HIS N N 16 123.520 123.778 -0.258 1
1 176 . 46 1 1 A 17 17 ASN H H 17 7.829 8.784 -0.955 1
1 177 . 46 1 1 A 17 17 ASN HA H 17 4.713 4.921 -0.208 1
1 182 . 46 1 1 A 17 17 ASN C C 17 173.682 175.339 -1.657 1
1 183 . 46 1 1 A 17 17 ASN CA C 17 51.822 51.940 -0.118 1
1 184 . 46 1 1 A 17 17 ASN CB C 17 43.176 39.884 3.292 1
1 185 . 46 1 1 A 17 17 ASN N N 17 122.213 124.659 -2.446 1
1 187 . 46 1 1 A 18 18 GLY H H 18 8.423 8.136 0.287 1
1 188 . 46 1 1 A 18 18 GLY HA2 H 18 3.931 3.674 0.257 1
1 189 . 46 1 1 A 18 18 GLY HA3 H 18 3.707 3.964 -0.257 1
1 190 . 46 1 1 A 18 18 GLY C C 18 173.985 173.109 0.876 1
1 191 . 46 1 1 A 18 18 GLY CA C 18 43.949 43.843 0.106 1
1 192 . 46 1 1 A 18 18 GLY N N 18 106.991 107.001 -0.010 1
1 193 . 46 1 1 A 19 19 PHE H H 19 8.338 8.318 0.020 1
1 194 . 46 1 1 A 19 19 PHE HA H 19 4.068 5.028 -0.960 1
1 197 . 46 1 1 A 19 19 PHE C C 19 176.568 174.885 1.683 1
1 198 . 46 1 1 A 19 19 PHE CA C 19 59.338 57.318 2.020 1
1 199 . 46 1 1 A 19 19 PHE CB C 19 40.201 39.952 0.249 1
1 200 . 46 1 1 A 19 19 PHE N N 19 116.857 119.180 -2.323 1
1 201 . 46 1 1 A 20 20 ASP H H 20 8.794 9.075 -0.281 1
1 202 . 46 1 1 A 20 20 ASP HA H 20 4.485 4.781 -0.296 1
1 205 . 46 1 1 A 20 20 ASP C C 20 177.379 176.991 0.388 1
1 206 . 46 1 1 A 20 20 ASP CA C 20 54.140 54.879 -0.739 1
1 207 . 46 1 1 A 20 20 ASP CB C 20 41.915 40.869 1.046 1
1 208 . 46 1 1 A 20 20 ASP N N 20 123.025 125.926 -2.901 1
1 209 . 46 1 1 A 21 21 PHE H H 21 8.862 9.126 -0.264 1
1 210 . 46 1 1 A 21 21 PHE HA H 21 4.087 4.128 -0.041 1
1 218 . 46 1 1 A 21 21 PHE C C 21 176.952 177.324 -0.372 1
1 219 . 46 1 1 A 21 21 PHE CA C 21 61.095 62.166 -1.071 1
1 220 . 46 1 1 A 21 21 PHE CB C 21 38.678 39.296 -0.618 1
1 226 . 46 1 1 A 21 21 PHE N N 21 127.163 125.635 1.528 1
1 227 . 46 1 1 A 22 22 ALA H H 22 8.561 8.436 0.125 1
1 228 . 46 1 1 A 22 22 ALA HA H 22 3.878 4.018 -0.140 1
1 232 . 46 1 1 A 22 22 ALA C C 22 180.710 179.922 0.788 1
1 233 . 46 1 1 A 22 22 ALA CA C 22 55.211 55.271 -0.060 1
1 234 . 46 1 1 A 22 22 ALA CB C 22 18.321 18.505 -0.184 1
1 235 . 46 1 1 A 22 22 ALA N N 22 120.293 121.187 -0.894 1
1 236 . 46 1 1 A 23 23 VAL H H 23 7.241 7.961 -0.720 1
1 237 . 46 1 1 A 23 23 VAL HA H 23 3.684 3.501 0.183 1
1 245 . 46 1 1 A 23 23 VAL C C 23 177.101 177.978 -0.877 1
1 246 . 46 1 1 A 23 23 VAL CA C 23 65.237 66.944 -1.707 1
1 247 . 46 1 1 A 23 23 VAL CB C 23 31.780 31.710 0.070 1
1 250 . 46 1 1 A 23 23 VAL N N 23 118.775 117.538 1.237 1
1 251 . 46 1 1 A 24 24 ILE H H 24 6.761 7.724 -0.963 1
1 252 . 46 1 1 A 24 24 ILE HA H 24 3.196 3.487 -0.291 1
1 262 . 46 1 1 A 24 24 ILE C C 24 177.287 177.770 -0.483 1
1 263 . 46 1 1 A 24 24 ILE CA C 24 63.404 65.614 -2.210 1
1 264 . 46 1 1 A 24 24 ILE CB C 24 36.294 37.741 -1.447 1
1 268 . 46 1 1 A 24 24 ILE N N 24 119.036 119.384 -0.348 1
1 269 . 46 1 1 A 25 25 LYS H H 25 8.032 8.021 0.011 1
1 270 . 46 1 1 A 25 25 LYS HA H 25 3.809 3.616 0.193 1
1 279 . 46 1 1 A 25 25 LYS C C 25 179.450 178.917 0.533 1
1 280 . 46 1 1 A 25 25 LYS CA C 25 59.621 59.491 0.130 1
1 281 . 46 1 1 A 25 25 LYS CB C 25 32.259 32.114 0.145 1
1 285 . 46 1 1 A 25 25 LYS N N 25 118.368 119.995 -1.627 1
1 286 . 46 1 1 A 26 26 GLU H H 26 7.845 7.824 0.021 1
1 287 . 46 1 1 A 26 26 GLU HA H 26 4.021 4.083 -0.062 1
1 292 . 46 1 1 A 26 26 GLU C C 26 179.191 179.433 -0.242 1
1 293 . 46 1 1 A 26 26 GLU CA C 26 59.530 58.874 0.656 1
1 294 . 46 1 1 A 26 26 GLU CB C 26 29.449 29.572 -0.123 1
1 296 . 46 1 1 A 26 26 GLU N N 26 120.522 118.621 1.901 1
1 297 . 46 1 1 A 27 27 LEU H H 27 8.165 8.180 -0.015 1
1 298 . 46 1 1 A 27 27 LEU HA H 27 4.163 4.138 0.025 1
1 308 . 46 1 1 A 27 27 LEU C C 27 177.256 178.309 -1.053 1
1 309 . 46 1 1 A 27 27 LEU CA C 27 58.049 57.691 0.358 1
1 310 . 46 1 1 A 27 27 LEU CB C 27 41.365 41.628 -0.263 1
1 314 . 46 1 1 A 27 27 LEU N N 27 120.879 121.505 -0.626 1
1 315 . 46 1 1 A 28 28 LYS H H 28 8.902 8.204 0.698 1
1 316 . 46 1 1 A 28 28 LYS HA H 28 4.199 4.402 -0.203 1
1 317 . 46 1 1 A 28 28 LYS C C 28 179.707 179.521 0.186 1
1 318 . 46 1 1 A 28 28 LYS CA C 28 60.097 58.824 1.273 1
1 319 . 46 1 1 A 28 28 LYS CB C 28 33.420 31.737 1.683 1
1 320 . 46 1 1 A 28 28 LYS N N 28 120.050 119.364 0.686 1
1 321 . 46 1 1 A 29 29 THR H H 29 8.294 7.877 0.417 1
1 322 . 46 1 1 A 29 29 THR HA H 29 3.892 3.953 -0.061 1
1 327 . 46 1 1 A 29 29 THR C C 29 175.711 176.271 -0.560 1
1 328 . 46 1 1 A 29 29 THR CA C 29 66.846 66.423 0.423 1
1 329 . 46 1 1 A 29 29 THR CB C 29 68.794 68.770 0.024 1
1 331 . 46 1 1 A 29 29 THR N N 29 115.933 116.823 -0.890 1
1 332 . 46 1 1 A 30 30 ALA H H 30 8.244 8.535 -0.291 1
1 333 . 46 1 1 A 30 30 ALA HA H 30 4.241 4.383 -0.142 1
1 337 . 46 1 1 A 30 30 ALA C C 30 179.128 179.277 -0.149 1
1 338 . 46 1 1 A 30 30 ALA CA C 30 55.714 55.842 -0.128 1
1 339 . 46 1 1 A 30 30 ALA CB C 30 18.955 18.266 0.689 1
1 340 . 46 1 1 A 30 30 ALA N N 30 124.617 123.392 1.225 1
1 341 . 46 1 1 A 31 31 ALA H H 31 8.968 8.758 0.210 1
1 342 . 46 1 1 A 31 31 ALA HA H 31 3.890 4.083 -0.193 1
1 346 . 46 1 1 A 31 31 ALA C C 31 180.352 179.339 1.013 1
1 347 . 46 1 1 A 31 31 ALA CA C 31 55.454 55.426 0.028 1
1 348 . 46 1 1 A 31 31 ALA CB C 31 17.124 18.214 -1.090 1
1 349 . 46 1 1 A 31 31 ALA N N 31 119.327 120.726 -1.399 1
1 350 . 46 1 1 A 32 32 SER H H 32 7.995 7.944 0.051 1
1 351 . 46 1 1 A 32 32 SER HA H 32 4.238 4.187 0.051 1
1 354 . 46 1 1 A 32 32 SER C C 32 175.612 177.275 -1.663 1
1 355 . 46 1 1 A 32 32 SER CA C 32 61.203 61.416 -0.213 1
1 356 . 46 1 1 A 32 32 SER CB C 32 63.406 63.133 0.273 1
1 357 . 46 1 1 A 32 32 SER N N 32 111.962 113.599 -1.637 1
1 358 . 46 1 1 A 33 33 GLN H H 33 8.333 8.150 0.183 1
1 359 . 46 1 1 A 33 33 GLN HA H 33 3.992 4.084 -0.092 1
1 366 . 46 1 1 A 33 33 GLN C C 33 177.486 176.910 0.576 1
1 367 . 46 1 1 A 33 33 GLN CA C 33 58.277 58.257 0.020 1
1 368 . 46 1 1 A 33 33 GLN CB C 33 29.140 29.304 -0.164 1
1 370 . 46 1 1 A 33 33 GLN N N 33 119.527 120.297 -0.770 1
1 372 . 46 1 1 A 34 34 TYR H H 34 8.587 7.988 0.599 1
1 373 . 46 1 1 A 34 34 TYR HA H 34 4.792 4.729 0.063 1
1 380 . 46 1 1 A 34 34 TYR C C 34 176.499 176.734 -0.235 1
1 381 . 46 1 1 A 34 34 TYR CA C 34 57.711 58.508 -0.797 1
1 382 . 46 1 1 A 34 34 TYR CB C 34 39.561 39.948 -0.387 1
1 387 . 46 1 1 A 34 34 TYR N N 34 114.610 114.522 0.088 1
1 388 . 46 1 1 A 35 35 GLY H H 35 7.346 8.178 -0.832 1
1 389 . 46 1 1 A 35 35 GLY HA2 H 35 4.785 4.087 0.698 1
1 390 . 46 1 1 A 35 35 GLY HA3 H 35 4.007 4.089 -0.082 1
1 391 . 46 1 1 A 35 35 GLY C C 35 175.796 173.019 2.777 1
1 392 . 46 1 1 A 35 35 GLY CA C 35 44.355 44.996 -0.641 1
1 393 . 46 1 1 A 35 35 GLY N N 35 108.501 106.791 1.710 1
1 394 . 46 1 1 A 36 36 ALA H H 36 9.363 8.264 1.099 1
1 395 . 46 1 1 A 36 36 ALA HA H 36 4.217 4.691 -0.474 1
1 399 . 46 1 1 A 36 36 ALA C C 36 178.039 177.242 0.797 1
1 400 . 46 1 1 A 36 36 ALA CA C 36 56.114 51.640 4.474 1
1 401 . 46 1 1 A 36 36 ALA CB C 36 19.179 18.983 0.196 1
1 402 . 46 1 1 A 36 36 ALA N N 36 125.811 122.534 3.277 1
1 403 . 46 1 1 A 37 37 THR H H 37 8.070 8.550 -0.480 1
1 404 . 46 1 1 A 37 37 THR HA H 37 4.570 4.532 0.038 1
1 409 . 46 1 1 A 37 37 THR C C 37 173.685 174.623 -0.938 1
1 410 . 46 1 1 A 37 37 THR CA C 37 59.822 62.435 -2.613 1
1 411 . 46 1 1 A 37 37 THR CB C 37 68.267 70.838 -2.571 1
1 413 . 46 1 1 A 37 37 THR N N 37 129.410 113.271 16.139 1
1 414 . 46 1 1 A 38 38 ALA H H 38 6.853 7.356 -0.503 1
1 415 . 46 1 1 A 38 38 ALA HA H 38 4.601 4.612 -0.011 1
1 419 . 46 1 1 A 38 38 ALA CA C 38 50.758 50.539 0.219 1
1 420 . 46 1 1 A 38 38 ALA CB C 38 18.325 19.789 -1.464 1
1 421 . 46 1 1 A 38 38 ALA N N 38 124.674 125.431 -0.757 1
1 422 . 46 1 1 A 40 40 TYR HA H 40 4.032 3.969 0.063 1
1 429 . 46 1 1 A 40 40 TYR C C 40 176.456 177.447 -0.991 1
1 430 . 46 1 1 A 40 40 TYR CA C 40 61.010 61.836 -0.826 1
1 431 . 46 1 1 A 40 40 TYR CB C 40 39.286 38.681 0.605 1
1 436 . 46 1 1 A 41 41 THR H H 41 6.874 7.930 -1.056 1
1 437 . 46 1 1 A 41 41 THR HA H 41 3.616 3.772 -0.156 1
1 442 . 46 1 1 A 41 41 THR C C 41 176.930 176.615 0.315 1
1 443 . 46 1 1 A 41 41 THR CA C 41 65.557 65.471 0.086 1
1 444 . 46 1 1 A 41 41 THR CB C 41 68.228 69.162 -0.934 1
1 446 . 46 1 1 A 41 41 THR N N 41 115.143 113.904 1.239 1
1 447 . 46 1 1 A 42 42 LEU H H 42 8.623 7.272 1.351 1
1 448 . 46 1 1 A 42 42 LEU HA H 42 3.708 4.043 -0.335 1
1 458 . 46 1 1 A 42 42 LEU C C 42 178.206 179.192 -0.986 1
1 459 . 46 1 1 A 42 42 LEU CA C 42 57.417 57.799 -0.382 1
1 460 . 46 1 1 A 42 42 LEU CB C 42 41.342 41.231 0.111 1
1 464 . 46 1 1 A 42 42 LEU N N 42 120.418 119.204 1.214 1
1 465 . 46 1 1 A 43 43 ALA H H 43 7.735 8.027 -0.292 1
1 466 . 46 1 1 A 43 43 ALA HA H 43 4.020 3.926 0.094 1
1 470 . 46 1 1 A 43 43 ALA C C 43 180.826 180.411 0.415 1
1 471 . 46 1 1 A 43 43 ALA CA C 43 54.925 55.103 -0.178 1
1 472 . 46 1 1 A 43 43 ALA CB C 43 17.506 18.199 -0.693 1
1 473 . 46 1 1 A 43 43 ALA N N 43 120.203 121.826 -1.623 1
1 474 . 46 1 1 A 44 44 ILE H H 44 7.149 7.345 -0.196 1
1 475 . 46 1 1 A 44 44 ILE HA H 44 3.603 3.568 0.035 1
1 485 . 46 1 1 A 44 44 ILE C C 44 178.594 177.806 0.788 1
1 486 . 46 1 1 A 44 44 ILE CA C 44 64.782 64.649 0.133 1
1 487 . 46 1 1 A 44 44 ILE CB C 44 37.472 37.665 -0.193 1
1 491 . 46 1 1 A 44 44 ILE N N 44 118.881 119.492 -0.611 1
1 492 . 46 1 1 A 45 45 VAL H H 45 7.968 7.942 0.026 1
1 493 . 46 1 1 A 45 45 VAL HA H 45 2.925 3.333 -0.408 1
1 501 . 46 1 1 A 45 45 VAL C C 45 177.023 177.834 -0.811 1
1 502 . 46 1 1 A 45 45 VAL CA C 45 67.081 67.062 0.019 1
1 503 . 46 1 1 A 45 45 VAL CB C 45 30.854 31.291 -0.437 1
1 506 . 46 1 1 A 45 45 VAL N N 45 120.764 120.012 0.752 1
1 507 . 46 1 1 A 46 46 GLU H H 46 8.399 8.418 -0.019 1
1 508 . 46 1 1 A 46 46 GLU HA H 46 3.848 3.939 -0.091 1
1 513 . 46 1 1 A 46 46 GLU C C 46 178.656 178.128 0.528 1
1 514 . 46 1 1 A 46 46 GLU CA C 46 59.491 59.135 0.356 1
1 515 . 46 1 1 A 46 46 GLU CB C 46 28.991 28.931 0.060 1
1 517 . 46 1 1 A 46 46 GLU N N 46 116.599 119.485 -2.886 1
1 518 . 46 1 1 A 47 47 SER H H 47 7.273 7.717 -0.444 1
1 519 . 46 1 1 A 47 47 SER HA H 47 4.287 4.267 0.020 1
1 521 . 46 1 1 A 47 47 SER CA C 47 61.047 61.766 -0.719 1
1 522 . 46 1 1 A 47 47 SER CB C 47 63.016 63.252 -0.236 1
1 523 . 46 1 1 A 47 47 SER N N 47 113.609 117.900 -4.291 1
1 524 . 46 1 1 A 48 48 VAL H H 48 8.006 8.127 -0.121 1
1 525 . 46 1 1 A 48 48 VAL HA H 48 3.556 3.584 -0.028 1
1 533 . 46 1 1 A 48 48 VAL C C 48 177.257 177.253 0.004 1
1 534 . 46 1 1 A 48 48 VAL CA C 48 65.025 66.573 -1.548 1
1 535 . 46 1 1 A 48 48 VAL CB C 48 31.841 31.497 0.344 1
1 538 . 46 1 1 A 48 48 VAL N N 48 122.327 121.547 0.780 1
1 539 . 46 1 1 A 49 49 ALA H H 49 8.369 7.875 0.494 1
1 540 . 46 1 1 A 49 49 ALA HA H 49 4.115 4.394 -0.279 1
1 544 . 46 1 1 A 49 49 ALA C C 49 177.307 178.316 -1.009 1
1 545 . 46 1 1 A 49 49 ALA CA C 49 53.253 53.024 0.229 1
1 546 . 46 1 1 A 49 49 ALA CB C 49 20.131 18.603 1.528 1
1 547 . 46 1 1 A 49 49 ALA N N 49 118.050 120.463 -2.413 1
1 548 . 46 1 1 A 50 50 ASP H H 50 7.052 7.944 -0.892 1
1 549 . 46 1 1 A 50 50 ASP HA H 50 4.788 4.539 0.249 1
1 552 . 46 1 1 A 50 50 ASP C C 50 175.481 176.114 -0.633 1
1 553 . 46 1 1 A 50 50 ASP CA C 50 53.681 56.362 -2.681 1
1 554 . 46 1 1 A 50 50 ASP CB C 50 39.333 40.795 -1.462 1
1 555 . 46 1 1 A 50 50 ASP N N 50 116.997 118.105 -1.108 1
1 556 . 46 1 1 A 51 51 ASN H H 51 8.535 7.492 1.043 1
1 557 . 46 1 1 A 51 51 ASN HA H 51 4.628 4.806 -0.178 1
1 562 . 46 1 1 A 51 51 ASN C C 51 174.077 175.231 -1.154 1
1 563 . 46 1 1 A 51 51 ASN CA C 51 52.315 51.858 0.457 1
1 564 . 46 1 1 A 51 51 ASN CB C 51 41.928 39.861 2.067 1
1 565 . 46 1 1 A 51 51 ASN N N 51 118.626 117.250 1.376 1
1 567 . 46 1 1 A 52 52 TRP H H 52 8.555 8.338 0.217 1
1 574 . 46 1 1 A 52 52 TRP C C 52 173.269 176.599 -3.330 1
1 575 . 46 1 1 A 52 52 TRP CA C 52 55.031 57.114 -2.083 1
1 576 . 46 1 1 A 52 52 TRP CB C 52 26.801 30.449 -3.648 1
1 582 . 46 1 1 A 52 52 TRP N N 52 120.693 120.609 0.084 1
1 584 . 46 1 1 A 53 53 LEU H H 53 7.847 9.220 -1.373 1
1 585 . 46 1 1 A 53 53 LEU HA H 53 4.859 5.014 -0.155 1
1 595 . 46 1 1 A 53 53 LEU C C 53 177.397 175.169 2.228 1
1 596 . 46 1 1 A 53 53 LEU CA C 53 53.619 53.679 -0.060 1
1 597 . 46 1 1 A 53 53 LEU CB C 53 41.812 45.744 -3.932 1
1 601 . 46 1 1 A 53 53 LEU N N 53 124.741 120.449 4.292 1
1 602 . 46 1 1 A 54 54 THR H H 54 8.850 8.617 0.233 1
1 603 . 46 1 1 A 54 54 THR HA H 54 4.598 4.651 -0.053 1
1 608 . 46 1 1 A 54 54 THR CA C 54 60.531 58.439 2.092 1
1 609 . 46 1 1 A 54 54 THR CB C 54 67.183 70.218 -3.035 1
1 611 . 46 1 1 A 54 54 THR N N 54 113.407 109.636 3.771 1
1 612 . 46 1 1 A 55 55 PRO HA H 55 4.511 3.955 0.556 1
1 619 . 46 1 1 A 55 55 PRO C C 55 179.383 177.518 1.865 1
1 620 . 46 1 1 A 55 55 PRO CA C 55 67.159 64.728 2.431 1
1 621 . 46 1 1 A 55 55 PRO CB C 55 32.095 31.608 0.487 1
1 622 . 46 1 1 A 56 56 THR H H 56 8.575 7.688 0.887 1
1 623 . 46 1 1 A 56 56 THR HA H 56 4.229 4.213 0.016 1
1 628 . 46 1 1 A 56 56 THR C C 56 176.668 176.520 0.148 1
1 629 . 46 1 1 A 56 56 THR CA C 56 66.943 65.141 1.802 1
1 630 . 46 1 1 A 56 56 THR CB C 56 68.129 68.911 -0.782 1
1 632 . 46 1 1 A 56 56 THR N N 56 114.855 111.626 3.229 1
1 633 . 46 1 1 A 57 57 ASP H H 57 8.730 8.191 0.539 1
1 634 . 46 1 1 A 57 57 ASP HA H 57 4.425 4.781 -0.356 1
1 637 . 46 1 1 A 57 57 ASP C C 57 178.351 179.466 -1.115 1
1 638 . 46 1 1 A 57 57 ASP CA C 57 57.963 57.773 0.190 1
1 639 . 46 1 1 A 57 57 ASP CB C 57 40.134 40.874 -0.740 1
1 640 . 46 1 1 A 57 57 ASP N N 57 126.239 121.854 4.385 1
1 641 . 46 1 1 A 58 58 TRP H H 58 8.244 8.093 0.151 1
1 642 . 46 1 1 A 58 58 TRP HA H 58 4.030 4.366 -0.336 1
1 650 . 46 1 1 A 58 58 TRP C C 58 177.432 179.410 -1.978 1
1 651 . 46 1 1 A 58 58 TRP CA C 58 62.731 60.123 2.608 1
1 652 . 46 1 1 A 58 58 TRP CB C 58 29.122 29.263 -0.141 1
1 657 . 46 1 1 A 58 58 TRP N N 58 119.241 120.752 -1.511 1
1 659 . 46 1 1 A 59 59 ASN H H 59 8.098 8.908 -0.810 1
1 660 . 46 1 1 A 59 59 ASN HA H 59 4.424 4.517 -0.093 1
1 663 . 46 1 1 A 59 59 ASN C C 59 176.952 178.010 -1.058 1
1 664 . 46 1 1 A 59 59 ASN CA C 59 58.135 56.525 1.610 1
1 665 . 46 1 1 A 59 59 ASN CB C 59 40.168 38.310 1.858 1
1 666 . 46 1 1 A 59 59 ASN N N 59 115.747 118.236 -2.489 1
1 667 . 46 1 1 A 60 60 THR H H 60 8.712 8.077 0.635 1
1 668 . 46 1 1 A 60 60 THR HA H 60 3.717 3.960 -0.243 1
1 673 . 46 1 1 A 60 60 THR C C 60 176.044 176.903 -0.859 1
1 674 . 46 1 1 A 60 60 THR CA C 60 66.576 66.818 -0.242 1
1 675 . 46 1 1 A 60 60 THR CB C 60 69.251 67.626 1.625 1
1 677 . 46 1 1 A 60 60 THR N N 60 114.896 118.209 -3.313 1
1 678 . 46 1 1 A 61 61 LEU H H 61 8.485 8.469 0.016 1
1 679 . 46 1 1 A 61 61 LEU HA H 61 3.391 3.990 -0.599 1
1 689 . 46 1 1 A 61 61 LEU C C 61 177.433 178.961 -1.528 1
1 690 . 46 1 1 A 61 61 LEU CA C 61 58.354 58.538 -0.184 1
1 691 . 46 1 1 A 61 61 LEU CB C 61 41.761 41.916 -0.155 1
1 695 . 46 1 1 A 61 61 LEU N N 61 123.433 121.883 1.550 1
1 696 . 46 1 1 A 62 62 VAL H H 62 8.073 8.277 -0.204 1
1 697 . 46 1 1 A 62 62 VAL HA H 62 3.207 3.591 -0.384 1
1 705 . 46 1 1 A 62 62 VAL C C 62 177.585 177.312 0.273 1
1 706 . 46 1 1 A 62 62 VAL CA C 62 67.345 65.063 2.282 1
1 707 . 46 1 1 A 62 62 VAL CB C 62 30.905 30.764 0.141 1
1 710 . 46 1 1 A 62 62 VAL N N 62 116.018 118.815 -2.797 1
1 711 . 46 1 1 A 63 63 ARG H H 63 7.765 8.148 -0.383 1
1 712 . 46 1 1 A 63 63 ARG HA H 63 3.602 4.003 -0.401 1
1 719 . 46 1 1 A 63 63 ARG C C 63 177.818 178.116 -0.298 1
1 720 . 46 1 1 A 63 63 ARG CA C 63 58.049 58.454 -0.405 1
1 721 . 46 1 1 A 63 63 ARG CB C 63 29.955 29.753 0.202 1
1 724 . 46 1 1 A 63 63 ARG N N 63 116.700 120.728 -4.028 1
1 725 . 46 1 1 A 64 64 ALA H H 64 7.574 7.618 -0.044 1
1 726 . 46 1 1 A 64 64 ALA HA H 64 4.158 4.420 -0.262 1
1 730 . 46 1 1 A 64 64 ALA C C 64 179.886 179.209 0.677 1
1 731 . 46 1 1 A 64 64 ALA CA C 64 54.007 53.814 0.193 1
1 732 . 46 1 1 A 64 64 ALA CB C 64 19.147 19.961 -0.814 1
1 733 . 46 1 1 A 64 64 ALA N N 64 117.555 121.390 -3.835 1
1 734 . 46 1 1 A 65 65 VAL H H 65 7.554 8.163 -0.609 1
1 735 . 46 1 1 A 65 65 VAL HA H 65 4.253 3.783 0.470 1
1 743 . 46 1 1 A 65 65 VAL C C 65 174.180 176.173 -1.993 1
1 744 . 46 1 1 A 65 65 VAL CA C 65 62.683 65.306 -2.623 1
1 745 . 46 1 1 A 65 65 VAL CB C 65 33.458 31.469 1.989 1
1 748 . 46 1 1 A 65 65 VAL N N 65 110.013 115.537 -5.524 1
1 749 . 46 1 1 A 66 66 LEU H H 66 7.792 7.395 0.397 1
1 750 . 46 1 1 A 66 66 LEU HA H 66 4.790 4.812 -0.022 1
1 760 . 46 1 1 A 66 66 LEU C C 66 177.537 175.382 2.155 1
1 761 . 46 1 1 A 66 66 LEU CA C 66 52.823 52.653 0.170 1
1 762 . 46 1 1 A 66 66 LEU CB C 66 44.071 45.532 -1.461 1
1 766 . 46 1 1 A 66 66 LEU N N 66 118.967 121.426 -2.459 1
1 767 . 46 1 1 A 67 67 SER H H 67 9.208 8.414 0.794 1
1 768 . 46 1 1 A 67 67 SER HA H 67 4.414 4.912 -0.498 1
1 771 . 46 1 1 A 67 67 SER CA C 67 57.943 57.017 0.926 1
1 772 . 46 1 1 A 67 67 SER CB C 67 64.743 66.094 -1.351 1
1 773 . 46 1 1 A 67 67 SER N N 67 116.378 113.747 2.631 1
1 774 . 46 1 1 A 69 69 GLY HA2 H 69 3.916 3.832 0.084 1
1 775 . 46 1 1 A 69 69 GLY HA3 H 69 3.867 3.854 0.013 1
1 776 . 46 1 1 A 69 69 GLY C C 69 176.783 175.550 1.233 1
1 777 . 46 1 1 A 69 69 GLY CA C 69 46.977 46.068 0.909 1
1 778 . 46 1 1 A 70 70 ASP H H 70 7.674 8.182 -0.508 1
1 779 . 46 1 1 A 70 70 ASP HA H 70 4.511 3.841 0.670 1
1 782 . 46 1 1 A 70 70 ASP C C 70 178.096 178.442 -0.346 1
1 783 . 46 1 1 A 70 70 ASP CA C 70 57.262 56.588 0.674 1
1 784 . 46 1 1 A 70 70 ASP CB C 70 40.594 39.858 0.736 1
1 785 . 46 1 1 A 70 70 ASP N N 70 123.930 121.907 2.023 1
1 786 . 46 1 1 A 71 71 HIS H H 71 8.729 7.846 0.883 1
1 787 . 46 1 1 A 71 71 HIS HA H 71 4.235 4.193 0.042 1
1 790 . 46 1 1 A 71 71 HIS C C 71 176.769 177.152 -0.383 1
1 791 . 46 1 1 A 71 71 HIS CA C 71 60.041 59.850 0.191 1
1 792 . 46 1 1 A 71 71 HIS CB C 71 30.682 29.901 0.781 1
1 793 . 46 1 1 A 71 71 HIS N N 71 121.003 119.532 1.471 1
1 794 . 46 1 1 A 72 72 LEU H H 72 7.620 8.312 -0.692 1
1 795 . 46 1 1 A 72 72 LEU HA H 72 3.769 3.771 -0.002 1
1 805 . 46 1 1 A 72 72 LEU C C 72 180.275 179.180 1.095 1
1 806 . 46 1 1 A 72 72 LEU CA C 72 58.192 58.181 0.011 1
1 807 . 46 1 1 A 72 72 LEU CB C 72 41.381 42.028 -0.647 1
1 811 . 46 1 1 A 72 72 LEU N N 72 118.569 119.982 -1.413 1
1 812 . 46 1 1 A 73 73 LEU H H 73 7.542 7.490 0.052 1
1 813 . 46 1 1 A 73 73 LEU HA H 73 4.107 4.195 -0.088 1
1 823 . 46 1 1 A 73 73 LEU C C 73 179.436 179.149 0.287 1
1 824 . 46 1 1 A 73 73 LEU CA C 73 58.026 57.201 0.825 1
1 825 . 46 1 1 A 73 73 LEU CB C 73 41.638 42.073 -0.435 1
1 829 . 46 1 1 A 73 73 LEU N N 73 121.418 116.976 4.442 1
1 830 . 46 1 1 A 74 74 TRP H H 74 8.786 7.987 0.799 1
1 831 . 46 1 1 A 74 74 TRP HA H 74 3.589 5.268 -1.679 1
1 840 . 46 1 1 A 74 74 TRP C C 74 176.816 178.625 -1.809 1
1 841 . 46 1 1 A 74 74 TRP CA C 74 63.046 59.767 3.279 1
1 842 . 46 1 1 A 74 74 TRP CB C 74 28.065 28.829 -0.764 1
1 848 . 46 1 1 A 74 74 TRP N N 74 121.111 118.210 2.901 1
1 850 . 46 1 1 A 75 75 LYS H H 75 8.939 7.397 1.542 1
1 851 . 46 1 1 A 75 75 LYS HA H 75 3.055 4.149 -1.094 1
1 860 . 46 1 1 A 75 75 LYS C C 75 177.967 179.319 -1.352 1
1 861 . 46 1 1 A 75 75 LYS CA C 75 60.029 58.520 1.509 1
1 862 . 46 1 1 A 75 75 LYS CB C 75 32.533 33.005 -0.472 1
1 866 . 46 1 1 A 75 75 LYS N N 75 119.783 118.567 1.216 1
1 867 . 46 1 1 A 76 76 SER H H 76 7.832 7.943 -0.111 1
1 868 . 46 1 1 A 76 76 SER HA H 76 4.040 4.273 -0.233 1
1 871 . 46 1 1 A 76 76 SER C C 76 177.816 177.051 0.765 1
1 872 . 46 1 1 A 76 76 SER CA C 76 62.105 62.262 -0.157 1
1 873 . 46 1 1 A 76 76 SER CB C 76 62.679 62.919 -0.240 1
1 874 . 46 1 1 A 76 76 SER N N 76 113.395 117.045 -3.650 1
1 875 . 46 1 1 A 77 77 GLU H H 77 7.590 7.609 -0.019 1
1 876 . 46 1 1 A 77 77 GLU HA H 77 4.042 4.266 -0.224 1
1 881 . 46 1 1 A 77 77 GLU C C 77 177.809 178.598 -0.789 1
1 882 . 46 1 1 A 77 77 GLU CA C 77 58.270 58.604 -0.334 1
1 883 . 46 1 1 A 77 77 GLU CB C 77 29.208 29.448 -0.240 1
1 885 . 46 1 1 A 77 77 GLU N N 77 121.574 122.515 -0.941 1
1 886 . 46 1 1 A 78 78 PHE H H 78 9.081 7.761 1.320 1
1 887 . 46 1 1 A 78 78 PHE HA H 78 3.778 4.231 -0.453 1
1 895 . 46 1 1 A 78 78 PHE C C 78 178.114 177.334 0.780 1
1 896 . 46 1 1 A 78 78 PHE CA C 78 60.629 61.247 -0.618 1
1 897 . 46 1 1 A 78 78 PHE CB C 78 38.295 38.382 -0.087 1
1 902 . 46 1 1 A 78 78 PHE N N 78 122.682 121.984 0.698 1
1 903 . 46 1 1 A 79 79 PHE H H 79 8.890 8.001 0.889 1
1 904 . 46 1 1 A 79 79 PHE HA H 79 3.800 4.018 -0.218 1
1 912 . 46 1 1 A 79 79 PHE C C 79 178.354 178.238 0.116 1
1 913 . 46 1 1 A 79 79 PHE CA C 79 60.704 61.868 -1.164 1
1 914 . 46 1 1 A 79 79 PHE CB C 79 37.184 38.555 -1.371 1
1 920 . 46 1 1 A 79 79 PHE N N 79 121.056 118.104 2.952 1
1 921 . 46 1 1 A 80 80 GLU H H 80 7.793 8.119 -0.326 1
1 922 . 46 1 1 A 80 80 GLU HA H 80 4.082 3.962 0.120 1
1 927 . 46 1 1 A 80 80 GLU C C 80 179.068 179.420 -0.352 1
1 928 . 46 1 1 A 80 80 GLU CA C 80 59.735 59.750 -0.015 1
1 929 . 46 1 1 A 80 80 GLU CB C 80 28.722 29.281 -0.559 1
1 931 . 46 1 1 A 80 80 GLU N N 80 120.312 119.166 1.146 1
1 932 . 46 1 1 A 81 81 ASN H H 81 8.624 8.657 -0.033 1
1 933 . 46 1 1 A 81 81 ASN HA H 81 4.521 4.482 0.039 1
1 938 . 46 1 1 A 81 81 ASN C C 81 179.262 178.251 1.011 1
1 939 . 46 1 1 A 81 81 ASN CA C 81 55.504 56.356 -0.852 1
1 940 . 46 1 1 A 81 81 ASN CB C 81 37.517 37.629 -0.112 1
1 941 . 46 1 1 A 81 81 ASN N N 81 119.338 118.578 0.760 1
1 943 . 46 1 1 A 82 82 CYS H H 82 8.554 7.870 0.684 1
1 944 . 46 1 1 A 82 82 CYS HA H 82 3.792 3.972 -0.180 1
1 947 . 46 1 1 A 82 82 CYS C C 82 176.478 176.967 -0.489 1
1 948 . 46 1 1 A 82 82 CYS CA C 82 65.232 63.070 2.162 1
1 949 . 46 1 1 A 82 82 CYS CB C 82 26.762 26.984 -0.222 1
1 950 . 46 1 1 A 82 82 CYS N N 82 120.576 117.894 2.682 1
1 951 . 46 1 1 A 83 83 ARG H H 83 8.522 7.990 0.532 1
1 952 . 46 1 1 A 83 83 ARG HA H 83 3.932 4.209 -0.277 1
1 960 . 46 1 1 A 83 83 ARG C C 83 179.138 178.869 0.269 1
1 961 . 46 1 1 A 83 83 ARG CA C 83 60.443 59.606 0.837 1
1 962 . 46 1 1 A 83 83 ARG CB C 83 29.550 29.707 -0.157 1
1 965 . 46 1 1 A 83 83 ARG N N 83 123.035 120.004 3.031 1
1 967 . 46 1 1 A 84 84 ASP H H 84 7.791 8.394 -0.603 1
1 968 . 46 1 1 A 84 84 ASP HA H 84 4.353 4.367 -0.014 1
1 971 . 46 1 1 A 84 84 ASP C C 84 178.649 178.853 -0.204 1
1 972 . 46 1 1 A 84 84 ASP CA C 84 57.767 57.590 0.177 1
1 973 . 46 1 1 A 84 84 ASP CB C 84 41.305 41.925 -0.620 1
1 974 . 46 1 1 A 84 84 ASP N N 84 120.332 119.343 0.989 1
1 975 . 46 1 1 A 85 85 THR H H 85 8.370 7.908 0.462 1
1 976 . 46 1 1 A 85 85 THR HA H 85 3.730 3.892 -0.162 1
1 981 . 46 1 1 A 85 85 THR C C 85 175.198 176.299 -1.101 1
1 982 . 46 1 1 A 85 85 THR CA C 85 66.830 66.035 0.795 1
1 983 . 46 1 1 A 85 85 THR CB C 85 68.533 68.353 0.180 1
1 985 . 46 1 1 A 85 85 THR N N 85 117.360 115.436 1.924 1
1 986 . 46 1 1 A 86 86 ALA H H 86 8.845 8.161 0.684 1
1 987 . 46 1 1 A 86 86 ALA HA H 86 3.991 3.962 0.029 1
1 991 . 46 1 1 A 86 86 ALA C C 86 179.980 179.933 0.047 1
1 992 . 46 1 1 A 86 86 ALA CA C 86 55.769 55.524 0.245 1
1 993 . 46 1 1 A 86 86 ALA CB C 86 17.881 18.295 -0.414 1
1 994 . 46 1 1 A 86 86 ALA N N 86 123.613 123.488 0.125 1
1 995 . 46 1 1 A 87 87 LYS H H 87 7.686 8.528 -0.842 1
1 996 . 46 1 1 A 87 87 LYS HA H 87 4.099 3.919 0.180 1
1 1005 . 46 1 1 A 87 87 LYS C C 87 179.592 179.701 -0.109 1
1 1006 . 46 1 1 A 87 87 LYS CA C 87 59.708 59.737 -0.029 1
1 1007 . 46 1 1 A 87 87 LYS CB C 87 32.054 32.270 -0.216 1
1 1011 . 46 1 1 A 87 87 LYS N N 87 119.623 117.395 2.228 1
1 1012 . 46 1 1 A 88 88 ARG H H 88 7.683 7.697 -0.014 1
1 1013 . 46 1 1 A 88 88 ARG HA H 88 4.051 4.122 -0.071 1
1 1020 . 46 1 1 A 88 88 ARG C C 88 180.053 179.069 0.984 1
1 1021 . 46 1 1 A 88 88 ARG CA C 88 59.558 59.172 0.386 1
1 1022 . 46 1 1 A 88 88 ARG CB C 88 29.684 29.789 -0.105 1
1 1025 . 46 1 1 A 88 88 ARG N N 88 120.788 119.084 1.704 1
1 1026 . 46 1 1 A 89 89 ASN H H 89 8.973 8.019 0.954 1
1 1027 . 46 1 1 A 89 89 ASN HA H 89 4.354 4.608 -0.254 1
1 1032 . 46 1 1 A 89 89 ASN C C 89 178.382 178.696 -0.314 1
1 1033 . 46 1 1 A 89 89 ASN CA C 89 55.334 55.827 -0.493 1
1 1034 . 46 1 1 A 89 89 ASN CB C 89 37.864 38.047 -0.183 1
1 1035 . 46 1 1 A 89 89 ASN N N 89 121.012 117.657 3.355 1
1 1037 . 46 1 1 A 90 90 GLN H H 90 8.152 8.155 -0.003 1
1 1038 . 46 1 1 A 90 90 GLN HA H 90 4.020 4.069 -0.049 1
1 1045 . 46 1 1 A 90 90 GLN C C 90 179.075 178.665 0.410 1
1 1046 . 46 1 1 A 90 90 GLN CA C 90 59.318 58.931 0.387 1
1 1047 . 46 1 1 A 90 90 GLN CB C 90 28.049 28.204 -0.155 1
1 1049 . 46 1 1 A 90 90 GLN N N 90 122.122 121.028 1.094 1
1 1051 . 46 1 1 A 91 91 GLN H H 91 7.514 8.461 -0.947 1
1 1052 . 46 1 1 A 91 91 GLN HA H 91 4.053 4.161 -0.108 1
1 1059 . 46 1 1 A 91 91 GLN C C 91 177.081 177.043 0.038 1
1 1060 . 46 1 1 A 91 91 GLN CA C 91 58.031 57.834 0.197 1
1 1061 . 46 1 1 A 91 91 GLN CB C 91 28.365 27.385 0.980 1
1 1063 . 46 1 1 A 91 91 GLN N N 91 118.124 117.945 0.179 1
1 1065 . 46 1 1 A 92 92 ALA H H 92 7.704 7.324 0.380 1
1 1066 . 46 1 1 A 92 92 ALA HA H 92 4.246 4.431 -0.185 1
1 1070 . 46 1 1 A 92 92 ALA C C 92 178.450 177.651 0.799 1
1 1071 . 46 1 1 A 92 92 ALA CA C 92 52.671 51.849 0.822 1
1 1072 . 46 1 1 A 92 92 ALA CB C 92 19.316 20.002 -0.686 1
1 1073 . 46 1 1 A 92 92 ALA N N 92 119.880 121.217 -1.337 1
1 1074 . 46 1 1 A 93 93 GLY H H 93 7.693 7.989 -0.296 1
1 1075 . 46 1 1 A 93 93 GLY HA2 H 93 3.941 3.969 -0.028 1
1 1076 . 46 1 1 A 93 93 GLY HA3 H 93 3.744 3.976 -0.232 1
1 1077 . 46 1 1 A 93 93 GLY C C 93 174.344 174.898 -0.554 1
1 1078 . 46 1 1 A 93 93 GLY CA C 93 45.949 46.570 -0.621 1
1 1079 . 46 1 1 A 93 93 GLY N N 93 105.347 106.555 -1.208 1
1 1080 . 46 1 1 A 94 94 ASN H H 94 7.076 8.842 -1.766 1
1 1081 . 46 1 1 A 94 94 ASN HA H 94 4.115 4.692 -0.577 1
1 1085 . 46 1 1 A 94 94 ASN C C 94 175.410 176.438 -1.028 1
1 1086 . 46 1 1 A 94 94 ASN CA C 94 52.651 54.195 -1.544 1
1 1087 . 46 1 1 A 94 94 ASN CB C 94 38.330 39.049 -0.719 1
1 1088 . 46 1 1 A 94 94 ASN N N 94 115.747 118.305 -2.558 1
1 1090 . 46 1 1 A 95 95 GLY H H 95 8.236 8.633 -0.397 1
1 1091 . 46 1 1 A 95 95 GLY HA2 H 95 3.633 4.002 -0.369 1
1 1092 . 46 1 1 A 95 95 GLY HA3 H 95 3.633 4.031 -0.398 1
1 1093 . 46 1 1 A 95 95 GLY C C 95 174.450 173.702 0.748 1
1 1094 . 46 1 1 A 95 95 GLY CA C 95 45.522 46.698 -1.176 1
1 1095 . 46 1 1 A 95 95 GLY N N 95 109.166 107.224 1.942 1
1 1096 . 46 1 1 A 96 96 TRP H H 96 7.899 7.789 0.110 1
1 1097 . 46 1 1 A 96 96 TRP HA H 96 5.241 5.069 0.172 1
1 1106 . 46 1 1 A 96 96 TRP C C 96 175.661 175.075 0.586 1
1 1107 . 46 1 1 A 96 96 TRP CA C 96 55.090 56.765 -1.675 1
1 1108 . 46 1 1 A 96 96 TRP CB C 96 27.138 33.120 -5.982 1
1 1114 . 46 1 1 A 96 96 TRP N N 96 122.840 120.446 2.394 1
1 1116 . 46 1 1 A 97 97 ASP H H 97 7.344 8.671 -1.327 1
1 1117 . 46 1 1 A 97 97 ASP HA H 97 4.829 4.032 0.797 1
1 1120 . 46 1 1 A 97 97 ASP C C 97 175.019 176.356 -1.337 1
1 1121 . 46 1 1 A 97 97 ASP CA C 97 52.149 56.228 -4.079 1
1 1122 . 46 1 1 A 97 97 ASP CB C 97 42.697 38.443 4.254 1
1 1123 . 46 1 1 A 97 97 ASP N N 97 126.861 122.548 4.313 1
1 1124 . 46 1 1 A 98 98 PHE H H 98 8.566 8.642 -0.076 1
1 1125 . 46 1 1 A 98 98 PHE HA H 98 3.727 3.985 -0.258 1
1 1133 . 46 1 1 A 98 98 PHE C C 98 177.443 177.284 0.159 1
1 1134 . 46 1 1 A 98 98 PHE CA C 98 62.471 61.524 0.947 1
1 1135 . 46 1 1 A 98 98 PHE CB C 98 39.919 39.390 0.529 1
1 1141 . 46 1 1 A 98 98 PHE N N 98 117.781 121.210 -3.429 1
1 1142 . 46 1 1 A 99 99 ASP H H 99 8.259 8.152 0.107 1
1 1143 . 46 1 1 A 99 99 ASP HA H 99 3.960 4.061 -0.101 1
1 1146 . 46 1 1 A 99 99 ASP C C 99 178.132 177.865 0.267 1
1 1147 . 46 1 1 A 99 99 ASP CA C 99 57.658 56.341 1.317 1
1 1148 . 46 1 1 A 99 99 ASP CB C 99 38.572 40.686 -2.114 1
1 1149 . 46 1 1 A 99 99 ASP N N 99 121.709 118.925 2.784 1
1 1150 . 46 1 1 A 100 100 MET H H 100 8.008 8.065 -0.057 1
1 1151 . 46 1 1 A 100 100 MET HA H 100 3.644 4.030 -0.386 1
1 1156 . 46 1 1 A 100 100 MET C C 100 180.008 177.479 2.529 1
1 1157 . 46 1 1 A 100 100 MET CA C 100 58.598 58.699 -0.101 1
1 1158 . 46 1 1 A 100 100 MET CB C 100 33.423 32.730 0.693 1
1 1160 . 46 1 1 A 100 100 MET N N 100 119.668 117.805 1.863 1
1 1161 . 46 1 1 A 101 101 LEU H H 101 7.961 8.357 -0.396 1
1 1162 . 46 1 1 A 101 101 LEU HA H 101 3.523 4.353 -0.830 1
1 1172 . 46 1 1 A 101 101 LEU C C 101 173.873 175.198 -1.325 1
1 1173 . 46 1 1 A 101 101 LEU CA C 101 58.743 54.101 4.642 1
1 1174 . 46 1 1 A 101 101 LEU CB C 101 42.632 41.141 1.491 1
1 1178 . 46 1 1 A 101 101 LEU N N 101 119.752 118.690 1.062 1
1 1179 . 46 1 1 A 102 102 THR H H 102 6.955 7.978 -1.023 1
1 1180 . 46 1 1 A 102 102 THR HA H 102 4.134 4.589 -0.455 1
1 1185 . 46 1 1 A 102 102 THR C C 102 176.513 172.730 3.783 1
1 1186 . 46 1 1 A 102 102 THR CA C 102 61.125 60.494 0.631 1
1 1187 . 46 1 1 A 102 102 THR CB C 102 71.415 70.518 0.897 1
1 1189 . 46 1 1 A 102 102 THR N N 102 124.665 118.266 6.399 1
1 1190 . 46 1 1 A 103 103 GLY H H 103 7.816 8.969 -1.153 1
1 1191 . 46 1 1 A 103 103 GLY HA2 H 103 3.824 3.987 -0.163 1
1 1192 . 46 1 1 A 103 103 GLY HA3 H 103 3.824 4.077 -0.253 1
1 1193 . 46 1 1 A 103 103 GLY C C 103 174.126 174.384 -0.258 1
1 1194 . 46 1 1 A 103 103 GLY CA C 103 47.805 47.170 0.635 1
1 1195 . 46 1 1 A 103 103 GLY N N 103 114.191 112.102 2.089 1
1 1196 . 46 1 1 A 104 104 SER H H 104 8.860 8.504 0.356 1
1 1197 . 46 1 1 A 104 104 SER HA H 104 4.758 4.462 0.296 1
1 1200 . 46 1 1 A 104 104 SER C C 104 174.591 174.670 -0.079 1
1 1201 . 46 1 1 A 104 104 SER CA C 104 56.755 58.011 -1.256 1
1 1202 . 46 1 1 A 104 104 SER CB C 104 65.050 62.980 2.070 1
1 1203 . 46 1 1 A 104 104 SER N N 104 114.771 120.090 -5.319 1
1 1204 . 46 1 1 A 105 105 GLY H H 105 8.788 7.965 0.823 1
1 1205 . 46 1 1 A 105 105 GLY HA2 H 105 3.733 3.923 -0.190 1
1 1206 . 46 1 1 A 105 105 GLY HA3 H 105 3.733 3.954 -0.221 1
1 1207 . 46 1 1 A 105 105 GLY CA C 105 47.247 46.401 0.846 1
1 1208 . 46 1 1 A 105 105 GLY N N 105 110.394 108.708 1.686 1
1 1209 . 46 1 1 A 106 106 ASN HA H 106 4.454 4.688 -0.234 1
1 1212 . 46 1 1 A 106 106 ASN C C 106 175.180 175.905 -0.725 1
1 1213 . 46 1 1 A 106 106 ASN CA C 106 54.492 55.404 -0.912 1
1 1214 . 46 1 1 A 106 106 ASN CB C 106 37.282 39.507 -2.225 1
1 1215 . 46 1 1 A 107 107 TYR H H 107 8.241 7.439 0.802 1
1 1216 . 46 1 1 A 107 107 TYR HA H 107 4.335 4.847 -0.512 1
1 1223 . 46 1 1 A 107 107 TYR C C 107 173.954 176.506 -2.552 1
1 1224 . 46 1 1 A 107 107 TYR CA C 107 57.727 57.030 0.697 1
1 1225 . 46 1 1 A 107 107 TYR CB C 107 37.063 39.785 -2.722 1
1 1230 . 46 1 1 A 107 107 TYR N N 107 120.708 113.892 6.816 1
1 1231 . 46 1 1 A 108 108 SER H H 108 7.117 7.858 -0.741 1
1 1232 . 46 1 1 A 108 108 SER HA H 108 4.221 4.235 -0.014 1
1 1235 . 46 1 1 A 108 108 SER C C 108 174.834 174.014 0.820 1
1 1236 . 46 1 1 A 108 108 SER CA C 108 59.859 60.075 -0.216 1
1 1237 . 46 1 1 A 108 108 SER CB C 108 63.846 63.320 0.526 1
1 1238 . 46 1 1 A 108 108 SER N N 108 113.362 115.980 -2.618 1
1 1239 . 46 1 1 A 109 109 SER H H 109 8.053 8.157 -0.104 1
1 1240 . 46 1 1 A 109 109 SER HA H 109 4.560 4.401 0.159 1
1 1243 . 46 1 1 A 109 109 SER CA C 109 57.141 59.727 -2.586 1
1 1244 . 46 1 1 A 109 109 SER CB C 109 64.874 62.866 2.008 1
1 1245 . 46 1 1 A 109 109 SER N N 109 116.657 115.654 1.003 1
1 1246 . 46 1 1 A 110 110 THR HA H 110 3.541 3.905 -0.364 1
1 1251 . 46 1 1 A 110 110 THR C C 110 175.477 176.094 -0.617 1
1 1252 . 46 1 1 A 110 110 THR CA C 110 66.443 66.469 -0.026 1
1 1253 . 46 1 1 A 110 110 THR CB C 110 68.091 68.461 -0.370 1
1 1255 . 46 1 1 A 111 111 ASP H H 111 8.224 8.378 -0.154 1
1 1256 . 46 1 1 A 111 111 ASP HA H 111 4.237 4.313 -0.076 1
1 1259 . 46 1 1 A 111 111 ASP C C 111 177.520 178.644 -1.124 1
1 1260 . 46 1 1 A 111 111 ASP CA C 111 57.559 57.174 0.385 1
1 1261 . 46 1 1 A 111 111 ASP CB C 111 40.292 40.550 -0.258 1
1 1262 . 46 1 1 A 111 111 ASP N N 111 119.490 120.545 -1.055 1
1 1263 . 46 1 1 A 112 112 ALA H H 112 7.431 8.290 -0.859 1
1 1264 . 46 1 1 A 112 112 ALA HA H 112 4.191 4.071 0.120 1
1 1268 . 46 1 1 A 112 112 ALA C C 112 180.646 179.376 1.270 1
1 1269 . 46 1 1 A 112 112 ALA CA C 112 54.534 55.238 -0.704 1
1 1270 . 46 1 1 A 112 112 ALA CB C 112 18.992 18.702 0.290 1
1 1271 . 46 1 1 A 112 112 ALA N N 112 119.710 122.310 -2.600 1
1 1272 . 46 1 1 A 113 113 GLN H H 113 7.576 7.588 -0.012 1
1 1273 . 46 1 1 A 113 113 GLN HA H 113 3.562 4.201 -0.639 1
1 1278 . 46 1 1 A 113 113 GLN C C 113 176.756 178.228 -1.472 1
1 1279 . 46 1 1 A 113 113 GLN CA C 113 57.736 57.729 0.007 1
1 1280 . 46 1 1 A 113 113 GLN CB C 113 29.110 28.497 0.613 1
1 1281 . 46 1 1 A 113 113 GLN N N 113 117.518 116.475 1.043 1
1 1283 . 46 1 1 A 114 114 MET H H 114 8.192 8.054 0.138 1
1 1284 . 46 1 1 A 114 114 MET HA H 114 4.231 4.256 -0.025 1
1 1289 . 46 1 1 A 114 114 MET C C 114 175.648 178.181 -2.533 1
1 1290 . 46 1 1 A 114 114 MET CA C 114 57.446 57.604 -0.158 1
1 1291 . 46 1 1 A 114 114 MET CB C 114 33.570 32.190 1.380 1
1 1293 . 46 1 1 A 114 114 MET N N 114 111.509 119.092 -7.583 1
1 1294 . 46 1 1 A 115 115 GLN H H 115 6.940 7.374 -0.434 1
1 1295 . 46 1 1 A 115 115 GLN HA H 115 4.307 4.198 0.109 1
1 1302 . 46 1 1 A 115 115 GLN C C 115 176.270 175.959 0.311 1
1 1303 . 46 1 1 A 115 115 GLN CA C 115 54.680 58.355 -3.675 1
1 1304 . 46 1 1 A 115 115 GLN CB C 115 28.233 28.962 -0.729 1
1 1306 . 46 1 1 A 115 115 GLN N N 115 114.300 117.567 -3.267 1
1 1308 . 46 1 1 A 116 116 TYR H H 116 6.677 8.101 -1.424 1
1 1309 . 46 1 1 A 116 116 TYR HA H 116 4.193 4.195 -0.002 1
1 1312 . 46 1 1 A 116 116 TYR C C 116 175.268 174.245 1.023 1
1 1313 . 46 1 1 A 116 116 TYR CA C 116 54.357 58.724 -4.367 1
1 1314 . 46 1 1 A 116 116 TYR CB C 116 35.498 36.705 -1.207 1
1 1315 . 46 1 1 A 116 116 TYR N N 116 117.919 119.123 -1.204 1
1 1316 . 46 1 1 A 117 117 ASP H H 117 8.081 8.288 -0.207 1
1 1317 . 46 1 1 A 117 117 ASP HA H 117 4.665 4.727 -0.062 1
1 1320 . 46 1 1 A 117 117 ASP CA C 117 52.422 50.162 2.260 1
1 1321 . 46 1 1 A 117 117 ASP CB C 117 42.416 43.210 -0.794 1
1 1322 . 46 1 1 A 117 117 ASP N N 117 120.887 128.020 -7.133 1
1 1323 . 46 1 1 A 118 118 PRO C C 118 179.180 178.365 0.815 1
1 1324 . 46 1 1 A 118 118 PRO CA C 118 65.942 64.660 1.282 1
1 1325 . 46 1 1 A 118 118 PRO CB C 118 32.197 31.808 0.389 1
1 1326 . 46 1 1 A 119 119 GLY H H 119 9.742 8.706 1.036 1
1 1327 . 46 1 1 A 119 119 GLY C C 119 175.622 175.650 -0.028 1
1 1328 . 46 1 1 A 119 119 GLY CA C 119 46.785 46.919 -0.134 1
1 1329 . 46 1 1 A 119 119 GLY N N 119 106.412 106.687 -0.275 1
1 1330 . 46 1 1 A 120 120 LEU H H 120 6.666 8.050 -1.384 1
1 1331 . 46 1 1 A 120 120 LEU HA H 120 3.365 3.537 -0.172 1
1 1341 . 46 1 1 A 120 120 LEU C C 120 179.262 178.643 0.619 1
1 1342 . 46 1 1 A 120 120 LEU CA C 120 56.605 56.980 -0.375 1
1 1343 . 46 1 1 A 120 120 LEU CB C 120 39.262 41.494 -2.232 1
1 1347 . 46 1 1 A 120 120 LEU N N 120 126.226 122.652 3.574 1
1 1348 . 46 1 1 A 121 121 PHE H H 121 7.356 8.973 -1.617 1
1 1349 . 46 1 1 A 121 121 PHE HA H 121 4.459 4.094 0.365 1
1 1352 . 46 1 1 A 121 121 PHE C C 121 179.716 177.751 1.965 1
1 1353 . 46 1 1 A 121 121 PHE CA C 121 62.838 62.148 0.690 1
1 1354 . 46 1 1 A 121 121 PHE CB C 121 37.603 39.408 -1.805 1
1 1355 . 46 1 1 A 121 121 PHE N N 121 117.437 119.352 -1.915 1
1 1356 . 46 1 1 A 122 122 ALA H H 122 7.926 7.986 -0.060 1
1 1357 . 46 1 1 A 122 122 ALA HA H 122 4.523 4.122 0.401 1
1 1361 . 46 1 1 A 122 122 ALA C C 122 180.435 180.113 0.322 1
1 1362 . 46 1 1 A 122 122 ALA CA C 122 55.527 55.416 0.111 1
1 1363 . 46 1 1 A 122 122 ALA CB C 122 17.814 18.032 -0.218 1
1 1364 . 46 1 1 A 122 122 ALA N N 122 121.068 121.212 -0.144 1
1 1365 . 46 1 1 A 123 123 GLN H H 123 7.507 7.840 -0.333 1
1 1366 . 46 1 1 A 123 123 GLN HA H 123 4.153 3.874 0.279 1
1 1371 . 46 1 1 A 123 123 GLN C C 123 180.561 178.480 2.081 1
1 1372 . 46 1 1 A 123 123 GLN CA C 123 59.948 59.090 0.858 1
1 1373 . 46 1 1 A 123 123 GLN CB C 123 29.135 28.189 0.946 1
1 1375 . 46 1 1 A 123 123 GLN N N 123 120.324 117.268 3.056 1
1 1376 . 46 1 1 A 124 124 ILE H H 124 8.318 7.701 0.617 1
1 1377 . 46 1 1 A 124 124 ILE HA H 124 3.635 3.788 -0.153 1
1 1387 . 46 1 1 A 124 124 ILE C C 124 176.481 178.090 -1.609 1
1 1388 . 46 1 1 A 124 124 ILE CA C 124 66.432 64.468 1.964 1
1 1389 . 46 1 1 A 124 124 ILE CB C 124 39.168 37.687 1.481 1
1 1393 . 46 1 1 A 124 124 ILE N N 124 123.747 118.224 5.523 1
1 1394 . 46 1 1 A 125 125 GLN H H 125 8.474 8.086 0.388 1
1 1395 . 46 1 1 A 125 125 GLN HA H 125 4.264 3.924 0.340 1
1 1402 . 46 1 1 A 125 125 GLN C C 125 178.947 177.813 1.134 1
1 1403 . 46 1 1 A 125 125 GLN CA C 125 59.651 58.523 1.128 1
1 1404 . 46 1 1 A 125 125 GLN CB C 125 28.880 28.636 0.244 1
1 1406 . 46 1 1 A 125 125 GLN N N 125 120.368 121.115 -0.747 1
1 1408 . 46 1 1 A 126 126 ALA H H 126 8.002 7.936 0.066 1
1 1409 . 46 1 1 A 126 126 ALA HA H 126 4.144 4.047 0.097 1
1 1413 . 46 1 1 A 126 126 ALA C C 126 179.316 179.965 -0.649 1
1 1414 . 46 1 1 A 126 126 ALA CA C 126 55.036 55.056 -0.020 1
1 1415 . 46 1 1 A 126 126 ALA CB C 126 18.087 18.081 0.006 1
1 1416 . 46 1 1 A 126 126 ALA N N 126 121.661 121.121 0.540 1
1 1417 . 46 1 1 A 127 127 ALA H H 127 7.823 8.152 -0.329 1
1 1418 . 46 1 1 A 127 127 ALA HA H 127 4.162 4.007 0.155 1
1 1422 . 46 1 1 A 127 127 ALA C C 127 180.707 179.276 1.431 1
1 1423 . 46 1 1 A 127 127 ALA CA C 127 55.080 54.891 0.189 1
1 1424 . 46 1 1 A 127 127 ALA CB C 127 19.354 18.189 1.165 1
1 1425 . 46 1 1 A 127 127 ALA N N 127 119.853 120.036 -0.183 1
1 1426 . 46 1 1 A 128 128 ALA H H 128 8.936 7.743 1.193 1
1 1427 . 46 1 1 A 128 128 ALA HA H 128 3.928 3.808 0.120 1
1 1431 . 46 1 1 A 128 128 ALA C C 128 181.031 179.357 1.674 1
1 1432 . 46 1 1 A 128 128 ALA CA C 128 55.502 54.664 0.838 1
1 1433 . 46 1 1 A 128 128 ALA CB C 128 16.609 17.623 -1.014 1
1 1434 . 46 1 1 A 128 128 ALA N N 128 121.355 120.067 1.288 1
1 1435 . 46 1 1 A 129 129 THR H H 129 8.543 7.431 1.112 1
1 1436 . 46 1 1 A 129 129 THR HA H 129 4.015 3.645 0.370 1
1 1441 . 46 1 1 A 129 129 THR C C 129 177.332 176.048 1.284 1
1 1442 . 46 1 1 A 129 129 THR CA C 129 65.893 64.784 1.109 1
1 1443 . 46 1 1 A 129 129 THR CB C 129 68.566 68.549 0.017 1
1 1445 . 46 1 1 A 129 129 THR N N 129 112.709 112.187 0.522 1
1 1446 . 46 1 1 A 130 130 LYS H H 130 8.126 7.562 0.564 1
1 1447 . 46 1 1 A 130 130 LYS HA H 130 4.000 3.979 0.021 1
1 1456 . 46 1 1 A 130 130 LYS C C 130 179.082 178.650 0.432 1
1 1457 . 46 1 1 A 130 130 LYS CA C 130 60.299 58.554 1.745 1
1 1458 . 46 1 1 A 130 130 LYS CB C 130 32.767 31.997 0.770 1
1 1462 . 46 1 1 A 130 130 LYS N N 130 123.879 120.739 3.140 1
1 1463 . 46 1 1 A 131 131 ALA H H 131 7.184 7.774 -0.590 1
1 1464 . 46 1 1 A 131 131 ALA HA H 131 4.005 4.244 -0.239 1
1 1468 . 46 1 1 A 131 131 ALA C C 131 178.482 179.543 -1.061 1
1 1469 . 46 1 1 A 131 131 ALA CA C 131 55.027 55.083 -0.056 1
1 1470 . 46 1 1 A 131 131 ALA CB C 131 18.669 19.549 -0.880 1
1 1471 . 46 1 1 A 131 131 ALA N N 131 118.590 121.114 -2.524 1
1 1472 . 46 1 1 A 132 132 TRP H H 132 7.977 8.689 -0.712 1
1 1473 . 46 1 1 A 132 132 TRP HA H 132 4.001 4.197 -0.196 1
1 1480 . 46 1 1 A 132 132 TRP C C 132 177.332 175.795 1.537 1
1 1481 . 46 1 1 A 132 132 TRP CA C 132 60.431 57.353 3.078 1
1 1482 . 46 1 1 A 132 132 TRP CB C 132 27.786 27.513 0.273 1
1 1486 . 46 1 1 A 132 132 TRP N N 132 119.168 117.224 1.944 1
1 1488 . 46 1 1 A 133 133 ARG H H 133 8.006 8.246 -0.240 1
1 1489 . 46 1 1 A 133 133 ARG HA H 133 4.027 4.387 -0.360 1
1 1497 . 46 1 1 A 133 133 ARG C C 133 176.664 177.444 -0.780 1
1 1498 . 46 1 1 A 133 133 ARG CA C 133 59.355 57.094 2.261 1
1 1499 . 46 1 1 A 133 133 ARG CB C 133 30.451 32.533 -2.082 1
1 1502 . 46 1 1 A 133 133 ARG N N 133 113.062 120.525 -7.463 1
1 1504 . 46 1 1 A 134 134 LYS H H 134 7.322 7.589 -0.267 1
1 1505 . 46 1 1 A 134 134 LYS HA H 134 4.313 4.411 -0.098 1
1 1514 . 46 1 1 A 134 134 LYS C C 134 176.282 175.912 0.370 1
1 1515 . 46 1 1 A 134 134 LYS CA C 134 54.922 56.374 -1.452 1
1 1516 . 46 1 1 A 134 134 LYS CB C 134 32.633 32.083 0.550 1
1 1520 . 46 1 1 A 134 134 LYS N N 134 118.170 115.234 2.936 1
1 1521 . 46 1 1 A 135 135 LEU H H 135 7.440 7.246 0.194 1
1 1522 . 46 1 1 A 135 135 LEU HA H 135 4.174 5.093 -0.919 1
1 1532 . 46 1 1 A 135 135 LEU CA C 135 54.408 51.129 3.279 1
1 1533 . 46 1 1 A 135 135 LEU CB C 135 40.407 43.420 -3.013 1
1 1537 . 46 1 1 A 135 135 LEU N N 135 123.358 116.875 6.483 1
1 1538 . 46 1 1 A 136 136 PRO HA H 136 4.437 4.656 -0.219 1
1 1545 . 46 1 1 A 136 136 PRO C C 136 177.106 176.390 0.716 1
1 1546 . 46 1 1 A 136 136 PRO CA C 136 62.889 62.291 0.598 1
1 1547 . 46 1 1 A 136 136 PRO CB C 136 32.192 32.845 -0.653 1
1 1550 . 46 1 1 A 137 137 VAL H H 137 8.219 8.515 -0.296 1
1 1551 . 46 1 1 A 137 137 VAL HA H 137 4.077 4.207 -0.130 1
1 1559 . 46 1 1 A 137 137 VAL C C 137 176.305 173.834 2.471 1
1 1560 . 46 1 1 A 137 137 VAL CA C 137 61.958 63.164 -1.206 1
1 1561 . 46 1 1 A 137 137 VAL CB C 137 32.755 30.762 1.993 1
1 1564 . 46 1 1 A 137 137 VAL N N 137 120.079 116.539 3.540 1
1 1565 . 46 1 1 A 138 138 LYS H H 138 8.444 8.442 0.002 1
1 1566 . 46 1 1 A 138 138 LYS HA H 138 4.316 4.575 -0.259 1
1 1575 . 46 1 1 A 138 138 LYS C C 138 176.790 176.510 0.280 1
1 1576 . 46 1 1 A 138 138 LYS CA C 138 56.792 55.098 1.694 1
1 1577 . 46 1 1 A 138 138 LYS CB C 138 33.205 33.967 -0.762 1
1 1581 . 46 1 1 A 138 138 LYS N N 138 126.449 126.370 0.079 1
1 1582 . 46 1 1 A 139 139 GLY H H 139 8.518 8.869 -0.351 1
1 1583 . 46 1 1 A 139 139 GLY HA2 H 139 4.070 3.923 0.147 1
1 1584 . 46 1 1 A 139 139 GLY HA3 H 139 3.897 3.934 -0.037 1
1 1585 . 46 1 1 A 139 139 GLY C C 139 172.874 172.869 0.005 1
1 1586 . 46 1 1 A 139 139 GLY CA C 139 45.157 46.195 -1.038 1
1 1587 . 46 1 1 A 139 139 GLY N N 139 112.617 114.995 -2.378 1
1 6 . 47 1 1 A 2 2 VAL H H 2 8.992 7.687 1.305 1
1 7 . 47 1 1 A 2 2 VAL HA H 2 5.370 4.047 1.323 1
1 15 . 47 1 1 A 2 2 VAL C C 2 174.325 175.448 -1.123 1
1 16 . 47 1 1 A 2 2 VAL CA C 2 61.267 62.599 -1.332 1
1 17 . 47 1 1 A 2 2 VAL CB C 2 33.890 32.194 1.696 1
1 20 . 47 1 1 A 2 2 VAL N N 2 126.939 117.216 9.723 1
1 21 . 47 1 1 A 3 3 THR H H 3 8.912 8.735 0.177 1
1 22 . 47 1 1 A 3 3 THR HA H 3 4.505 4.971 -0.466 1
1 27 . 47 1 1 A 3 3 THR C C 3 172.710 174.106 -1.396 1
1 28 . 47 1 1 A 3 3 THR CA C 3 59.689 59.744 -0.055 1
1 29 . 47 1 1 A 3 3 THR CB C 3 72.398 70.675 1.723 1
1 31 . 47 1 1 A 3 3 THR N N 3 118.091 116.229 1.862 1
1 32 . 47 1 1 A 4 4 GLU H H 4 8.631 8.855 -0.224 1
1 33 . 47 1 1 A 4 4 GLU HA H 4 5.788 5.056 0.732 1
1 38 . 47 1 1 A 4 4 GLU C C 4 175.758 174.298 1.460 1
1 39 . 47 1 1 A 4 4 GLU CA C 4 54.902 54.245 0.657 1
1 40 . 47 1 1 A 4 4 GLU CB C 4 35.097 33.475 1.622 1
1 42 . 47 1 1 A 4 4 GLU N N 4 120.966 119.735 1.231 1
1 43 . 47 1 1 A 5 5 THR H H 5 9.188 8.477 0.711 1
1 44 . 47 1 1 A 5 5 THR HA H 5 4.739 4.712 0.027 1
1 49 . 47 1 1 A 5 5 THR C C 5 172.757 171.638 1.119 1
1 50 . 47 1 1 A 5 5 THR CA C 5 60.382 60.419 -0.037 1
1 51 . 47 1 1 A 5 5 THR CB C 5 71.558 70.395 1.163 1
1 53 . 47 1 1 A 5 5 THR N N 5 119.366 114.368 4.998 1
1 54 . 47 1 1 A 6 6 VAL H H 6 8.476 8.420 0.056 1
1 55 . 47 1 1 A 6 6 VAL HA H 6 5.026 5.833 -0.807 1
1 63 . 47 1 1 A 6 6 VAL C C 6 176.674 175.004 1.670 1
1 64 . 47 1 1 A 6 6 VAL CA C 6 61.008 60.951 0.057 1
1 65 . 47 1 1 A 6 6 VAL CB C 6 33.861 35.227 -1.366 1
1 68 . 47 1 1 A 6 6 VAL N N 6 121.384 123.524 -2.140 1
1 69 . 47 1 1 A 7 7 ASP H H 7 8.848 8.949 -0.101 1
1 70 . 47 1 1 A 7 7 ASP HA H 7 4.797 4.739 0.058 1
1 73 . 47 1 1 A 7 7 ASP CA C 7 52.834 54.965 -2.131 1
1 74 . 47 1 1 A 7 7 ASP CB C 7 42.219 42.409 -0.190 1
1 75 . 47 1 1 A 7 7 ASP N N 7 127.061 127.145 -0.084 1
1 76 . 47 1 1 A 8 8 GLY C C 8 175.143 174.696 0.447 1
1 77 . 47 1 1 A 8 8 GLY CA C 8 46.553 47.176 -0.623 1
1 78 . 47 1 1 A 9 9 GLN H H 9 8.408 8.041 0.367 1
1 79 . 47 1 1 A 9 9 GLN HA H 9 4.541 4.262 0.279 1
1 86 . 47 1 1 A 9 9 GLN C C 9 176.463 177.049 -0.586 1
1 87 . 47 1 1 A 9 9 GLN CA C 9 55.167 55.292 -0.125 1
1 88 . 47 1 1 A 9 9 GLN CB C 9 29.376 27.922 1.454 1
1 90 . 47 1 1 A 9 9 GLN N N 9 118.300 116.462 1.838 1
1 92 . 47 1 1 A 10 10 GLY H H 10 8.162 8.502 -0.340 1
1 93 . 47 1 1 A 10 10 GLY HA2 H 10 4.174 4.013 0.161 1
1 94 . 47 1 1 A 10 10 GLY HA3 H 10 3.521 4.031 -0.510 1
1 95 . 47 1 1 A 10 10 GLY C C 10 174.092 174.724 -0.632 1
1 96 . 47 1 1 A 10 10 GLY CA C 10 45.558 46.365 -0.807 1
1 97 . 47 1 1 A 10 10 GLY N N 10 108.747 110.350 -1.603 1
1 98 . 47 1 1 A 11 11 GLN H H 11 8.507 7.471 1.036 1
1 99 . 47 1 1 A 11 11 GLN HA H 11 4.202 4.602 -0.400 1
1 106 . 47 1 1 A 11 11 GLN C C 11 173.992 174.717 -0.725 1
1 107 . 47 1 1 A 11 11 GLN CA C 11 55.098 54.723 0.375 1
1 108 . 47 1 1 A 11 11 GLN CB C 11 29.097 30.142 -1.045 1
1 110 . 47 1 1 A 11 11 GLN N N 11 122.979 119.790 3.189 1
1 112 . 47 1 1 A 12 12 ALA H H 12 8.259 8.950 -0.691 1
1 113 . 47 1 1 A 12 12 ALA HA H 12 5.156 5.548 -0.392 1
1 117 . 47 1 1 A 12 12 ALA C C 12 177.284 176.734 0.550 1
1 118 . 47 1 1 A 12 12 ALA CA C 12 51.087 51.000 0.087 1
1 119 . 47 1 1 A 12 12 ALA CB C 12 20.500 20.530 -0.030 1
1 120 . 47 1 1 A 12 12 ALA N N 12 127.100 129.664 -2.564 1
1 121 . 47 1 1 A 13 13 TRP H H 13 9.245 8.728 0.517 1
1 122 . 47 1 1 A 13 13 TRP HA H 13 4.717 5.479 -0.762 1
1 131 . 47 1 1 A 13 13 TRP C C 13 175.108 174.395 0.713 1
1 132 . 47 1 1 A 13 13 TRP CA C 13 55.966 55.615 0.351 1
1 133 . 47 1 1 A 13 13 TRP CB C 13 31.912 32.121 -0.209 1
1 139 . 47 1 1 A 13 13 TRP N N 13 123.088 120.638 2.450 1
1 141 . 47 1 1 A 14 14 ARG H H 14 8.575 8.727 -0.152 1
1 142 . 47 1 1 A 14 14 ARG HA H 14 5.335 4.149 1.186 1
1 150 . 47 1 1 A 14 14 ARG C C 14 175.191 174.321 0.870 1
1 151 . 47 1 1 A 14 14 ARG CA C 14 53.106 55.002 -1.896 1
1 152 . 47 1 1 A 14 14 ARG CB C 14 32.749 31.738 1.011 1
1 154 . 47 1 1 A 14 14 ARG N N 14 121.163 119.792 1.371 1
1 156 . 47 1 1 A 15 15 HIS H H 15 8.595 8.202 0.393 1
1 157 . 47 1 1 A 15 15 HIS HA H 15 4.790 5.349 -0.559 1
1 161 . 47 1 1 A 15 15 HIS C C 15 173.770 174.920 -1.150 1
1 162 . 47 1 1 A 15 15 HIS CA C 15 55.289 53.935 1.354 1
1 163 . 47 1 1 A 15 15 HIS CB C 15 33.208 32.178 1.030 1
1 165 . 47 1 1 A 15 15 HIS N N 15 117.643 119.849 -2.206 1
1 166 . 47 1 1 A 16 16 HIS H H 16 8.993 9.020 -0.027 1
1 167 . 47 1 1 A 16 16 HIS HA H 16 5.158 4.786 0.372 1
1 171 . 47 1 1 A 16 16 HIS C C 16 173.608 174.244 -0.636 1
1 172 . 47 1 1 A 16 16 HIS CA C 16 56.450 56.282 0.168 1
1 173 . 47 1 1 A 16 16 HIS CB C 16 34.171 30.787 3.384 1
1 175 . 47 1 1 A 16 16 HIS N N 16 123.520 124.028 -0.508 1
1 176 . 47 1 1 A 17 17 ASN H H 17 7.829 8.659 -0.830 1
1 177 . 47 1 1 A 17 17 ASN HA H 17 4.713 4.917 -0.204 1
1 182 . 47 1 1 A 17 17 ASN C C 17 173.682 174.486 -0.804 1
1 183 . 47 1 1 A 17 17 ASN CA C 17 51.822 51.790 0.032 1
1 184 . 47 1 1 A 17 17 ASN CB C 17 43.176 42.590 0.586 1
1 185 . 47 1 1 A 17 17 ASN N N 17 122.213 125.771 -3.558 1
1 187 . 47 1 1 A 18 18 GLY H H 18 8.423 8.504 -0.081 1
1 188 . 47 1 1 A 18 18 GLY HA2 H 18 3.931 4.140 -0.209 1
1 189 . 47 1 1 A 18 18 GLY HA3 H 18 3.707 4.176 -0.469 1
1 190 . 47 1 1 A 18 18 GLY C C 18 173.985 173.035 0.950 1
1 191 . 47 1 1 A 18 18 GLY CA C 18 43.949 44.143 -0.194 1
1 192 . 47 1 1 A 18 18 GLY N N 18 106.991 109.853 -2.862 1
1 193 . 47 1 1 A 19 19 PHE H H 19 8.338 8.849 -0.511 1
1 194 . 47 1 1 A 19 19 PHE HA H 19 4.068 4.969 -0.901 1
1 197 . 47 1 1 A 19 19 PHE C C 19 176.568 175.465 1.103 1
1 198 . 47 1 1 A 19 19 PHE CA C 19 59.338 57.459 1.879 1
1 199 . 47 1 1 A 19 19 PHE CB C 19 40.201 41.867 -1.666 1
1 200 . 47 1 1 A 19 19 PHE N N 19 116.857 119.131 -2.274 1
1 201 . 47 1 1 A 20 20 ASP H H 20 8.794 9.100 -0.306 1
1 202 . 47 1 1 A 20 20 ASP HA H 20 4.485 4.983 -0.498 1
1 205 . 47 1 1 A 20 20 ASP C C 20 177.379 176.868 0.511 1
1 206 . 47 1 1 A 20 20 ASP CA C 20 54.140 54.489 -0.349 1
1 207 . 47 1 1 A 20 20 ASP CB C 20 41.915 41.368 0.547 1
1 208 . 47 1 1 A 20 20 ASP N N 20 123.025 122.027 0.998 1
1 209 . 47 1 1 A 21 21 PHE H H 21 8.862 9.048 -0.186 1
1 210 . 47 1 1 A 21 21 PHE HA H 21 4.087 4.095 -0.008 1
1 218 . 47 1 1 A 21 21 PHE C C 21 176.952 177.165 -0.213 1
1 219 . 47 1 1 A 21 21 PHE CA C 21 61.095 61.764 -0.669 1
1 220 . 47 1 1 A 21 21 PHE CB C 21 38.678 39.517 -0.839 1
1 226 . 47 1 1 A 21 21 PHE N N 21 127.163 125.501 1.662 1
1 227 . 47 1 1 A 22 22 ALA H H 22 8.561 8.357 0.204 1
1 228 . 47 1 1 A 22 22 ALA HA H 22 3.878 3.990 -0.112 1
1 232 . 47 1 1 A 22 22 ALA C C 22 180.710 179.589 1.121 1
1 233 . 47 1 1 A 22 22 ALA CA C 22 55.211 55.216 -0.005 1
1 234 . 47 1 1 A 22 22 ALA CB C 22 18.321 18.477 -0.156 1
1 235 . 47 1 1 A 22 22 ALA N N 22 120.293 121.272 -0.979 1
1 236 . 47 1 1 A 23 23 VAL H H 23 7.241 7.774 -0.533 1
1 237 . 47 1 1 A 23 23 VAL HA H 23 3.684 3.824 -0.140 1
1 245 . 47 1 1 A 23 23 VAL C C 23 177.101 177.615 -0.514 1
1 246 . 47 1 1 A 23 23 VAL CA C 23 65.237 65.118 0.119 1
1 247 . 47 1 1 A 23 23 VAL CB C 23 31.780 31.575 0.205 1
1 250 . 47 1 1 A 23 23 VAL N N 23 118.775 116.433 2.342 1
1 251 . 47 1 1 A 24 24 ILE H H 24 6.761 8.155 -1.394 1
1 252 . 47 1 1 A 24 24 ILE HA H 24 3.196 3.625 -0.429 1
1 262 . 47 1 1 A 24 24 ILE C C 24 177.287 178.016 -0.729 1
1 263 . 47 1 1 A 24 24 ILE CA C 24 63.404 64.557 -1.153 1
1 264 . 47 1 1 A 24 24 ILE CB C 24 36.294 36.649 -0.355 1
1 268 . 47 1 1 A 24 24 ILE N N 24 119.036 121.153 -2.117 1
1 269 . 47 1 1 A 25 25 LYS H H 25 8.032 7.930 0.102 1
1 270 . 47 1 1 A 25 25 LYS HA H 25 3.809 3.584 0.225 1
1 279 . 47 1 1 A 25 25 LYS C C 25 179.450 177.604 1.846 1
1 280 . 47 1 1 A 25 25 LYS CA C 25 59.621 58.916 0.705 1
1 281 . 47 1 1 A 25 25 LYS CB C 25 32.259 31.799 0.460 1
1 285 . 47 1 1 A 25 25 LYS N N 25 118.368 121.375 -3.007 1
1 286 . 47 1 1 A 26 26 GLU H H 26 7.845 7.792 0.053 1
1 287 . 47 1 1 A 26 26 GLU HA H 26 4.021 4.209 -0.188 1
1 292 . 47 1 1 A 26 26 GLU C C 26 179.191 178.885 0.306 1
1 293 . 47 1 1 A 26 26 GLU CA C 26 59.530 58.741 0.789 1
1 294 . 47 1 1 A 26 26 GLU CB C 26 29.449 29.456 -0.007 1
1 296 . 47 1 1 A 26 26 GLU N N 26 120.522 119.012 1.510 1
1 297 . 47 1 1 A 27 27 LEU H H 27 8.165 7.976 0.189 1
1 298 . 47 1 1 A 27 27 LEU HA H 27 4.163 4.129 0.034 1
1 308 . 47 1 1 A 27 27 LEU C C 27 177.256 178.213 -0.957 1
1 309 . 47 1 1 A 27 27 LEU CA C 27 58.049 57.420 0.629 1
1 310 . 47 1 1 A 27 27 LEU CB C 27 41.365 41.674 -0.309 1
1 314 . 47 1 1 A 27 27 LEU N N 27 120.879 120.787 0.092 1
1 315 . 47 1 1 A 28 28 LYS H H 28 8.902 8.147 0.755 1
1 316 . 47 1 1 A 28 28 LYS HA H 28 4.199 4.665 -0.466 1
1 317 . 47 1 1 A 28 28 LYS C C 28 179.707 178.835 0.872 1
1 318 . 47 1 1 A 28 28 LYS CA C 28 60.097 59.872 0.225 1
1 319 . 47 1 1 A 28 28 LYS CB C 28 33.420 32.086 1.334 1
1 320 . 47 1 1 A 28 28 LYS N N 28 120.050 120.014 0.036 1
1 321 . 47 1 1 A 29 29 THR H H 29 8.294 7.883 0.411 1
1 322 . 47 1 1 A 29 29 THR HA H 29 3.892 3.970 -0.078 1
1 327 . 47 1 1 A 29 29 THR C C 29 175.711 176.400 -0.689 1
1 328 . 47 1 1 A 29 29 THR CA C 29 66.846 66.543 0.303 1
1 329 . 47 1 1 A 29 29 THR CB C 29 68.794 68.840 -0.046 1
1 331 . 47 1 1 A 29 29 THR N N 29 115.933 116.908 -0.975 1
1 332 . 47 1 1 A 30 30 ALA H H 30 8.244 8.606 -0.362 1
1 333 . 47 1 1 A 30 30 ALA HA H 30 4.241 4.315 -0.074 1
1 337 . 47 1 1 A 30 30 ALA C C 30 179.128 179.555 -0.427 1
1 338 . 47 1 1 A 30 30 ALA CA C 30 55.714 55.790 -0.076 1
1 339 . 47 1 1 A 30 30 ALA CB C 30 18.955 18.015 0.940 1
1 340 . 47 1 1 A 30 30 ALA N N 30 124.617 123.304 1.313 1
1 341 . 47 1 1 A 31 31 ALA H H 31 8.968 8.616 0.352 1
1 342 . 47 1 1 A 31 31 ALA HA H 31 3.890 4.138 -0.248 1
1 346 . 47 1 1 A 31 31 ALA C C 31 180.352 179.505 0.847 1
1 347 . 47 1 1 A 31 31 ALA CA C 31 55.454 55.279 0.175 1
1 348 . 47 1 1 A 31 31 ALA CB C 31 17.124 18.147 -1.023 1
1 349 . 47 1 1 A 31 31 ALA N N 31 119.327 120.570 -1.243 1
1 350 . 47 1 1 A 32 32 SER H H 32 7.995 7.909 0.086 1
1 351 . 47 1 1 A 32 32 SER HA H 32 4.238 4.168 0.070 1
1 354 . 47 1 1 A 32 32 SER C C 32 175.612 176.432 -0.820 1
1 355 . 47 1 1 A 32 32 SER CA C 32 61.203 61.395 -0.192 1
1 356 . 47 1 1 A 32 32 SER CB C 32 63.406 62.956 0.450 1
1 357 . 47 1 1 A 32 32 SER N N 32 111.962 113.583 -1.621 1
1 358 . 47 1 1 A 33 33 GLN H H 33 8.333 7.896 0.437 1
1 359 . 47 1 1 A 33 33 GLN HA H 33 3.992 4.279 -0.287 1
1 366 . 47 1 1 A 33 33 GLN C C 33 177.486 177.259 0.227 1
1 367 . 47 1 1 A 33 33 GLN CA C 33 58.277 57.880 0.397 1
1 368 . 47 1 1 A 33 33 GLN CB C 33 29.140 29.998 -0.858 1
1 370 . 47 1 1 A 33 33 GLN N N 33 119.527 119.451 0.076 1
1 372 . 47 1 1 A 34 34 TYR H H 34 8.587 8.302 0.285 1
1 373 . 47 1 1 A 34 34 TYR HA H 34 4.792 4.625 0.167 1
1 380 . 47 1 1 A 34 34 TYR C C 34 176.499 176.643 -0.144 1
1 381 . 47 1 1 A 34 34 TYR CA C 34 57.711 58.925 -1.214 1
1 382 . 47 1 1 A 34 34 TYR CB C 34 39.561 39.519 0.042 1
1 387 . 47 1 1 A 34 34 TYR N N 34 114.610 115.198 -0.588 1
1 388 . 47 1 1 A 35 35 GLY H H 35 7.346 8.374 -1.028 1
1 389 . 47 1 1 A 35 35 GLY HA2 H 35 4.785 4.120 0.665 1
1 390 . 47 1 1 A 35 35 GLY HA3 H 35 4.007 4.121 -0.114 1
1 391 . 47 1 1 A 35 35 GLY C C 35 175.796 173.662 2.134 1
1 392 . 47 1 1 A 35 35 GLY CA C 35 44.355 45.201 -0.846 1
1 393 . 47 1 1 A 35 35 GLY N N 35 108.501 107.282 1.219 1
1 394 . 47 1 1 A 36 36 ALA H H 36 9.363 8.307 1.056 1
1 395 . 47 1 1 A 36 36 ALA HA H 36 4.217 4.541 -0.324 1
1 399 . 47 1 1 A 36 36 ALA C C 36 178.039 178.235 -0.196 1
1 400 . 47 1 1 A 36 36 ALA CA C 36 56.114 51.622 4.492 1
1 401 . 47 1 1 A 36 36 ALA CB C 36 19.179 20.196 -1.017 1
1 402 . 47 1 1 A 36 36 ALA N N 36 125.811 125.477 0.334 1
1 403 . 47 1 1 A 37 37 THR H H 37 8.070 8.850 -0.780 1
1 404 . 47 1 1 A 37 37 THR HA H 37 4.570 4.387 0.183 1
1 409 . 47 1 1 A 37 37 THR C C 37 173.685 174.089 -0.404 1
1 410 . 47 1 1 A 37 37 THR CA C 37 59.822 63.876 -4.054 1
1 411 . 47 1 1 A 37 37 THR CB C 37 68.267 66.986 1.281 1
1 413 . 47 1 1 A 37 37 THR N N 37 129.410 115.747 13.663 1
1 414 . 47 1 1 A 38 38 ALA H H 38 6.853 7.825 -0.972 1
1 415 . 47 1 1 A 38 38 ALA HA H 38 4.601 4.544 0.057 1
1 419 . 47 1 1 A 38 38 ALA CA C 38 50.758 50.661 0.097 1
1 420 . 47 1 1 A 38 38 ALA CB C 38 18.325 19.763 -1.438 1
1 421 . 47 1 1 A 38 38 ALA N N 38 124.674 125.185 -0.511 1
1 422 . 47 1 1 A 40 40 TYR HA H 40 4.032 4.059 -0.027 1
1 429 . 47 1 1 A 40 40 TYR C C 40 176.456 177.672 -1.216 1
1 430 . 47 1 1 A 40 40 TYR CA C 40 61.010 61.623 -0.613 1
1 431 . 47 1 1 A 40 40 TYR CB C 40 39.286 38.602 0.684 1
1 436 . 47 1 1 A 41 41 THR H H 41 6.874 7.892 -1.018 1
1 437 . 47 1 1 A 41 41 THR HA H 41 3.616 3.736 -0.120 1
1 442 . 47 1 1 A 41 41 THR C C 41 176.930 176.559 0.371 1
1 443 . 47 1 1 A 41 41 THR CA C 41 65.557 65.586 -0.029 1
1 444 . 47 1 1 A 41 41 THR CB C 41 68.228 69.085 -0.857 1
1 446 . 47 1 1 A 41 41 THR N N 41 115.143 113.914 1.229 1
1 447 . 47 1 1 A 42 42 LEU H H 42 8.623 7.865 0.758 1
1 448 . 47 1 1 A 42 42 LEU HA H 42 3.708 4.012 -0.304 1
1 458 . 47 1 1 A 42 42 LEU C C 42 178.206 178.964 -0.758 1
1 459 . 47 1 1 A 42 42 LEU CA C 42 57.417 57.828 -0.411 1
1 460 . 47 1 1 A 42 42 LEU CB C 42 41.342 41.169 0.173 1
1 464 . 47 1 1 A 42 42 LEU N N 42 120.418 118.297 2.121 1
1 465 . 47 1 1 A 43 43 ALA H H 43 7.735 7.716 0.019 1
1 466 . 47 1 1 A 43 43 ALA HA H 43 4.020 3.970 0.050 1
1 470 . 47 1 1 A 43 43 ALA C C 43 180.826 180.548 0.278 1
1 471 . 47 1 1 A 43 43 ALA CA C 43 54.925 55.112 -0.187 1
1 472 . 47 1 1 A 43 43 ALA CB C 43 17.506 18.214 -0.708 1
1 473 . 47 1 1 A 43 43 ALA N N 43 120.203 121.910 -1.707 1
1 474 . 47 1 1 A 44 44 ILE H H 44 7.149 7.326 -0.177 1
1 475 . 47 1 1 A 44 44 ILE HA H 44 3.603 3.622 -0.019 1
1 485 . 47 1 1 A 44 44 ILE C C 44 178.594 178.116 0.478 1
1 486 . 47 1 1 A 44 44 ILE CA C 44 64.782 64.659 0.123 1
1 487 . 47 1 1 A 44 44 ILE CB C 44 37.472 37.261 0.211 1
1 491 . 47 1 1 A 44 44 ILE N N 44 118.881 119.711 -0.830 1
1 492 . 47 1 1 A 45 45 VAL H H 45 7.968 8.013 -0.045 1
1 493 . 47 1 1 A 45 45 VAL HA H 45 2.925 3.460 -0.535 1
1 501 . 47 1 1 A 45 45 VAL C C 45 177.023 177.739 -0.716 1
1 502 . 47 1 1 A 45 45 VAL CA C 45 67.081 66.558 0.523 1
1 503 . 47 1 1 A 45 45 VAL CB C 45 30.854 31.216 -0.362 1
1 506 . 47 1 1 A 45 45 VAL N N 45 120.764 120.454 0.310 1
1 507 . 47 1 1 A 46 46 GLU H H 46 8.399 8.078 0.321 1
1 508 . 47 1 1 A 46 46 GLU HA H 46 3.848 3.991 -0.143 1
1 513 . 47 1 1 A 46 46 GLU C C 46 178.656 179.268 -0.612 1
1 514 . 47 1 1 A 46 46 GLU CA C 46 59.491 59.238 0.253 1
1 515 . 47 1 1 A 46 46 GLU CB C 46 28.991 28.591 0.400 1
1 517 . 47 1 1 A 46 46 GLU N N 46 116.599 120.106 -3.507 1
1 518 . 47 1 1 A 47 47 SER H H 47 7.273 7.813 -0.540 1
1 519 . 47 1 1 A 47 47 SER HA H 47 4.287 4.227 0.060 1
1 521 . 47 1 1 A 47 47 SER CA C 47 61.047 62.557 -1.510 1
1 522 . 47 1 1 A 47 47 SER CB C 47 63.016 63.055 -0.039 1
1 523 . 47 1 1 A 47 47 SER N N 47 113.609 118.356 -4.747 1
1 524 . 47 1 1 A 48 48 VAL H H 48 8.006 7.932 0.074 1
1 525 . 47 1 1 A 48 48 VAL HA H 48 3.556 3.991 -0.435 1
1 533 . 47 1 1 A 48 48 VAL C C 48 177.257 177.287 -0.030 1
1 534 . 47 1 1 A 48 48 VAL CA C 48 65.025 64.635 0.390 1
1 535 . 47 1 1 A 48 48 VAL CB C 48 31.841 31.263 0.578 1
1 538 . 47 1 1 A 48 48 VAL N N 48 122.327 119.438 2.889 1
1 539 . 47 1 1 A 49 49 ALA H H 49 8.369 7.503 0.866 1
1 540 . 47 1 1 A 49 49 ALA HA H 49 4.115 4.352 -0.237 1
1 544 . 47 1 1 A 49 49 ALA C C 49 177.307 177.653 -0.346 1
1 545 . 47 1 1 A 49 49 ALA CA C 49 53.253 52.819 0.434 1
1 546 . 47 1 1 A 49 49 ALA CB C 49 20.131 19.078 1.053 1
1 547 . 47 1 1 A 49 49 ALA N N 49 118.050 123.828 -5.778 1
1 548 . 47 1 1 A 50 50 ASP H H 50 7.052 7.909 -0.857 1
1 549 . 47 1 1 A 50 50 ASP HA H 50 4.788 4.812 -0.024 1
1 552 . 47 1 1 A 50 50 ASP C C 50 175.481 176.153 -0.672 1
1 553 . 47 1 1 A 50 50 ASP CA C 50 53.681 53.431 0.250 1
1 554 . 47 1 1 A 50 50 ASP CB C 50 39.333 41.271 -1.938 1
1 555 . 47 1 1 A 50 50 ASP N N 50 116.997 116.928 0.069 1
1 556 . 47 1 1 A 51 51 ASN H H 51 8.535 8.044 0.491 1
1 557 . 47 1 1 A 51 51 ASN HA H 51 4.628 5.339 -0.711 1
1 562 . 47 1 1 A 51 51 ASN C C 51 174.077 175.502 -1.425 1
1 563 . 47 1 1 A 51 51 ASN CA C 51 52.315 52.214 0.101 1
1 564 . 47 1 1 A 51 51 ASN CB C 51 41.928 40.905 1.023 1
1 565 . 47 1 1 A 51 51 ASN N N 51 118.626 118.011 0.615 1
1 567 . 47 1 1 A 52 52 TRP H H 52 8.555 8.912 -0.357 1
1 574 . 47 1 1 A 52 52 TRP C C 52 173.269 176.456 -3.187 1
1 575 . 47 1 1 A 52 52 TRP CA C 52 55.031 56.748 -1.717 1
1 576 . 47 1 1 A 52 52 TRP CB C 52 26.801 29.119 -2.318 1
1 582 . 47 1 1 A 52 52 TRP N N 52 120.693 122.296 -1.603 1
1 584 . 47 1 1 A 53 53 LEU H H 53 7.847 8.778 -0.931 1
1 585 . 47 1 1 A 53 53 LEU HA H 53 4.859 5.351 -0.492 1
1 595 . 47 1 1 A 53 53 LEU C C 53 177.397 175.094 2.303 1
1 596 . 47 1 1 A 53 53 LEU CA C 53 53.619 53.227 0.392 1
1 597 . 47 1 1 A 53 53 LEU CB C 53 41.812 46.195 -4.383 1
1 601 . 47 1 1 A 53 53 LEU N N 53 124.741 120.883 3.858 1
1 602 . 47 1 1 A 54 54 THR H H 54 8.850 8.579 0.271 1
1 603 . 47 1 1 A 54 54 THR HA H 54 4.598 4.566 0.032 1
1 608 . 47 1 1 A 54 54 THR CA C 54 60.531 59.919 0.612 1
1 609 . 47 1 1 A 54 54 THR CB C 54 67.183 68.964 -1.781 1
1 611 . 47 1 1 A 54 54 THR N N 54 113.407 114.778 -1.371 1
1 612 . 47 1 1 A 55 55 PRO HA H 55 4.511 4.347 0.164 1
1 619 . 47 1 1 A 55 55 PRO C C 55 179.383 177.716 1.667 1
1 620 . 47 1 1 A 55 55 PRO CA C 55 67.159 65.546 1.613 1
1 621 . 47 1 1 A 55 55 PRO CB C 55 32.095 31.882 0.213 1
1 622 . 47 1 1 A 56 56 THR H H 56 8.575 7.744 0.831 1
1 623 . 47 1 1 A 56 56 THR HA H 56 4.229 4.167 0.062 1
1 628 . 47 1 1 A 56 56 THR C C 56 176.668 176.595 0.073 1
1 629 . 47 1 1 A 56 56 THR CA C 56 66.943 65.042 1.901 1
1 630 . 47 1 1 A 56 56 THR CB C 56 68.129 68.856 -0.727 1
1 632 . 47 1 1 A 56 56 THR N N 56 114.855 111.575 3.280 1
1 633 . 47 1 1 A 57 57 ASP H H 57 8.730 8.026 0.704 1
1 634 . 47 1 1 A 57 57 ASP HA H 57 4.425 4.434 -0.009 1
1 637 . 47 1 1 A 57 57 ASP C C 57 178.351 179.372 -1.021 1
1 638 . 47 1 1 A 57 57 ASP CA C 57 57.963 57.242 0.721 1
1 639 . 47 1 1 A 57 57 ASP CB C 57 40.134 40.261 -0.127 1
1 640 . 47 1 1 A 57 57 ASP N N 57 126.239 121.343 4.896 1
1 641 . 47 1 1 A 58 58 TRP H H 58 8.244 8.259 -0.015 1
1 642 . 47 1 1 A 58 58 TRP HA H 58 4.030 4.468 -0.438 1
1 650 . 47 1 1 A 58 58 TRP C C 58 177.432 179.354 -1.922 1
1 651 . 47 1 1 A 58 58 TRP CA C 58 62.731 60.058 2.673 1
1 652 . 47 1 1 A 58 58 TRP CB C 58 29.122 29.170 -0.048 1
1 657 . 47 1 1 A 58 58 TRP N N 58 119.241 120.332 -1.091 1
1 659 . 47 1 1 A 59 59 ASN H H 59 8.098 8.537 -0.439 1
1 660 . 47 1 1 A 59 59 ASN HA H 59 4.424 4.432 -0.008 1
1 663 . 47 1 1 A 59 59 ASN C C 59 176.952 178.031 -1.079 1
1 664 . 47 1 1 A 59 59 ASN CA C 59 58.135 56.435 1.700 1
1 665 . 47 1 1 A 59 59 ASN CB C 59 40.168 38.086 2.082 1
1 666 . 47 1 1 A 59 59 ASN N N 59 115.747 117.404 -1.657 1
1 667 . 47 1 1 A 60 60 THR H H 60 8.712 7.880 0.832 1
1 668 . 47 1 1 A 60 60 THR HA H 60 3.717 4.088 -0.371 1
1 673 . 47 1 1 A 60 60 THR C C 60 176.044 176.706 -0.662 1
1 674 . 47 1 1 A 60 60 THR CA C 60 66.576 66.991 -0.415 1
1 675 . 47 1 1 A 60 60 THR CB C 60 69.251 68.052 1.199 1
1 677 . 47 1 1 A 60 60 THR N N 60 114.896 118.367 -3.471 1
1 678 . 47 1 1 A 61 61 LEU H H 61 8.485 8.516 -0.031 1
1 679 . 47 1 1 A 61 61 LEU HA H 61 3.391 4.073 -0.682 1
1 689 . 47 1 1 A 61 61 LEU C C 61 177.433 178.683 -1.250 1
1 690 . 47 1 1 A 61 61 LEU CA C 61 58.354 58.650 -0.296 1
1 691 . 47 1 1 A 61 61 LEU CB C 61 41.761 42.337 -0.576 1
1 695 . 47 1 1 A 61 61 LEU N N 61 123.433 122.290 1.143 1
1 696 . 47 1 1 A 62 62 VAL H H 62 8.073 8.641 -0.568 1
1 697 . 47 1 1 A 62 62 VAL HA H 62 3.207 3.933 -0.726 1
1 705 . 47 1 1 A 62 62 VAL C C 62 177.585 177.861 -0.276 1
1 706 . 47 1 1 A 62 62 VAL CA C 62 67.345 65.218 2.127 1
1 707 . 47 1 1 A 62 62 VAL CB C 62 30.905 30.570 0.335 1
1 710 . 47 1 1 A 62 62 VAL N N 62 116.018 118.575 -2.557 1
1 711 . 47 1 1 A 63 63 ARG H H 63 7.765 8.037 -0.272 1
1 712 . 47 1 1 A 63 63 ARG HA H 63 3.602 3.909 -0.307 1
1 719 . 47 1 1 A 63 63 ARG C C 63 177.818 178.866 -1.048 1
1 720 . 47 1 1 A 63 63 ARG CA C 63 58.049 59.718 -1.669 1
1 721 . 47 1 1 A 63 63 ARG CB C 63 29.955 30.096 -0.141 1
1 724 . 47 1 1 A 63 63 ARG N N 63 116.700 121.227 -4.527 1
1 725 . 47 1 1 A 64 64 ALA H H 64 7.574 7.917 -0.343 1
1 726 . 47 1 1 A 64 64 ALA HA H 64 4.158 4.388 -0.230 1
1 730 . 47 1 1 A 64 64 ALA C C 64 179.886 179.579 0.307 1
1 731 . 47 1 1 A 64 64 ALA CA C 64 54.007 54.257 -0.250 1
1 732 . 47 1 1 A 64 64 ALA CB C 64 19.147 19.289 -0.142 1
1 733 . 47 1 1 A 64 64 ALA N N 64 117.555 120.350 -2.795 1
1 734 . 47 1 1 A 65 65 VAL H H 65 7.554 7.826 -0.272 1
1 735 . 47 1 1 A 65 65 VAL HA H 65 4.253 3.890 0.363 1
1 743 . 47 1 1 A 65 65 VAL C C 65 174.180 175.580 -1.400 1
1 744 . 47 1 1 A 65 65 VAL CA C 65 62.683 65.144 -2.461 1
1 745 . 47 1 1 A 65 65 VAL CB C 65 33.458 31.515 1.943 1
1 748 . 47 1 1 A 65 65 VAL N N 65 110.013 115.159 -5.146 1
1 749 . 47 1 1 A 66 66 LEU H H 66 7.792 7.600 0.192 1
1 750 . 47 1 1 A 66 66 LEU HA H 66 4.790 4.765 0.025 1
1 760 . 47 1 1 A 66 66 LEU C C 66 177.537 174.393 3.144 1
1 761 . 47 1 1 A 66 66 LEU CA C 66 52.823 53.596 -0.773 1
1 762 . 47 1 1 A 66 66 LEU CB C 66 44.071 45.752 -1.681 1
1 766 . 47 1 1 A 66 66 LEU N N 66 118.967 122.053 -3.086 1
1 767 . 47 1 1 A 67 67 SER H H 67 9.208 8.510 0.698 1
1 768 . 47 1 1 A 67 67 SER HA H 67 4.414 5.345 -0.931 1
1 771 . 47 1 1 A 67 67 SER CA C 67 57.943 56.776 1.167 1
1 772 . 47 1 1 A 67 67 SER CB C 67 64.743 66.214 -1.471 1
1 773 . 47 1 1 A 67 67 SER N N 67 116.378 116.066 0.312 1
1 774 . 47 1 1 A 69 69 GLY HA2 H 69 3.916 3.790 0.126 1
1 775 . 47 1 1 A 69 69 GLY HA3 H 69 3.867 3.813 0.054 1
1 776 . 47 1 1 A 69 69 GLY C C 69 176.783 175.499 1.284 1
1 777 . 47 1 1 A 69 69 GLY CA C 69 46.977 46.133 0.844 1
1 778 . 47 1 1 A 70 70 ASP H H 70 7.674 8.128 -0.454 1
1 779 . 47 1 1 A 70 70 ASP HA H 70 4.511 3.625 0.886 1
1 782 . 47 1 1 A 70 70 ASP C C 70 178.096 178.195 -0.099 1
1 783 . 47 1 1 A 70 70 ASP CA C 70 57.262 56.455 0.807 1
1 784 . 47 1 1 A 70 70 ASP CB C 70 40.594 39.675 0.919 1
1 785 . 47 1 1 A 70 70 ASP N N 70 123.930 121.859 2.071 1
1 786 . 47 1 1 A 71 71 HIS H H 71 8.729 8.005 0.724 1
1 787 . 47 1 1 A 71 71 HIS HA H 71 4.235 4.087 0.148 1
1 790 . 47 1 1 A 71 71 HIS C C 71 176.769 177.662 -0.893 1
1 791 . 47 1 1 A 71 71 HIS CA C 71 60.041 60.107 -0.066 1
1 792 . 47 1 1 A 71 71 HIS CB C 71 30.682 30.625 0.057 1
1 793 . 47 1 1 A 71 71 HIS N N 71 121.003 116.851 4.152 1
1 794 . 47 1 1 A 72 72 LEU H H 72 7.620 7.963 -0.343 1
1 795 . 47 1 1 A 72 72 LEU HA H 72 3.769 3.933 -0.164 1
1 805 . 47 1 1 A 72 72 LEU C C 72 180.275 179.174 1.101 1
1 806 . 47 1 1 A 72 72 LEU CA C 72 58.192 58.018 0.174 1
1 807 . 47 1 1 A 72 72 LEU CB C 72 41.381 41.267 0.114 1
1 811 . 47 1 1 A 72 72 LEU N N 72 118.569 118.292 0.277 1
1 812 . 47 1 1 A 73 73 LEU H H 73 7.542 7.571 -0.029 1
1 813 . 47 1 1 A 73 73 LEU HA H 73 4.107 4.143 -0.036 1
1 823 . 47 1 1 A 73 73 LEU C C 73 179.436 179.097 0.339 1
1 824 . 47 1 1 A 73 73 LEU CA C 73 58.026 57.397 0.629 1
1 825 . 47 1 1 A 73 73 LEU CB C 73 41.638 42.030 -0.392 1
1 829 . 47 1 1 A 73 73 LEU N N 73 121.418 120.700 0.718 1
1 830 . 47 1 1 A 74 74 TRP H H 74 8.786 8.113 0.673 1
1 831 . 47 1 1 A 74 74 TRP HA H 74 3.589 5.372 -1.783 1
1 840 . 47 1 1 A 74 74 TRP C C 74 176.816 178.670 -1.854 1
1 841 . 47 1 1 A 74 74 TRP CA C 74 63.046 60.001 3.045 1
1 842 . 47 1 1 A 74 74 TRP CB C 74 28.065 29.064 -0.999 1
1 848 . 47 1 1 A 74 74 TRP N N 74 121.111 118.120 2.991 1
1 850 . 47 1 1 A 75 75 LYS H H 75 8.939 7.569 1.370 1
1 851 . 47 1 1 A 75 75 LYS HA H 75 3.055 4.057 -1.002 1
1 860 . 47 1 1 A 75 75 LYS C C 75 177.967 179.544 -1.577 1
1 861 . 47 1 1 A 75 75 LYS CA C 75 60.029 58.672 1.357 1
1 862 . 47 1 1 A 75 75 LYS CB C 75 32.533 32.730 -0.197 1
1 866 . 47 1 1 A 75 75 LYS N N 75 119.783 118.557 1.226 1
1 867 . 47 1 1 A 76 76 SER H H 76 7.832 8.101 -0.269 1
1 868 . 47 1 1 A 76 76 SER HA H 76 4.040 4.384 -0.344 1
1 871 . 47 1 1 A 76 76 SER C C 76 177.816 177.289 0.527 1
1 872 . 47 1 1 A 76 76 SER CA C 76 62.105 61.501 0.604 1
1 873 . 47 1 1 A 76 76 SER CB C 76 62.679 62.443 0.236 1
1 874 . 47 1 1 A 76 76 SER N N 76 113.395 114.534 -1.139 1
1 875 . 47 1 1 A 77 77 GLU H H 77 7.590 7.727 -0.137 1
1 876 . 47 1 1 A 77 77 GLU HA H 77 4.042 4.266 -0.224 1
1 881 . 47 1 1 A 77 77 GLU C C 77 177.809 178.521 -0.712 1
1 882 . 47 1 1 A 77 77 GLU CA C 77 58.270 58.703 -0.433 1
1 883 . 47 1 1 A 77 77 GLU CB C 77 29.208 29.389 -0.181 1
1 885 . 47 1 1 A 77 77 GLU N N 77 121.574 122.351 -0.777 1
1 886 . 47 1 1 A 78 78 PHE H H 78 9.081 7.837 1.244 1
1 887 . 47 1 1 A 78 78 PHE HA H 78 3.778 4.128 -0.350 1
1 895 . 47 1 1 A 78 78 PHE C C 78 178.114 177.290 0.824 1
1 896 . 47 1 1 A 78 78 PHE CA C 78 60.629 61.380 -0.751 1
1 897 . 47 1 1 A 78 78 PHE CB C 78 38.295 38.735 -0.440 1
1 902 . 47 1 1 A 78 78 PHE N N 78 122.682 122.488 0.194 1
1 903 . 47 1 1 A 79 79 PHE H H 79 8.890 7.998 0.892 1
1 904 . 47 1 1 A 79 79 PHE HA H 79 3.800 4.049 -0.249 1
1 912 . 47 1 1 A 79 79 PHE C C 79 178.354 178.186 0.168 1
1 913 . 47 1 1 A 79 79 PHE CA C 79 60.704 61.916 -1.212 1
1 914 . 47 1 1 A 79 79 PHE CB C 79 37.184 38.421 -1.237 1
1 920 . 47 1 1 A 79 79 PHE N N 79 121.056 118.240 2.816 1
1 921 . 47 1 1 A 80 80 GLU H H 80 7.793 8.349 -0.556 1
1 922 . 47 1 1 A 80 80 GLU HA H 80 4.082 4.166 -0.084 1
1 927 . 47 1 1 A 80 80 GLU C C 80 179.068 179.150 -0.082 1
1 928 . 47 1 1 A 80 80 GLU CA C 80 59.735 59.480 0.255 1
1 929 . 47 1 1 A 80 80 GLU CB C 80 28.722 29.677 -0.955 1
1 931 . 47 1 1 A 80 80 GLU N N 80 120.312 119.058 1.254 1
1 932 . 47 1 1 A 81 81 ASN H H 81 8.624 8.494 0.130 1
1 933 . 47 1 1 A 81 81 ASN HA H 81 4.521 4.483 0.038 1
1 938 . 47 1 1 A 81 81 ASN C C 81 179.262 178.098 1.164 1
1 939 . 47 1 1 A 81 81 ASN CA C 81 55.504 56.240 -0.736 1
1 940 . 47 1 1 A 81 81 ASN CB C 81 37.517 37.995 -0.478 1
1 941 . 47 1 1 A 81 81 ASN N N 81 119.338 118.675 0.663 1
1 943 . 47 1 1 A 82 82 CYS H H 82 8.554 7.898 0.656 1
1 944 . 47 1 1 A 82 82 CYS HA H 82 3.792 3.926 -0.134 1
1 947 . 47 1 1 A 82 82 CYS C C 82 176.478 177.075 -0.597 1
1 948 . 47 1 1 A 82 82 CYS CA C 82 65.232 63.328 1.904 1
1 949 . 47 1 1 A 82 82 CYS CB C 82 26.762 26.412 0.350 1
1 950 . 47 1 1 A 82 82 CYS N N 82 120.576 117.586 2.990 1
1 951 . 47 1 1 A 83 83 ARG H H 83 8.522 7.894 0.628 1
1 952 . 47 1 1 A 83 83 ARG HA H 83 3.932 4.120 -0.188 1
1 960 . 47 1 1 A 83 83 ARG C C 83 179.138 178.790 0.348 1
1 961 . 47 1 1 A 83 83 ARG CA C 83 60.443 59.014 1.429 1
1 962 . 47 1 1 A 83 83 ARG CB C 83 29.550 29.831 -0.281 1
1 965 . 47 1 1 A 83 83 ARG N N 83 123.035 119.608 3.427 1
1 967 . 47 1 1 A 84 84 ASP H H 84 7.791 8.039 -0.248 1
1 968 . 47 1 1 A 84 84 ASP HA H 84 4.353 4.384 -0.031 1
1 971 . 47 1 1 A 84 84 ASP C C 84 178.649 178.735 -0.086 1
1 972 . 47 1 1 A 84 84 ASP CA C 84 57.767 57.575 0.192 1
1 973 . 47 1 1 A 84 84 ASP CB C 84 41.305 41.607 -0.302 1
1 974 . 47 1 1 A 84 84 ASP N N 84 120.332 119.593 0.739 1
1 975 . 47 1 1 A 85 85 THR H H 85 8.370 7.995 0.375 1
1 976 . 47 1 1 A 85 85 THR HA H 85 3.730 3.825 -0.095 1
1 981 . 47 1 1 A 85 85 THR C C 85 175.198 176.450 -1.252 1
1 982 . 47 1 1 A 85 85 THR CA C 85 66.830 66.185 0.645 1
1 983 . 47 1 1 A 85 85 THR CB C 85 68.533 68.402 0.131 1
1 985 . 47 1 1 A 85 85 THR N N 85 117.360 115.787 1.573 1
1 986 . 47 1 1 A 86 86 ALA H H 86 8.845 8.486 0.359 1
1 987 . 47 1 1 A 86 86 ALA HA H 86 3.991 4.139 -0.148 1
1 991 . 47 1 1 A 86 86 ALA C C 86 179.980 179.669 0.311 1
1 992 . 47 1 1 A 86 86 ALA CA C 86 55.769 55.679 0.090 1
1 993 . 47 1 1 A 86 86 ALA CB C 86 17.881 18.354 -0.473 1
1 994 . 47 1 1 A 86 86 ALA N N 86 123.613 123.094 0.519 1
1 995 . 47 1 1 A 87 87 LYS H H 87 7.686 8.300 -0.614 1
1 996 . 47 1 1 A 87 87 LYS HA H 87 4.099 4.068 0.031 1
1 1005 . 47 1 1 A 87 87 LYS C C 87 179.592 178.416 1.176 1
1 1006 . 47 1 1 A 87 87 LYS CA C 87 59.708 59.105 0.603 1
1 1007 . 47 1 1 A 87 87 LYS CB C 87 32.054 31.860 0.194 1
1 1011 . 47 1 1 A 87 87 LYS N N 87 119.623 116.664 2.959 1
1 1012 . 47 1 1 A 88 88 ARG H H 88 7.683 7.727 -0.044 1
1 1013 . 47 1 1 A 88 88 ARG HA H 88 4.051 4.177 -0.126 1
1 1020 . 47 1 1 A 88 88 ARG C C 88 180.053 178.575 1.478 1
1 1021 . 47 1 1 A 88 88 ARG CA C 88 59.558 58.580 0.978 1
1 1022 . 47 1 1 A 88 88 ARG CB C 88 29.684 29.787 -0.103 1
1 1025 . 47 1 1 A 88 88 ARG N N 88 120.788 119.258 1.530 1
1 1026 . 47 1 1 A 89 89 ASN H H 89 8.973 8.145 0.828 1
1 1027 . 47 1 1 A 89 89 ASN HA H 89 4.354 4.582 -0.228 1
1 1032 . 47 1 1 A 89 89 ASN C C 89 178.382 177.958 0.424 1
1 1033 . 47 1 1 A 89 89 ASN CA C 89 55.334 55.708 -0.374 1
1 1034 . 47 1 1 A 89 89 ASN CB C 89 37.864 38.480 -0.616 1
1 1035 . 47 1 1 A 89 89 ASN N N 89 121.012 117.817 3.195 1
1 1037 . 47 1 1 A 90 90 GLN H H 90 8.152 8.289 -0.137 1
1 1038 . 47 1 1 A 90 90 GLN HA H 90 4.020 4.006 0.014 1
1 1045 . 47 1 1 A 90 90 GLN C C 90 179.075 179.036 0.039 1
1 1046 . 47 1 1 A 90 90 GLN CA C 90 59.318 58.876 0.442 1
1 1047 . 47 1 1 A 90 90 GLN CB C 90 28.049 28.021 0.028 1
1 1049 . 47 1 1 A 90 90 GLN N N 90 122.122 118.722 3.400 1
1 1051 . 47 1 1 A 91 91 GLN H H 91 7.514 8.154 -0.640 1
1 1052 . 47 1 1 A 91 91 GLN HA H 91 4.053 4.099 -0.046 1
1 1059 . 47 1 1 A 91 91 GLN C C 91 177.081 177.418 -0.337 1
1 1060 . 47 1 1 A 91 91 GLN CA C 91 58.031 58.182 -0.151 1
1 1061 . 47 1 1 A 91 91 GLN CB C 91 28.365 27.291 1.074 1
1 1063 . 47 1 1 A 91 91 GLN N N 91 118.124 118.001 0.123 1
1 1065 . 47 1 1 A 92 92 ALA H H 92 7.704 7.819 -0.115 1
1 1066 . 47 1 1 A 92 92 ALA HA H 92 4.246 4.341 -0.095 1
1 1070 . 47 1 1 A 92 92 ALA C C 92 178.450 178.148 0.302 1
1 1071 . 47 1 1 A 92 92 ALA CA C 92 52.671 52.347 0.324 1
1 1072 . 47 1 1 A 92 92 ALA CB C 92 19.316 19.895 -0.579 1
1 1073 . 47 1 1 A 92 92 ALA N N 92 119.880 121.053 -1.173 1
1 1074 . 47 1 1 A 93 93 GLY H H 93 7.693 7.830 -0.137 1
1 1075 . 47 1 1 A 93 93 GLY HA2 H 93 3.941 3.876 0.065 1
1 1076 . 47 1 1 A 93 93 GLY HA3 H 93 3.744 3.879 -0.135 1
1 1077 . 47 1 1 A 93 93 GLY C C 93 174.344 175.042 -0.698 1
1 1078 . 47 1 1 A 93 93 GLY CA C 93 45.949 46.616 -0.667 1
1 1079 . 47 1 1 A 93 93 GLY N N 93 105.347 106.693 -1.346 1
1 1080 . 47 1 1 A 94 94 ASN H H 94 7.076 8.397 -1.321 1
1 1081 . 47 1 1 A 94 94 ASN HA H 94 4.115 4.524 -0.409 1
1 1085 . 47 1 1 A 94 94 ASN C C 94 175.410 175.815 -0.405 1
1 1086 . 47 1 1 A 94 94 ASN CA C 94 52.651 52.542 0.109 1
1 1087 . 47 1 1 A 94 94 ASN CB C 94 38.330 39.315 -0.985 1
1 1088 . 47 1 1 A 94 94 ASN N N 94 115.747 116.704 -0.957 1
1 1090 . 47 1 1 A 95 95 GLY H H 95 8.236 8.515 -0.279 1
1 1091 . 47 1 1 A 95 95 GLY HA2 H 95 3.633 3.729 -0.096 1
1 1092 . 47 1 1 A 95 95 GLY HA3 H 95 3.633 3.860 -0.227 1
1 1093 . 47 1 1 A 95 95 GLY C C 95 174.450 173.893 0.557 1
1 1094 . 47 1 1 A 95 95 GLY CA C 95 45.522 45.882 -0.360 1
1 1095 . 47 1 1 A 95 95 GLY N N 95 109.166 108.073 1.093 1
1 1096 . 47 1 1 A 96 96 TRP H H 96 7.899 7.774 0.125 1
1 1097 . 47 1 1 A 96 96 TRP HA H 96 5.241 5.068 0.173 1
1 1106 . 47 1 1 A 96 96 TRP C C 96 175.661 175.734 -0.073 1
1 1107 . 47 1 1 A 96 96 TRP CA C 96 55.090 56.600 -1.510 1
1 1108 . 47 1 1 A 96 96 TRP CB C 96 27.138 32.001 -4.863 1
1 1114 . 47 1 1 A 96 96 TRP N N 96 122.840 120.006 2.834 1
1 1116 . 47 1 1 A 97 97 ASP H H 97 7.344 9.044 -1.700 1
1 1117 . 47 1 1 A 97 97 ASP HA H 97 4.829 4.356 0.473 1
1 1120 . 47 1 1 A 97 97 ASP C C 97 175.019 176.014 -0.995 1
1 1121 . 47 1 1 A 97 97 ASP CA C 97 52.149 56.328 -4.179 1
1 1122 . 47 1 1 A 97 97 ASP CB C 97 42.697 38.618 4.079 1
1 1123 . 47 1 1 A 97 97 ASP N N 97 126.861 117.237 9.624 1
1 1124 . 47 1 1 A 98 98 PHE H H 98 8.566 8.452 0.114 1
1 1125 . 47 1 1 A 98 98 PHE HA H 98 3.727 4.214 -0.487 1
1 1133 . 47 1 1 A 98 98 PHE C C 98 177.443 177.140 0.303 1
1 1134 . 47 1 1 A 98 98 PHE CA C 98 62.471 61.095 1.376 1
1 1135 . 47 1 1 A 98 98 PHE CB C 98 39.919 39.845 0.074 1
1 1141 . 47 1 1 A 98 98 PHE N N 98 117.781 121.435 -3.654 1
1 1142 . 47 1 1 A 99 99 ASP H H 99 8.259 8.406 -0.147 1
1 1143 . 47 1 1 A 99 99 ASP HA H 99 3.960 4.574 -0.614 1
1 1146 . 47 1 1 A 99 99 ASP C C 99 178.132 178.429 -0.297 1
1 1147 . 47 1 1 A 99 99 ASP CA C 99 57.658 56.774 0.884 1
1 1148 . 47 1 1 A 99 99 ASP CB C 99 38.572 40.554 -1.982 1
1 1149 . 47 1 1 A 99 99 ASP N N 99 121.709 119.941 1.768 1
1 1150 . 47 1 1 A 100 100 MET H H 100 8.008 8.233 -0.225 1
1 1151 . 47 1 1 A 100 100 MET HA H 100 3.644 4.251 -0.607 1
1 1156 . 47 1 1 A 100 100 MET C C 100 180.008 177.167 2.841 1
1 1157 . 47 1 1 A 100 100 MET CA C 100 58.598 58.207 0.391 1
1 1158 . 47 1 1 A 100 100 MET CB C 100 33.423 33.123 0.300 1
1 1160 . 47 1 1 A 100 100 MET N N 100 119.668 118.219 1.449 1
1 1161 . 47 1 1 A 101 101 LEU H H 101 7.961 7.911 0.050 1
1 1162 . 47 1 1 A 101 101 LEU HA H 101 3.523 4.123 -0.600 1
1 1172 . 47 1 1 A 101 101 LEU C C 101 173.873 177.576 -3.703 1
1 1173 . 47 1 1 A 101 101 LEU CA C 101 58.743 55.976 2.767 1
1 1174 . 47 1 1 A 101 101 LEU CB C 101 42.632 42.422 0.210 1
1 1178 . 47 1 1 A 101 101 LEU N N 101 119.752 119.237 0.515 1
1 1179 . 47 1 1 A 102 102 THR H H 102 6.955 8.941 -1.986 1
1 1180 . 47 1 1 A 102 102 THR HA H 102 4.134 3.968 0.166 1
1 1185 . 47 1 1 A 102 102 THR C C 102 176.513 174.936 1.577 1
1 1186 . 47 1 1 A 102 102 THR CA C 102 61.125 63.300 -2.175 1
1 1187 . 47 1 1 A 102 102 THR CB C 102 71.415 66.775 4.640 1
1 1189 . 47 1 1 A 102 102 THR N N 102 124.665 121.327 3.338 1
1 1190 . 47 1 1 A 103 103 GLY H H 103 7.816 8.708 -0.892 1
1 1191 . 47 1 1 A 103 103 GLY HA2 H 103 3.824 4.025 -0.201 1
1 1192 . 47 1 1 A 103 103 GLY HA3 H 103 3.824 4.134 -0.310 1
1 1193 . 47 1 1 A 103 103 GLY C C 103 174.126 174.120 0.006 1
1 1194 . 47 1 1 A 103 103 GLY CA C 103 47.805 46.800 1.005 1
1 1195 . 47 1 1 A 103 103 GLY N N 103 114.191 113.324 0.867 1
1 1196 . 47 1 1 A 104 104 SER H H 104 8.860 7.550 1.310 1
1 1197 . 47 1 1 A 104 104 SER HA H 104 4.758 4.971 -0.213 1
1 1200 . 47 1 1 A 104 104 SER C C 104 174.591 173.161 1.430 1
1 1201 . 47 1 1 A 104 104 SER CA C 104 56.755 57.686 -0.931 1
1 1202 . 47 1 1 A 104 104 SER CB C 104 65.050 65.292 -0.242 1
1 1203 . 47 1 1 A 104 104 SER N N 104 114.771 114.919 -0.148 1
1 1204 . 47 1 1 A 105 105 GLY H H 105 8.788 8.309 0.479 1
1 1205 . 47 1 1 A 105 105 GLY HA2 H 105 3.733 4.041 -0.308 1
1 1206 . 47 1 1 A 105 105 GLY HA3 H 105 3.733 4.131 -0.398 1
1 1207 . 47 1 1 A 105 105 GLY CA C 105 47.247 45.793 1.454 1
1 1208 . 47 1 1 A 105 105 GLY N N 105 110.394 111.374 -0.980 1
1 1209 . 47 1 1 A 106 106 ASN HA H 106 4.454 4.730 -0.276 1
1 1212 . 47 1 1 A 106 106 ASN C C 106 175.180 175.799 -0.619 1
1 1213 . 47 1 1 A 106 106 ASN CA C 106 54.492 54.653 -0.161 1
1 1214 . 47 1 1 A 106 106 ASN CB C 106 37.282 39.654 -2.372 1
1 1215 . 47 1 1 A 107 107 TYR H H 107 8.241 7.203 1.038 1
1 1216 . 47 1 1 A 107 107 TYR HA H 107 4.335 4.845 -0.510 1
1 1223 . 47 1 1 A 107 107 TYR C C 107 173.954 176.185 -2.231 1
1 1224 . 47 1 1 A 107 107 TYR CA C 107 57.727 57.501 0.226 1
1 1225 . 47 1 1 A 107 107 TYR CB C 107 37.063 38.520 -1.457 1
1 1230 . 47 1 1 A 107 107 TYR N N 107 120.708 115.222 5.486 1
1 1231 . 47 1 1 A 108 108 SER H H 108 7.117 7.768 -0.651 1
1 1232 . 47 1 1 A 108 108 SER HA H 108 4.221 4.396 -0.175 1
1 1235 . 47 1 1 A 108 108 SER C C 108 174.834 174.935 -0.101 1
1 1236 . 47 1 1 A 108 108 SER CA C 108 59.859 61.200 -1.341 1
1 1237 . 47 1 1 A 108 108 SER CB C 108 63.846 63.556 0.290 1
1 1238 . 47 1 1 A 108 108 SER N N 108 113.362 117.174 -3.812 1
1 1239 . 47 1 1 A 109 109 SER H H 109 8.053 7.547 0.506 1
1 1240 . 47 1 1 A 109 109 SER HA H 109 4.560 4.481 0.079 1
1 1243 . 47 1 1 A 109 109 SER CA C 109 57.141 58.944 -1.803 1
1 1244 . 47 1 1 A 109 109 SER CB C 109 64.874 64.588 0.286 1
1 1245 . 47 1 1 A 109 109 SER N N 109 116.657 117.192 -0.535 1
1 1246 . 47 1 1 A 110 110 THR HA H 110 3.541 3.893 -0.352 1
1 1251 . 47 1 1 A 110 110 THR C C 110 175.477 175.734 -0.257 1
1 1252 . 47 1 1 A 110 110 THR CA C 110 66.443 66.013 0.430 1
1 1253 . 47 1 1 A 110 110 THR CB C 110 68.091 68.465 -0.374 1
1 1255 . 47 1 1 A 111 111 ASP H H 111 8.224 8.380 -0.156 1
1 1256 . 47 1 1 A 111 111 ASP HA H 111 4.237 4.308 -0.071 1
1 1259 . 47 1 1 A 111 111 ASP C C 111 177.520 178.509 -0.989 1
1 1260 . 47 1 1 A 111 111 ASP CA C 111 57.559 57.350 0.209 1
1 1261 . 47 1 1 A 111 111 ASP CB C 111 40.292 40.275 0.017 1
1 1262 . 47 1 1 A 111 111 ASP N N 111 119.490 120.352 -0.862 1
1 1263 . 47 1 1 A 112 112 ALA H H 112 7.431 7.933 -0.502 1
1 1264 . 47 1 1 A 112 112 ALA HA H 112 4.191 4.101 0.090 1
1 1268 . 47 1 1 A 112 112 ALA C C 112 180.646 179.329 1.317 1
1 1269 . 47 1 1 A 112 112 ALA CA C 112 54.534 54.988 -0.454 1
1 1270 . 47 1 1 A 112 112 ALA CB C 112 18.992 18.972 0.020 1
1 1271 . 47 1 1 A 112 112 ALA N N 112 119.710 122.285 -2.575 1
1 1272 . 47 1 1 A 113 113 GLN H H 113 7.576 7.204 0.372 1
1 1273 . 47 1 1 A 113 113 GLN HA H 113 3.562 4.124 -0.562 1
1 1278 . 47 1 1 A 113 113 GLN C C 113 176.756 178.133 -1.377 1
1 1279 . 47 1 1 A 113 113 GLN CA C 113 57.736 57.515 0.221 1
1 1280 . 47 1 1 A 113 113 GLN CB C 113 29.110 28.388 0.722 1
1 1281 . 47 1 1 A 113 113 GLN N N 113 117.518 117.253 0.265 1
1 1283 . 47 1 1 A 114 114 MET H H 114 8.192 7.979 0.213 1
1 1284 . 47 1 1 A 114 114 MET HA H 114 4.231 4.287 -0.056 1
1 1289 . 47 1 1 A 114 114 MET C C 114 175.648 178.451 -2.803 1
1 1290 . 47 1 1 A 114 114 MET CA C 114 57.446 58.406 -0.960 1
1 1291 . 47 1 1 A 114 114 MET CB C 114 33.570 31.921 1.649 1
1 1293 . 47 1 1 A 114 114 MET N N 114 111.509 119.904 -8.395 1
1 1294 . 47 1 1 A 115 115 GLN H H 115 6.940 7.410 -0.470 1
1 1295 . 47 1 1 A 115 115 GLN HA H 115 4.307 5.050 -0.743 1
1 1302 . 47 1 1 A 115 115 GLN C C 115 176.270 175.362 0.908 1
1 1303 . 47 1 1 A 115 115 GLN CA C 115 54.680 55.799 -1.119 1
1 1304 . 47 1 1 A 115 115 GLN CB C 115 28.233 28.865 -0.632 1
1 1306 . 47 1 1 A 115 115 GLN N N 115 114.300 115.538 -1.238 1
1 1308 . 47 1 1 A 116 116 TYR H H 116 6.677 7.611 -0.934 1
1 1309 . 47 1 1 A 116 116 TYR HA H 116 4.193 3.832 0.361 1
1 1312 . 47 1 1 A 116 116 TYR C C 116 175.268 174.265 1.003 1
1 1313 . 47 1 1 A 116 116 TYR CA C 116 54.357 58.542 -4.185 1
1 1314 . 47 1 1 A 116 116 TYR CB C 116 35.498 36.385 -0.887 1
1 1315 . 47 1 1 A 116 116 TYR N N 116 117.919 118.415 -0.496 1
1 1316 . 47 1 1 A 117 117 ASP H H 117 8.081 8.352 -0.271 1
1 1317 . 47 1 1 A 117 117 ASP HA H 117 4.665 4.848 -0.183 1
1 1320 . 47 1 1 A 117 117 ASP CA C 117 52.422 50.233 2.189 1
1 1321 . 47 1 1 A 117 117 ASP CB C 117 42.416 41.435 0.981 1
1 1322 . 47 1 1 A 117 117 ASP N N 117 120.887 126.143 -5.256 1
1 1323 . 47 1 1 A 118 118 PRO C C 118 179.180 179.107 0.073 1
1 1324 . 47 1 1 A 118 118 PRO CA C 118 65.942 65.581 0.361 1
1 1325 . 47 1 1 A 118 118 PRO CB C 118 32.197 31.545 0.652 1
1 1326 . 47 1 1 A 119 119 GLY H H 119 9.742 8.445 1.297 1
1 1327 . 47 1 1 A 119 119 GLY C C 119 175.622 175.378 0.244 1
1 1328 . 47 1 1 A 119 119 GLY CA C 119 46.785 46.560 0.225 1
1 1329 . 47 1 1 A 119 119 GLY N N 119 106.412 106.145 0.267 1
1 1330 . 47 1 1 A 120 120 LEU H H 120 6.666 7.337 -0.671 1
1 1331 . 47 1 1 A 120 120 LEU HA H 120 3.365 3.730 -0.365 1
1 1341 . 47 1 1 A 120 120 LEU C C 120 179.262 178.299 0.963 1
1 1342 . 47 1 1 A 120 120 LEU CA C 120 56.605 57.324 -0.719 1
1 1343 . 47 1 1 A 120 120 LEU CB C 120 39.262 41.385 -2.123 1
1 1347 . 47 1 1 A 120 120 LEU N N 120 126.226 122.329 3.897 1
1 1348 . 47 1 1 A 121 121 PHE H H 121 7.356 8.364 -1.008 1
1 1349 . 47 1 1 A 121 121 PHE HA H 121 4.459 3.923 0.536 1
1 1352 . 47 1 1 A 121 121 PHE C C 121 179.716 178.045 1.671 1
1 1353 . 47 1 1 A 121 121 PHE CA C 121 62.838 61.952 0.886 1
1 1354 . 47 1 1 A 121 121 PHE CB C 121 37.603 39.224 -1.621 1
1 1355 . 47 1 1 A 121 121 PHE N N 121 117.437 119.393 -1.956 1
1 1356 . 47 1 1 A 122 122 ALA H H 122 7.926 8.302 -0.376 1
1 1357 . 47 1 1 A 122 122 ALA HA H 122 4.523 3.729 0.794 1
1 1361 . 47 1 1 A 122 122 ALA C C 122 180.435 180.081 0.354 1
1 1362 . 47 1 1 A 122 122 ALA CA C 122 55.527 55.175 0.352 1
1 1363 . 47 1 1 A 122 122 ALA CB C 122 17.814 18.287 -0.473 1
1 1364 . 47 1 1 A 122 122 ALA N N 122 121.068 121.203 -0.135 1
1 1365 . 47 1 1 A 123 123 GLN H H 123 7.507 8.227 -0.720 1
1 1366 . 47 1 1 A 123 123 GLN HA H 123 4.153 3.977 0.176 1
1 1371 . 47 1 1 A 123 123 GLN C C 123 180.561 179.023 1.538 1
1 1372 . 47 1 1 A 123 123 GLN CA C 123 59.948 58.948 1.000 1
1 1373 . 47 1 1 A 123 123 GLN CB C 123 29.135 28.673 0.462 1
1 1375 . 47 1 1 A 123 123 GLN N N 123 120.324 116.610 3.714 1
1 1376 . 47 1 1 A 124 124 ILE H H 124 8.318 7.944 0.374 1
1 1377 . 47 1 1 A 124 124 ILE HA H 124 3.635 3.919 -0.284 1
1 1387 . 47 1 1 A 124 124 ILE C C 124 176.481 178.196 -1.715 1
1 1388 . 47 1 1 A 124 124 ILE CA C 124 66.432 64.274 2.158 1
1 1389 . 47 1 1 A 124 124 ILE CB C 124 39.168 37.858 1.310 1
1 1393 . 47 1 1 A 124 124 ILE N N 124 123.747 118.192 5.555 1
1 1394 . 47 1 1 A 125 125 GLN H H 125 8.474 7.794 0.680 1
1 1395 . 47 1 1 A 125 125 GLN HA H 125 4.264 4.002 0.262 1
1 1402 . 47 1 1 A 125 125 GLN C C 125 178.947 177.823 1.124 1
1 1403 . 47 1 1 A 125 125 GLN CA C 125 59.651 58.511 1.140 1
1 1404 . 47 1 1 A 125 125 GLN CB C 125 28.880 28.654 0.226 1
1 1406 . 47 1 1 A 125 125 GLN N N 125 120.368 121.084 -0.716 1
1 1408 . 47 1 1 A 126 126 ALA H H 126 8.002 8.081 -0.079 1
1 1409 . 47 1 1 A 126 126 ALA HA H 126 4.144 4.018 0.126 1
1 1413 . 47 1 1 A 126 126 ALA C C 126 179.316 179.941 -0.625 1
1 1414 . 47 1 1 A 126 126 ALA CA C 126 55.036 54.947 0.089 1
1 1415 . 47 1 1 A 126 126 ALA CB C 126 18.087 17.809 0.278 1
1 1416 . 47 1 1 A 126 126 ALA N N 126 121.661 121.190 0.471 1
1 1417 . 47 1 1 A 127 127 ALA H H 127 7.823 8.004 -0.181 1
1 1418 . 47 1 1 A 127 127 ALA HA H 127 4.162 4.064 0.098 1
1 1422 . 47 1 1 A 127 127 ALA C C 127 180.707 179.430 1.277 1
1 1423 . 47 1 1 A 127 127 ALA CA C 127 55.080 54.885 0.195 1
1 1424 . 47 1 1 A 127 127 ALA CB C 127 19.354 18.353 1.001 1
1 1425 . 47 1 1 A 127 127 ALA N N 127 119.853 119.660 0.193 1
1 1426 . 47 1 1 A 128 128 ALA H H 128 8.936 7.747 1.189 1
1 1427 . 47 1 1 A 128 128 ALA HA H 128 3.928 3.663 0.265 1
1 1431 . 47 1 1 A 128 128 ALA C C 128 181.031 179.474 1.557 1
1 1432 . 47 1 1 A 128 128 ALA CA C 128 55.502 54.695 0.807 1
1 1433 . 47 1 1 A 128 128 ALA CB C 128 16.609 17.903 -1.294 1
1 1434 . 47 1 1 A 128 128 ALA N N 128 121.355 120.318 1.037 1
1 1435 . 47 1 1 A 129 129 THR H H 129 8.543 7.581 0.962 1
1 1436 . 47 1 1 A 129 129 THR HA H 129 4.015 3.673 0.342 1
1 1441 . 47 1 1 A 129 129 THR C C 129 177.332 176.460 0.872 1
1 1442 . 47 1 1 A 129 129 THR CA C 129 65.893 65.045 0.848 1
1 1443 . 47 1 1 A 129 129 THR CB C 129 68.566 68.517 0.049 1
1 1445 . 47 1 1 A 129 129 THR N N 129 112.709 112.197 0.512 1
1 1446 . 47 1 1 A 130 130 LYS H H 130 8.126 7.381 0.745 1
1 1447 . 47 1 1 A 130 130 LYS HA H 130 4.000 4.016 -0.016 1
1 1456 . 47 1 1 A 130 130 LYS C C 130 179.082 178.558 0.524 1
1 1457 . 47 1 1 A 130 130 LYS CA C 130 60.299 58.733 1.566 1
1 1458 . 47 1 1 A 130 130 LYS CB C 130 32.767 32.172 0.595 1
1 1462 . 47 1 1 A 130 130 LYS N N 130 123.879 120.459 3.420 1
1 1463 . 47 1 1 A 131 131 ALA H H 131 7.184 7.759 -0.575 1
1 1464 . 47 1 1 A 131 131 ALA HA H 131 4.005 4.206 -0.201 1
1 1468 . 47 1 1 A 131 131 ALA C C 131 178.482 179.547 -1.065 1
1 1469 . 47 1 1 A 131 131 ALA CA C 131 55.027 55.186 -0.159 1
1 1470 . 47 1 1 A 131 131 ALA CB C 131 18.669 19.473 -0.804 1
1 1471 . 47 1 1 A 131 131 ALA N N 131 118.590 121.187 -2.597 1
1 1472 . 47 1 1 A 132 132 TRP H H 132 7.977 8.614 -0.637 1
1 1473 . 47 1 1 A 132 132 TRP HA H 132 4.001 4.107 -0.106 1
1 1480 . 47 1 1 A 132 132 TRP C C 132 177.332 175.673 1.659 1
1 1481 . 47 1 1 A 132 132 TRP CA C 132 60.431 57.275 3.156 1
1 1482 . 47 1 1 A 132 132 TRP CB C 132 27.786 27.652 0.134 1
1 1486 . 47 1 1 A 132 132 TRP N N 132 119.168 116.971 2.197 1
1 1488 . 47 1 1 A 133 133 ARG H H 133 8.006 8.175 -0.169 1
1 1489 . 47 1 1 A 133 133 ARG HA H 133 4.027 4.421 -0.394 1
1 1497 . 47 1 1 A 133 133 ARG C C 133 176.664 177.574 -0.910 1
1 1498 . 47 1 1 A 133 133 ARG CA C 133 59.355 57.224 2.131 1
1 1499 . 47 1 1 A 133 133 ARG CB C 133 30.451 32.564 -2.113 1
1 1502 . 47 1 1 A 133 133 ARG N N 133 113.062 120.533 -7.471 1
1 1504 . 47 1 1 A 134 134 LYS H H 134 7.322 7.609 -0.287 1
1 1505 . 47 1 1 A 134 134 LYS HA H 134 4.313 4.407 -0.094 1
1 1514 . 47 1 1 A 134 134 LYS C C 134 176.282 176.263 0.019 1
1 1515 . 47 1 1 A 134 134 LYS CA C 134 54.922 56.345 -1.423 1
1 1516 . 47 1 1 A 134 134 LYS CB C 134 32.633 32.028 0.605 1
1 1520 . 47 1 1 A 134 134 LYS N N 134 118.170 116.178 1.992 1
1 1521 . 47 1 1 A 135 135 LEU H H 135 7.440 7.016 0.424 1
1 1522 . 47 1 1 A 135 135 LEU HA H 135 4.174 4.569 -0.395 1
1 1532 . 47 1 1 A 135 135 LEU CA C 135 54.408 53.187 1.221 1
1 1533 . 47 1 1 A 135 135 LEU CB C 135 40.407 40.998 -0.591 1
1 1537 . 47 1 1 A 135 135 LEU N N 135 123.358 122.732 0.626 1
1 1538 . 47 1 1 A 136 136 PRO HA H 136 4.437 4.419 0.018 1
1 1545 . 47 1 1 A 136 136 PRO C C 136 177.106 176.302 0.804 1
1 1546 . 47 1 1 A 136 136 PRO CA C 136 62.889 65.881 -2.992 1
1 1547 . 47 1 1 A 136 136 PRO CB C 136 32.192 31.280 0.912 1
1 1550 . 47 1 1 A 137 137 VAL H H 137 8.219 7.426 0.793 1
1 1551 . 47 1 1 A 137 137 VAL HA H 137 4.077 4.609 -0.532 1
1 1559 . 47 1 1 A 137 137 VAL C C 137 176.305 173.411 2.894 1
1 1560 . 47 1 1 A 137 137 VAL CA C 137 61.958 60.221 1.737 1
1 1561 . 47 1 1 A 137 137 VAL CB C 137 32.755 34.526 -1.771 1
1 1564 . 47 1 1 A 137 137 VAL N N 137 120.079 115.746 4.333 1
1 1565 . 47 1 1 A 138 138 LYS H H 138 8.444 8.405 0.039 1
1 1566 . 47 1 1 A 138 138 LYS HA H 138 4.316 4.527 -0.211 1
1 1575 . 47 1 1 A 138 138 LYS C C 138 176.790 176.793 -0.003 1
1 1576 . 47 1 1 A 138 138 LYS CA C 138 56.792 55.973 0.819 1
1 1577 . 47 1 1 A 138 138 LYS CB C 138 33.205 33.352 -0.147 1
1 1581 . 47 1 1 A 138 138 LYS N N 138 126.449 126.665 -0.216 1
1 1582 . 47 1 1 A 139 139 GLY H H 139 8.518 8.209 0.309 1
1 1583 . 47 1 1 A 139 139 GLY HA2 H 139 4.070 3.980 0.090 1
1 1584 . 47 1 1 A 139 139 GLY HA3 H 139 3.897 3.988 -0.091 1
1 1585 . 47 1 1 A 139 139 GLY C C 139 172.874 173.356 -0.482 1
1 1586 . 47 1 1 A 139 139 GLY CA C 139 45.157 45.514 -0.357 1
1 1587 . 47 1 1 A 139 139 GLY N N 139 112.617 113.510 -0.893 1
1 6 . 48 1 1 A 2 2 VAL H H 2 8.992 9.190 -0.198 1
1 7 . 48 1 1 A 2 2 VAL HA H 2 5.370 4.515 0.855 1
1 15 . 48 1 1 A 2 2 VAL C C 2 174.325 175.035 -0.710 1
1 16 . 48 1 1 A 2 2 VAL CA C 2 61.267 62.214 -0.947 1
1 17 . 48 1 1 A 2 2 VAL CB C 2 33.890 32.579 1.311 1
1 20 . 48 1 1 A 2 2 VAL N N 2 126.939 121.053 5.886 1
1 21 . 48 1 1 A 3 3 THR H H 3 8.912 8.690 0.222 1
1 22 . 48 1 1 A 3 3 THR HA H 3 4.505 5.413 -0.908 1
1 27 . 48 1 1 A 3 3 THR C C 3 172.710 172.404 0.306 1
1 28 . 48 1 1 A 3 3 THR CA C 3 59.689 59.868 -0.179 1
1 29 . 48 1 1 A 3 3 THR CB C 3 72.398 71.587 0.811 1
1 31 . 48 1 1 A 3 3 THR N N 3 118.091 121.568 -3.477 1
1 32 . 48 1 1 A 4 4 GLU H H 4 8.631 9.081 -0.450 1
1 33 . 48 1 1 A 4 4 GLU HA H 4 5.788 4.949 0.839 1
1 38 . 48 1 1 A 4 4 GLU C C 4 175.758 174.305 1.453 1
1 39 . 48 1 1 A 4 4 GLU CA C 4 54.902 54.522 0.380 1
1 40 . 48 1 1 A 4 4 GLU CB C 4 35.097 33.575 1.522 1
1 42 . 48 1 1 A 4 4 GLU N N 4 120.966 124.492 -3.526 1
1 43 . 48 1 1 A 5 5 THR H H 5 9.188 8.046 1.142 1
1 44 . 48 1 1 A 5 5 THR HA H 5 4.739 5.038 -0.299 1
1 49 . 48 1 1 A 5 5 THR C C 5 172.757 173.691 -0.934 1
1 50 . 48 1 1 A 5 5 THR CA C 5 60.382 61.277 -0.895 1
1 51 . 48 1 1 A 5 5 THR CB C 5 71.558 71.002 0.556 1
1 53 . 48 1 1 A 5 5 THR N N 5 119.366 116.955 2.411 1
1 54 . 48 1 1 A 6 6 VAL H H 6 8.476 9.070 -0.594 1
1 55 . 48 1 1 A 6 6 VAL HA H 6 5.026 5.613 -0.587 1
1 63 . 48 1 1 A 6 6 VAL C C 6 176.674 173.718 2.956 1
1 64 . 48 1 1 A 6 6 VAL CA C 6 61.008 59.379 1.629 1
1 65 . 48 1 1 A 6 6 VAL CB C 6 33.861 35.561 -1.700 1
1 68 . 48 1 1 A 6 6 VAL N N 6 121.384 118.715 2.669 1
1 69 . 48 1 1 A 7 7 ASP H H 7 8.848 9.221 -0.373 1
1 70 . 48 1 1 A 7 7 ASP HA H 7 4.797 5.228 -0.431 1
1 73 . 48 1 1 A 7 7 ASP CA C 7 52.834 53.306 -0.472 1
1 74 . 48 1 1 A 7 7 ASP CB C 7 42.219 43.007 -0.788 1
1 75 . 48 1 1 A 7 7 ASP N N 7 127.061 125.794 1.267 1
1 76 . 48 1 1 A 8 8 GLY C C 8 175.143 175.013 0.130 1
1 77 . 48 1 1 A 8 8 GLY CA C 8 46.553 46.952 -0.399 1
1 78 . 48 1 1 A 9 9 GLN H H 9 8.408 7.998 0.410 1
1 79 . 48 1 1 A 9 9 GLN HA H 9 4.541 4.218 0.323 1
1 86 . 48 1 1 A 9 9 GLN C C 9 176.463 176.366 0.097 1
1 87 . 48 1 1 A 9 9 GLN CA C 9 55.167 55.349 -0.182 1
1 88 . 48 1 1 A 9 9 GLN CB C 9 29.376 27.831 1.545 1
1 90 . 48 1 1 A 9 9 GLN N N 9 118.300 116.942 1.358 1
1 92 . 48 1 1 A 10 10 GLY H H 10 8.162 8.361 -0.199 1
1 93 . 48 1 1 A 10 10 GLY HA2 H 10 4.174 3.953 0.221 1
1 94 . 48 1 1 A 10 10 GLY HA3 H 10 3.521 3.971 -0.450 1
1 95 . 48 1 1 A 10 10 GLY C C 10 174.092 174.161 -0.069 1
1 96 . 48 1 1 A 10 10 GLY CA C 10 45.558 45.693 -0.135 1
1 97 . 48 1 1 A 10 10 GLY N N 10 108.747 110.340 -1.593 1
1 98 . 48 1 1 A 11 11 GLN H H 11 8.507 7.371 1.136 1
1 99 . 48 1 1 A 11 11 GLN HA H 11 4.202 4.783 -0.581 1
1 106 . 48 1 1 A 11 11 GLN C C 11 173.992 174.462 -0.470 1
1 107 . 48 1 1 A 11 11 GLN CA C 11 55.098 54.820 0.278 1
1 108 . 48 1 1 A 11 11 GLN CB C 11 29.097 31.095 -1.998 1
1 110 . 48 1 1 A 11 11 GLN N N 11 122.979 116.697 6.282 1
1 112 . 48 1 1 A 12 12 ALA H H 12 8.259 8.770 -0.511 1
1 113 . 48 1 1 A 12 12 ALA HA H 12 5.156 5.856 -0.700 1
1 117 . 48 1 1 A 12 12 ALA C C 12 177.284 176.400 0.884 1
1 118 . 48 1 1 A 12 12 ALA CA C 12 51.087 50.396 0.691 1
1 119 . 48 1 1 A 12 12 ALA CB C 12 20.500 21.639 -1.139 1
1 120 . 48 1 1 A 12 12 ALA N N 12 127.100 124.300 2.800 1
1 121 . 48 1 1 A 13 13 TRP H H 13 9.245 9.332 -0.087 1
1 122 . 48 1 1 A 13 13 TRP HA H 13 4.717 5.652 -0.935 1
1 131 . 48 1 1 A 13 13 TRP C C 13 175.108 174.531 0.577 1
1 132 . 48 1 1 A 13 13 TRP CA C 13 55.966 55.431 0.535 1
1 133 . 48 1 1 A 13 13 TRP CB C 13 31.912 32.596 -0.684 1
1 139 . 48 1 1 A 13 13 TRP N N 13 123.088 119.579 3.509 1
1 141 . 48 1 1 A 14 14 ARG H H 14 8.575 8.682 -0.107 1
1 142 . 48 1 1 A 14 14 ARG HA H 14 5.335 4.734 0.601 1
1 150 . 48 1 1 A 14 14 ARG C C 14 175.191 174.199 0.992 1
1 151 . 48 1 1 A 14 14 ARG CA C 14 53.106 55.173 -2.067 1
1 152 . 48 1 1 A 14 14 ARG CB C 14 32.749 31.739 1.010 1
1 154 . 48 1 1 A 14 14 ARG N N 14 121.163 121.784 -0.621 1
1 156 . 48 1 1 A 15 15 HIS H H 15 8.595 8.088 0.507 1
1 157 . 48 1 1 A 15 15 HIS HA H 15 4.790 4.984 -0.194 1
1 161 . 48 1 1 A 15 15 HIS C C 15 173.770 174.227 -0.457 1
1 162 . 48 1 1 A 15 15 HIS CA C 15 55.289 54.665 0.624 1
1 163 . 48 1 1 A 15 15 HIS CB C 15 33.208 33.144 0.064 1
1 165 . 48 1 1 A 15 15 HIS N N 15 117.643 118.460 -0.817 1
1 166 . 48 1 1 A 16 16 HIS H H 16 8.993 8.547 0.446 1
1 167 . 48 1 1 A 16 16 HIS HA H 16 5.158 5.040 0.118 1
1 171 . 48 1 1 A 16 16 HIS C C 16 173.608 173.912 -0.304 1
1 172 . 48 1 1 A 16 16 HIS CA C 16 56.450 54.316 2.134 1
1 173 . 48 1 1 A 16 16 HIS CB C 16 34.171 30.914 3.257 1
1 175 . 48 1 1 A 16 16 HIS N N 16 123.520 118.187 5.333 1
1 176 . 48 1 1 A 17 17 ASN H H 17 7.829 8.889 -1.060 1
1 177 . 48 1 1 A 17 17 ASN HA H 17 4.713 4.881 -0.168 1
1 182 . 48 1 1 A 17 17 ASN C C 17 173.682 175.242 -1.560 1
1 183 . 48 1 1 A 17 17 ASN CA C 17 51.822 51.862 -0.040 1
1 184 . 48 1 1 A 17 17 ASN CB C 17 43.176 39.988 3.188 1
1 185 . 48 1 1 A 17 17 ASN N N 17 122.213 122.874 -0.661 1
1 187 . 48 1 1 A 18 18 GLY H H 18 8.423 8.806 -0.383 1
1 188 . 48 1 1 A 18 18 GLY HA2 H 18 3.931 3.284 0.647 1
1 189 . 48 1 1 A 18 18 GLY HA3 H 18 3.707 3.617 0.090 1
1 190 . 48 1 1 A 18 18 GLY C C 18 173.985 172.716 1.269 1
1 191 . 48 1 1 A 18 18 GLY CA C 18 43.949 46.457 -2.508 1
1 192 . 48 1 1 A 18 18 GLY N N 18 106.991 115.981 -8.990 1
1 193 . 48 1 1 A 19 19 PHE H H 19 8.338 8.337 0.001 1
1 194 . 48 1 1 A 19 19 PHE HA H 19 4.068 5.346 -1.278 1
1 197 . 48 1 1 A 19 19 PHE C C 19 176.568 174.319 2.249 1
1 198 . 48 1 1 A 19 19 PHE CA C 19 59.338 56.351 2.987 1
1 199 . 48 1 1 A 19 19 PHE CB C 19 40.201 42.469 -2.268 1
1 200 . 48 1 1 A 19 19 PHE N N 19 116.857 121.313 -4.456 1
1 201 . 48 1 1 A 20 20 ASP H H 20 8.794 8.682 0.112 1
1 202 . 48 1 1 A 20 20 ASP HA H 20 4.485 4.865 -0.380 1
1 205 . 48 1 1 A 20 20 ASP C C 20 177.379 176.872 0.507 1
1 206 . 48 1 1 A 20 20 ASP CA C 20 54.140 54.150 -0.010 1
1 207 . 48 1 1 A 20 20 ASP CB C 20 41.915 41.722 0.193 1
1 208 . 48 1 1 A 20 20 ASP N N 20 123.025 124.387 -1.362 1
1 209 . 48 1 1 A 21 21 PHE H H 21 8.862 9.132 -0.270 1
1 210 . 48 1 1 A 21 21 PHE HA H 21 4.087 4.098 -0.011 1
1 218 . 48 1 1 A 21 21 PHE C C 21 176.952 177.309 -0.357 1
1 219 . 48 1 1 A 21 21 PHE CA C 21 61.095 62.308 -1.213 1
1 220 . 48 1 1 A 21 21 PHE CB C 21 38.678 39.317 -0.639 1
1 226 . 48 1 1 A 21 21 PHE N N 21 127.163 127.415 -0.252 1
1 227 . 48 1 1 A 22 22 ALA H H 22 8.561 8.405 0.156 1
1 228 . 48 1 1 A 22 22 ALA HA H 22 3.878 3.882 -0.004 1
1 232 . 48 1 1 A 22 22 ALA C C 22 180.710 180.229 0.481 1
1 233 . 48 1 1 A 22 22 ALA CA C 22 55.211 55.096 0.115 1
1 234 . 48 1 1 A 22 22 ALA CB C 22 18.321 18.144 0.177 1
1 235 . 48 1 1 A 22 22 ALA N N 22 120.293 121.382 -1.089 1
1 236 . 48 1 1 A 23 23 VAL H H 23 7.241 7.864 -0.623 1
1 237 . 48 1 1 A 23 23 VAL HA H 23 3.684 3.483 0.201 1
1 245 . 48 1 1 A 23 23 VAL C C 23 177.101 178.016 -0.915 1
1 246 . 48 1 1 A 23 23 VAL CA C 23 65.237 66.938 -1.701 1
1 247 . 48 1 1 A 23 23 VAL CB C 23 31.780 31.488 0.292 1
1 250 . 48 1 1 A 23 23 VAL N N 23 118.775 117.903 0.872 1
1 251 . 48 1 1 A 24 24 ILE H H 24 6.761 8.120 -1.359 1
1 252 . 48 1 1 A 24 24 ILE HA H 24 3.196 3.516 -0.320 1
1 262 . 48 1 1 A 24 24 ILE C C 24 177.287 177.937 -0.650 1
1 263 . 48 1 1 A 24 24 ILE CA C 24 63.404 65.417 -2.013 1
1 264 . 48 1 1 A 24 24 ILE CB C 24 36.294 37.894 -1.600 1
1 268 . 48 1 1 A 24 24 ILE N N 24 119.036 119.744 -0.708 1
1 269 . 48 1 1 A 25 25 LYS H H 25 8.032 8.126 -0.094 1
1 270 . 48 1 1 A 25 25 LYS HA H 25 3.809 3.630 0.179 1
1 279 . 48 1 1 A 25 25 LYS C C 25 179.450 178.902 0.548 1
1 280 . 48 1 1 A 25 25 LYS CA C 25 59.621 59.487 0.134 1
1 281 . 48 1 1 A 25 25 LYS CB C 25 32.259 31.983 0.276 1
1 285 . 48 1 1 A 25 25 LYS N N 25 118.368 120.592 -2.224 1
1 286 . 48 1 1 A 26 26 GLU H H 26 7.845 8.064 -0.219 1
1 287 . 48 1 1 A 26 26 GLU HA H 26 4.021 4.107 -0.086 1
1 292 . 48 1 1 A 26 26 GLU C C 26 179.191 178.733 0.458 1
1 293 . 48 1 1 A 26 26 GLU CA C 26 59.530 58.819 0.711 1
1 294 . 48 1 1 A 26 26 GLU CB C 26 29.449 29.409 0.040 1
1 296 . 48 1 1 A 26 26 GLU N N 26 120.522 118.626 1.896 1
1 297 . 48 1 1 A 27 27 LEU H H 27 8.165 8.271 -0.106 1
1 298 . 48 1 1 A 27 27 LEU HA H 27 4.163 4.061 0.102 1
1 308 . 48 1 1 A 27 27 LEU C C 27 177.256 178.365 -1.109 1
1 309 . 48 1 1 A 27 27 LEU CA C 27 58.049 57.453 0.596 1
1 310 . 48 1 1 A 27 27 LEU CB C 27 41.365 41.339 0.026 1
1 314 . 48 1 1 A 27 27 LEU N N 27 120.879 121.152 -0.273 1
1 315 . 48 1 1 A 28 28 LYS H H 28 8.902 8.195 0.707 1
1 316 . 48 1 1 A 28 28 LYS HA H 28 4.199 4.471 -0.272 1
1 317 . 48 1 1 A 28 28 LYS C C 28 179.707 179.416 0.291 1
1 318 . 48 1 1 A 28 28 LYS CA C 28 60.097 59.068 1.029 1
1 319 . 48 1 1 A 28 28 LYS CB C 28 33.420 31.696 1.724 1
1 320 . 48 1 1 A 28 28 LYS N N 28 120.050 119.607 0.443 1
1 321 . 48 1 1 A 29 29 THR H H 29 8.294 7.759 0.535 1
1 322 . 48 1 1 A 29 29 THR HA H 29 3.892 3.886 0.006 1
1 327 . 48 1 1 A 29 29 THR C C 29 175.711 176.124 -0.413 1
1 328 . 48 1 1 A 29 29 THR CA C 29 66.846 66.432 0.414 1
1 329 . 48 1 1 A 29 29 THR CB C 29 68.794 68.620 0.174 1
1 331 . 48 1 1 A 29 29 THR N N 29 115.933 116.528 -0.595 1
1 332 . 48 1 1 A 30 30 ALA H H 30 8.244 8.166 0.078 1
1 333 . 48 1 1 A 30 30 ALA HA H 30 4.241 4.027 0.214 1
1 337 . 48 1 1 A 30 30 ALA C C 30 179.128 179.473 -0.345 1
1 338 . 48 1 1 A 30 30 ALA CA C 30 55.714 55.172 0.542 1
1 339 . 48 1 1 A 30 30 ALA CB C 30 18.955 18.444 0.511 1
1 340 . 48 1 1 A 30 30 ALA N N 30 124.617 123.048 1.569 1
1 341 . 48 1 1 A 31 31 ALA H H 31 8.968 8.444 0.524 1
1 342 . 48 1 1 A 31 31 ALA HA H 31 3.890 4.029 -0.139 1
1 346 . 48 1 1 A 31 31 ALA C C 31 180.352 179.632 0.720 1
1 347 . 48 1 1 A 31 31 ALA CA C 31 55.454 55.332 0.122 1
1 348 . 48 1 1 A 31 31 ALA CB C 31 17.124 18.624 -1.500 1
1 349 . 48 1 1 A 31 31 ALA N N 31 119.327 120.814 -1.487 1
1 350 . 48 1 1 A 32 32 SER H H 32 7.995 7.994 0.001 1
1 351 . 48 1 1 A 32 32 SER HA H 32 4.238 4.226 0.012 1
1 354 . 48 1 1 A 32 32 SER C C 32 175.612 175.556 0.056 1
1 355 . 48 1 1 A 32 32 SER CA C 32 61.203 61.330 -0.127 1
1 356 . 48 1 1 A 32 32 SER CB C 32 63.406 63.337 0.069 1
1 357 . 48 1 1 A 32 32 SER N N 32 111.962 113.718 -1.756 1
1 358 . 48 1 1 A 33 33 GLN H H 33 8.333 7.779 0.554 1
1 359 . 48 1 1 A 33 33 GLN HA H 33 3.992 4.360 -0.368 1
1 366 . 48 1 1 A 33 33 GLN C C 33 177.486 177.591 -0.105 1
1 367 . 48 1 1 A 33 33 GLN CA C 33 58.277 57.936 0.341 1
1 368 . 48 1 1 A 33 33 GLN CB C 33 29.140 30.153 -1.013 1
1 370 . 48 1 1 A 33 33 GLN N N 33 119.527 119.420 0.107 1
1 372 . 48 1 1 A 34 34 TYR H H 34 8.587 8.238 0.349 1
1 373 . 48 1 1 A 34 34 TYR HA H 34 4.792 4.535 0.257 1
1 380 . 48 1 1 A 34 34 TYR C C 34 176.499 176.701 -0.202 1
1 381 . 48 1 1 A 34 34 TYR CA C 34 57.711 59.127 -1.416 1
1 382 . 48 1 1 A 34 34 TYR CB C 34 39.561 39.032 0.529 1
1 387 . 48 1 1 A 34 34 TYR N N 34 114.610 115.154 -0.544 1
1 388 . 48 1 1 A 35 35 GLY H H 35 7.346 8.012 -0.666 1
1 389 . 48 1 1 A 35 35 GLY HA2 H 35 4.785 4.072 0.713 1
1 390 . 48 1 1 A 35 35 GLY HA3 H 35 4.007 4.081 -0.074 1
1 391 . 48 1 1 A 35 35 GLY C C 35 175.796 173.147 2.649 1
1 392 . 48 1 1 A 35 35 GLY CA C 35 44.355 44.730 -0.375 1
1 393 . 48 1 1 A 35 35 GLY N N 35 108.501 106.464 2.037 1
1 394 . 48 1 1 A 36 36 ALA H H 36 9.363 8.008 1.355 1
1 395 . 48 1 1 A 36 36 ALA HA H 36 4.217 4.629 -0.412 1
1 399 . 48 1 1 A 36 36 ALA C C 36 178.039 177.602 0.437 1
1 400 . 48 1 1 A 36 36 ALA CA C 36 56.114 51.764 4.350 1
1 401 . 48 1 1 A 36 36 ALA CB C 36 19.179 19.243 -0.064 1
1 402 . 48 1 1 A 36 36 ALA N N 36 125.811 123.126 2.685 1
1 403 . 48 1 1 A 37 37 THR H H 37 8.070 8.808 -0.738 1
1 404 . 48 1 1 A 37 37 THR HA H 37 4.570 4.540 0.030 1
1 409 . 48 1 1 A 37 37 THR C C 37 173.685 174.180 -0.495 1
1 410 . 48 1 1 A 37 37 THR CA C 37 59.822 62.723 -2.901 1
1 411 . 48 1 1 A 37 37 THR CB C 37 68.267 71.390 -3.123 1
1 413 . 48 1 1 A 37 37 THR N N 37 129.410 117.858 11.552 1
1 414 . 48 1 1 A 38 38 ALA H H 38 6.853 7.481 -0.628 1
1 415 . 48 1 1 A 38 38 ALA HA H 38 4.601 4.531 0.070 1
1 419 . 48 1 1 A 38 38 ALA CA C 38 50.758 50.777 -0.019 1
1 420 . 48 1 1 A 38 38 ALA CB C 38 18.325 19.612 -1.287 1
1 421 . 48 1 1 A 38 38 ALA N N 38 124.674 124.215 0.459 1
1 422 . 48 1 1 A 40 40 TYR HA H 40 4.032 4.096 -0.064 1
1 429 . 48 1 1 A 40 40 TYR C C 40 176.456 177.322 -0.866 1
1 430 . 48 1 1 A 40 40 TYR CA C 40 61.010 61.786 -0.776 1
1 431 . 48 1 1 A 40 40 TYR CB C 40 39.286 38.733 0.553 1
1 436 . 48 1 1 A 41 41 THR H H 41 6.874 8.230 -1.356 1
1 437 . 48 1 1 A 41 41 THR HA H 41 3.616 3.766 -0.150 1
1 442 . 48 1 1 A 41 41 THR C C 41 176.930 176.539 0.391 1
1 443 . 48 1 1 A 41 41 THR CA C 41 65.557 65.640 -0.083 1
1 444 . 48 1 1 A 41 41 THR CB C 41 68.228 69.276 -1.048 1
1 446 . 48 1 1 A 41 41 THR N N 41 115.143 113.982 1.161 1
1 447 . 48 1 1 A 42 42 LEU H H 42 8.623 7.387 1.236 1
1 448 . 48 1 1 A 42 42 LEU HA H 42 3.708 4.034 -0.326 1
1 458 . 48 1 1 A 42 42 LEU C C 42 178.206 179.036 -0.830 1
1 459 . 48 1 1 A 42 42 LEU CA C 42 57.417 57.829 -0.412 1
1 460 . 48 1 1 A 42 42 LEU CB C 42 41.342 41.259 0.083 1
1 464 . 48 1 1 A 42 42 LEU N N 42 120.418 117.858 2.560 1
1 465 . 48 1 1 A 43 43 ALA H H 43 7.735 7.587 0.148 1
1 466 . 48 1 1 A 43 43 ALA HA H 43 4.020 4.012 0.008 1
1 470 . 48 1 1 A 43 43 ALA C C 43 180.826 180.392 0.434 1
1 471 . 48 1 1 A 43 43 ALA CA C 43 54.925 54.959 -0.034 1
1 472 . 48 1 1 A 43 43 ALA CB C 43 17.506 18.337 -0.831 1
1 473 . 48 1 1 A 43 43 ALA N N 43 120.203 121.846 -1.643 1
1 474 . 48 1 1 A 44 44 ILE H H 44 7.149 7.303 -0.154 1
1 475 . 48 1 1 A 44 44 ILE HA H 44 3.603 3.624 -0.021 1
1 485 . 48 1 1 A 44 44 ILE C C 44 178.594 178.106 0.488 1
1 486 . 48 1 1 A 44 44 ILE CA C 44 64.782 64.107 0.675 1
1 487 . 48 1 1 A 44 44 ILE CB C 44 37.472 37.703 -0.231 1
1 491 . 48 1 1 A 44 44 ILE N N 44 118.881 119.324 -0.443 1
1 492 . 48 1 1 A 45 45 VAL H H 45 7.968 8.049 -0.081 1
1 493 . 48 1 1 A 45 45 VAL HA H 45 2.925 3.368 -0.443 1
1 501 . 48 1 1 A 45 45 VAL C C 45 177.023 177.980 -0.957 1
1 502 . 48 1 1 A 45 45 VAL CA C 45 67.081 67.019 0.062 1
1 503 . 48 1 1 A 45 45 VAL CB C 45 30.854 31.277 -0.423 1
1 506 . 48 1 1 A 45 45 VAL N N 45 120.764 119.859 0.905 1
1 507 . 48 1 1 A 46 46 GLU H H 46 8.399 8.160 0.239 1
1 508 . 48 1 1 A 46 46 GLU HA H 46 3.848 3.910 -0.062 1
1 513 . 48 1 1 A 46 46 GLU C C 46 178.656 178.679 -0.023 1
1 514 . 48 1 1 A 46 46 GLU CA C 46 59.491 58.739 0.752 1
1 515 . 48 1 1 A 46 46 GLU CB C 46 28.991 28.580 0.411 1
1 517 . 48 1 1 A 46 46 GLU N N 46 116.599 119.641 -3.042 1
1 518 . 48 1 1 A 47 47 SER H H 47 7.273 7.390 -0.117 1
1 519 . 48 1 1 A 47 47 SER HA H 47 4.287 4.152 0.135 1
1 521 . 48 1 1 A 47 47 SER CA C 47 61.047 61.131 -0.084 1
1 522 . 48 1 1 A 47 47 SER CB C 47 63.016 62.833 0.183 1
1 523 . 48 1 1 A 47 47 SER N N 47 113.609 116.017 -2.408 1
1 524 . 48 1 1 A 48 48 VAL H H 48 8.006 8.370 -0.364 1
1 525 . 48 1 1 A 48 48 VAL HA H 48 3.556 3.522 0.034 1
1 533 . 48 1 1 A 48 48 VAL C C 48 177.257 177.881 -0.624 1
1 534 . 48 1 1 A 48 48 VAL CA C 48 65.025 66.506 -1.481 1
1 535 . 48 1 1 A 48 48 VAL CB C 48 31.841 31.488 0.353 1
1 538 . 48 1 1 A 48 48 VAL N N 48 122.327 121.617 0.710 1
1 539 . 48 1 1 A 49 49 ALA H H 49 8.369 7.800 0.569 1
1 540 . 48 1 1 A 49 49 ALA HA H 49 4.115 4.290 -0.175 1
1 544 . 48 1 1 A 49 49 ALA C C 49 177.307 178.039 -0.732 1
1 545 . 48 1 1 A 49 49 ALA CA C 49 53.253 53.426 -0.173 1
1 546 . 48 1 1 A 49 49 ALA CB C 49 20.131 18.207 1.924 1
1 547 . 48 1 1 A 49 49 ALA N N 49 118.050 121.162 -3.112 1
1 548 . 48 1 1 A 50 50 ASP H H 50 7.052 7.886 -0.834 1
1 549 . 48 1 1 A 50 50 ASP HA H 50 4.788 4.622 0.166 1
1 552 . 48 1 1 A 50 50 ASP C C 50 175.481 176.251 -0.770 1
1 553 . 48 1 1 A 50 50 ASP CA C 50 53.681 55.258 -1.577 1
1 554 . 48 1 1 A 50 50 ASP CB C 50 39.333 41.087 -1.754 1
1 555 . 48 1 1 A 50 50 ASP N N 50 116.997 117.589 -0.592 1
1 556 . 48 1 1 A 51 51 ASN H H 51 8.535 7.635 0.900 1
1 557 . 48 1 1 A 51 51 ASN HA H 51 4.628 4.859 -0.231 1
1 562 . 48 1 1 A 51 51 ASN C C 51 174.077 175.376 -1.299 1
1 563 . 48 1 1 A 51 51 ASN CA C 51 52.315 51.874 0.441 1
1 564 . 48 1 1 A 51 51 ASN CB C 51 41.928 39.873 2.055 1
1 565 . 48 1 1 A 51 51 ASN N N 51 118.626 117.507 1.119 1
1 567 . 48 1 1 A 52 52 TRP H H 52 8.555 8.072 0.483 1
1 574 . 48 1 1 A 52 52 TRP C C 52 173.269 176.035 -2.766 1
1 575 . 48 1 1 A 52 52 TRP CA C 52 55.031 58.191 -3.160 1
1 576 . 48 1 1 A 52 52 TRP CB C 52 26.801 29.884 -3.083 1
1 582 . 48 1 1 A 52 52 TRP N N 52 120.693 121.295 -0.602 1
1 584 . 48 1 1 A 53 53 LEU H H 53 7.847 8.953 -1.106 1
1 585 . 48 1 1 A 53 53 LEU HA H 53 4.859 5.171 -0.312 1
1 595 . 48 1 1 A 53 53 LEU C C 53 177.397 175.013 2.384 1
1 596 . 48 1 1 A 53 53 LEU CA C 53 53.619 53.900 -0.281 1
1 597 . 48 1 1 A 53 53 LEU CB C 53 41.812 46.157 -4.345 1
1 601 . 48 1 1 A 53 53 LEU N N 53 124.741 124.788 -0.047 1
1 602 . 48 1 1 A 54 54 THR H H 54 8.850 8.850 0.000 1
1 603 . 48 1 1 A 54 54 THR HA H 54 4.598 4.504 0.094 1
1 608 . 48 1 1 A 54 54 THR CA C 54 60.531 60.843 -0.312 1
1 609 . 48 1 1 A 54 54 THR CB C 54 67.183 68.644 -1.461 1
1 611 . 48 1 1 A 54 54 THR N N 54 113.407 121.134 -7.727 1
1 612 . 48 1 1 A 55 55 PRO HA H 55 4.511 4.069 0.442 1
1 619 . 48 1 1 A 55 55 PRO C C 55 179.383 177.882 1.501 1
1 620 . 48 1 1 A 55 55 PRO CA C 55 67.159 65.575 1.584 1
1 621 . 48 1 1 A 55 55 PRO CB C 55 32.095 31.828 0.267 1
1 622 . 48 1 1 A 56 56 THR H H 56 8.575 7.731 0.844 1
1 623 . 48 1 1 A 56 56 THR HA H 56 4.229 4.248 -0.019 1
1 628 . 48 1 1 A 56 56 THR C C 56 176.668 176.457 0.211 1
1 629 . 48 1 1 A 56 56 THR CA C 56 66.943 65.100 1.843 1
1 630 . 48 1 1 A 56 56 THR CB C 56 68.129 69.075 -0.946 1
1 632 . 48 1 1 A 56 56 THR N N 56 114.855 111.363 3.492 1
1 633 . 48 1 1 A 57 57 ASP H H 57 8.730 8.139 0.591 1
1 634 . 48 1 1 A 57 57 ASP HA H 57 4.425 4.916 -0.491 1
1 637 . 48 1 1 A 57 57 ASP C C 57 178.351 178.770 -0.419 1
1 638 . 48 1 1 A 57 57 ASP CA C 57 57.963 57.677 0.286 1
1 639 . 48 1 1 A 57 57 ASP CB C 57 40.134 41.529 -1.395 1
1 640 . 48 1 1 A 57 57 ASP N N 57 126.239 121.606 4.633 1
1 641 . 48 1 1 A 58 58 TRP H H 58 8.244 8.625 -0.381 1
1 642 . 48 1 1 A 58 58 TRP HA H 58 4.030 4.625 -0.595 1
1 650 . 48 1 1 A 58 58 TRP C C 58 177.432 179.282 -1.850 1
1 651 . 48 1 1 A 58 58 TRP CA C 58 62.731 60.025 2.706 1
1 652 . 48 1 1 A 58 58 TRP CB C 58 29.122 29.519 -0.397 1
1 657 . 48 1 1 A 58 58 TRP N N 58 119.241 121.119 -1.878 1
1 659 . 48 1 1 A 59 59 ASN H H 59 8.098 8.706 -0.608 1
1 660 . 48 1 1 A 59 59 ASN HA H 59 4.424 4.383 0.041 1
1 663 . 48 1 1 A 59 59 ASN C C 59 176.952 178.126 -1.174 1
1 664 . 48 1 1 A 59 59 ASN CA C 59 58.135 56.589 1.546 1
1 665 . 48 1 1 A 59 59 ASN CB C 59 40.168 38.258 1.910 1
1 666 . 48 1 1 A 59 59 ASN N N 59 115.747 117.578 -1.831 1
1 667 . 48 1 1 A 60 60 THR H H 60 8.712 7.834 0.878 1
1 668 . 48 1 1 A 60 60 THR HA H 60 3.717 3.943 -0.226 1
1 673 . 48 1 1 A 60 60 THR C C 60 176.044 177.036 -0.992 1
1 674 . 48 1 1 A 60 60 THR CA C 60 66.576 66.205 0.371 1
1 675 . 48 1 1 A 60 60 THR CB C 60 69.251 67.882 1.369 1
1 677 . 48 1 1 A 60 60 THR N N 60 114.896 118.110 -3.214 1
1 678 . 48 1 1 A 61 61 LEU H H 61 8.485 8.164 0.321 1
1 679 . 48 1 1 A 61 61 LEU HA H 61 3.391 3.943 -0.552 1
1 689 . 48 1 1 A 61 61 LEU C C 61 177.433 178.701 -1.268 1
1 690 . 48 1 1 A 61 61 LEU CA C 61 58.354 58.380 -0.026 1
1 691 . 48 1 1 A 61 61 LEU CB C 61 41.761 41.891 -0.130 1
1 695 . 48 1 1 A 61 61 LEU N N 61 123.433 122.133 1.300 1
1 696 . 48 1 1 A 62 62 VAL H H 62 8.073 7.676 0.397 1
1 697 . 48 1 1 A 62 62 VAL HA H 62 3.207 3.246 -0.039 1
1 705 . 48 1 1 A 62 62 VAL C C 62 177.585 178.019 -0.434 1
1 706 . 48 1 1 A 62 62 VAL CA C 62 67.345 66.618 0.727 1
1 707 . 48 1 1 A 62 62 VAL CB C 62 30.905 30.982 -0.077 1
1 710 . 48 1 1 A 62 62 VAL N N 62 116.018 117.345 -1.327 1
1 711 . 48 1 1 A 63 63 ARG H H 63 7.765 7.562 0.203 1
1 712 . 48 1 1 A 63 63 ARG HA H 63 3.602 3.889 -0.287 1
1 719 . 48 1 1 A 63 63 ARG C C 63 177.818 178.107 -0.289 1
1 720 . 48 1 1 A 63 63 ARG CA C 63 58.049 59.592 -1.543 1
1 721 . 48 1 1 A 63 63 ARG CB C 63 29.955 30.093 -0.138 1
1 724 . 48 1 1 A 63 63 ARG N N 63 116.700 120.809 -4.109 1
1 725 . 48 1 1 A 64 64 ALA H H 64 7.574 7.681 -0.107 1
1 726 . 48 1 1 A 64 64 ALA HA H 64 4.158 4.406 -0.248 1
1 730 . 48 1 1 A 64 64 ALA C C 64 179.886 179.159 0.727 1
1 731 . 48 1 1 A 64 64 ALA CA C 64 54.007 53.346 0.661 1
1 732 . 48 1 1 A 64 64 ALA CB C 64 19.147 20.134 -0.987 1
1 733 . 48 1 1 A 64 64 ALA N N 64 117.555 120.468 -2.913 1
1 734 . 48 1 1 A 65 65 VAL H H 65 7.554 7.679 -0.125 1
1 735 . 48 1 1 A 65 65 VAL HA H 65 4.253 3.557 0.696 1
1 743 . 48 1 1 A 65 65 VAL C C 65 174.180 176.559 -2.379 1
1 744 . 48 1 1 A 65 65 VAL CA C 65 62.683 66.790 -4.107 1
1 745 . 48 1 1 A 65 65 VAL CB C 65 33.458 32.000 1.458 1
1 748 . 48 1 1 A 65 65 VAL N N 65 110.013 117.985 -7.972 1
1 749 . 48 1 1 A 66 66 LEU H H 66 7.792 7.563 0.229 1
1 750 . 48 1 1 A 66 66 LEU HA H 66 4.790 4.588 0.202 1
1 760 . 48 1 1 A 66 66 LEU C C 66 177.537 175.590 1.947 1
1 761 . 48 1 1 A 66 66 LEU CA C 66 52.823 52.845 -0.022 1
1 762 . 48 1 1 A 66 66 LEU CB C 66 44.071 44.252 -0.181 1
1 766 . 48 1 1 A 66 66 LEU N N 66 118.967 118.895 0.072 1
1 767 . 48 1 1 A 67 67 SER H H 67 9.208 8.478 0.730 1
1 768 . 48 1 1 A 67 67 SER HA H 67 4.414 4.773 -0.359 1
1 771 . 48 1 1 A 67 67 SER CA C 67 57.943 57.501 0.442 1
1 772 . 48 1 1 A 67 67 SER CB C 67 64.743 65.300 -0.557 1
1 773 . 48 1 1 A 67 67 SER N N 67 116.378 116.602 -0.224 1
1 774 . 48 1 1 A 69 69 GLY HA2 H 69 3.916 3.767 0.149 1
1 775 . 48 1 1 A 69 69 GLY HA3 H 69 3.867 3.798 0.069 1
1 776 . 48 1 1 A 69 69 GLY C C 69 176.783 175.531 1.252 1
1 777 . 48 1 1 A 69 69 GLY CA C 69 46.977 46.750 0.227 1
1 778 . 48 1 1 A 70 70 ASP H H 70 7.674 8.150 -0.476 1
1 779 . 48 1 1 A 70 70 ASP HA H 70 4.511 3.728 0.783 1
1 782 . 48 1 1 A 70 70 ASP C C 70 178.096 178.421 -0.325 1
1 783 . 48 1 1 A 70 70 ASP CA C 70 57.262 56.549 0.713 1
1 784 . 48 1 1 A 70 70 ASP CB C 70 40.594 39.749 0.845 1
1 785 . 48 1 1 A 70 70 ASP N N 70 123.930 121.879 2.051 1
1 786 . 48 1 1 A 71 71 HIS H H 71 8.729 7.785 0.944 1
1 787 . 48 1 1 A 71 71 HIS HA H 71 4.235 4.295 -0.060 1
1 790 . 48 1 1 A 71 71 HIS C C 71 176.769 176.917 -0.148 1
1 791 . 48 1 1 A 71 71 HIS CA C 71 60.041 59.897 0.144 1
1 792 . 48 1 1 A 71 71 HIS CB C 71 30.682 30.495 0.187 1
1 793 . 48 1 1 A 71 71 HIS N N 71 121.003 119.376 1.627 1
1 794 . 48 1 1 A 72 72 LEU H H 72 7.620 7.980 -0.360 1
1 795 . 48 1 1 A 72 72 LEU HA H 72 3.769 3.972 -0.203 1
1 805 . 48 1 1 A 72 72 LEU C C 72 180.275 179.173 1.102 1
1 806 . 48 1 1 A 72 72 LEU CA C 72 58.192 58.044 0.148 1
1 807 . 48 1 1 A 72 72 LEU CB C 72 41.381 41.299 0.082 1
1 811 . 48 1 1 A 72 72 LEU N N 72 118.569 118.784 -0.215 1
1 812 . 48 1 1 A 73 73 LEU H H 73 7.542 7.576 -0.034 1
1 813 . 48 1 1 A 73 73 LEU HA H 73 4.107 4.180 -0.073 1
1 823 . 48 1 1 A 73 73 LEU C C 73 179.436 179.158 0.278 1
1 824 . 48 1 1 A 73 73 LEU CA C 73 58.026 57.391 0.635 1
1 825 . 48 1 1 A 73 73 LEU CB C 73 41.638 42.046 -0.408 1
1 829 . 48 1 1 A 73 73 LEU N N 73 121.418 120.735 0.683 1
1 830 . 48 1 1 A 74 74 TRP H H 74 8.786 8.014 0.772 1
1 831 . 48 1 1 A 74 74 TRP HA H 74 3.589 5.240 -1.651 1
1 840 . 48 1 1 A 74 74 TRP C C 74 176.816 178.640 -1.824 1
1 841 . 48 1 1 A 74 74 TRP CA C 74 63.046 60.025 3.021 1
1 842 . 48 1 1 A 74 74 TRP CB C 74 28.065 29.174 -1.109 1
1 848 . 48 1 1 A 74 74 TRP N N 74 121.111 118.113 2.998 1
1 850 . 48 1 1 A 75 75 LYS H H 75 8.939 7.503 1.436 1
1 851 . 48 1 1 A 75 75 LYS HA H 75 3.055 4.148 -1.093 1
1 860 . 48 1 1 A 75 75 LYS C C 75 177.967 179.210 -1.243 1
1 861 . 48 1 1 A 75 75 LYS CA C 75 60.029 58.666 1.363 1
1 862 . 48 1 1 A 75 75 LYS CB C 75 32.533 32.691 -0.158 1
1 866 . 48 1 1 A 75 75 LYS N N 75 119.783 118.656 1.127 1
1 867 . 48 1 1 A 76 76 SER H H 76 7.832 7.799 0.033 1
1 868 . 48 1 1 A 76 76 SER HA H 76 4.040 4.307 -0.267 1
1 871 . 48 1 1 A 76 76 SER C C 76 177.816 176.616 1.200 1
1 872 . 48 1 1 A 76 76 SER CA C 76 62.105 62.254 -0.149 1
1 873 . 48 1 1 A 76 76 SER CB C 76 62.679 62.965 -0.286 1
1 874 . 48 1 1 A 76 76 SER N N 76 113.395 117.060 -3.665 1
1 875 . 48 1 1 A 77 77 GLU H H 77 7.590 7.637 -0.047 1
1 876 . 48 1 1 A 77 77 GLU HA H 77 4.042 4.397 -0.355 1
1 881 . 48 1 1 A 77 77 GLU C C 77 177.809 178.516 -0.707 1
1 882 . 48 1 1 A 77 77 GLU CA C 77 58.270 58.073 0.197 1
1 883 . 48 1 1 A 77 77 GLU CB C 77 29.208 29.459 -0.251 1
1 885 . 48 1 1 A 77 77 GLU N N 77 121.574 122.390 -0.816 1
1 886 . 48 1 1 A 78 78 PHE H H 78 9.081 7.873 1.208 1
1 887 . 48 1 1 A 78 78 PHE HA H 78 3.778 4.244 -0.466 1
1 895 . 48 1 1 A 78 78 PHE C C 78 178.114 177.342 0.772 1
1 896 . 48 1 1 A 78 78 PHE CA C 78 60.629 61.289 -0.660 1
1 897 . 48 1 1 A 78 78 PHE CB C 78 38.295 38.858 -0.563 1
1 902 . 48 1 1 A 78 78 PHE N N 78 122.682 122.615 0.067 1
1 903 . 48 1 1 A 79 79 PHE H H 79 8.890 8.061 0.829 1
1 904 . 48 1 1 A 79 79 PHE HA H 79 3.800 3.993 -0.193 1
1 912 . 48 1 1 A 79 79 PHE C C 79 178.354 178.233 0.121 1
1 913 . 48 1 1 A 79 79 PHE CA C 79 60.704 62.047 -1.343 1
1 914 . 48 1 1 A 79 79 PHE CB C 79 37.184 38.532 -1.348 1
1 920 . 48 1 1 A 79 79 PHE N N 79 121.056 117.771 3.285 1
1 921 . 48 1 1 A 80 80 GLU H H 80 7.793 8.121 -0.328 1
1 922 . 48 1 1 A 80 80 GLU HA H 80 4.082 4.049 0.033 1
1 927 . 48 1 1 A 80 80 GLU C C 80 179.068 179.402 -0.334 1
1 928 . 48 1 1 A 80 80 GLU CA C 80 59.735 59.725 0.010 1
1 929 . 48 1 1 A 80 80 GLU CB C 80 28.722 29.384 -0.662 1
1 931 . 48 1 1 A 80 80 GLU N N 80 120.312 119.178 1.134 1
1 932 . 48 1 1 A 81 81 ASN H H 81 8.624 8.732 -0.108 1
1 933 . 48 1 1 A 81 81 ASN HA H 81 4.521 4.525 -0.004 1
1 938 . 48 1 1 A 81 81 ASN C C 81 179.262 178.057 1.205 1
1 939 . 48 1 1 A 81 81 ASN CA C 81 55.504 56.602 -1.098 1
1 940 . 48 1 1 A 81 81 ASN CB C 81 37.517 38.159 -0.642 1
1 941 . 48 1 1 A 81 81 ASN N N 81 119.338 118.623 0.715 1
1 943 . 48 1 1 A 82 82 CYS H H 82 8.554 8.126 0.428 1
1 944 . 48 1 1 A 82 82 CYS HA H 82 3.792 4.071 -0.279 1
1 947 . 48 1 1 A 82 82 CYS C C 82 176.478 176.958 -0.480 1
1 948 . 48 1 1 A 82 82 CYS CA C 82 65.232 63.474 1.758 1
1 949 . 48 1 1 A 82 82 CYS CB C 82 26.762 26.976 -0.214 1
1 950 . 48 1 1 A 82 82 CYS N N 82 120.576 117.510 3.066 1
1 951 . 48 1 1 A 83 83 ARG H H 83 8.522 8.172 0.350 1
1 952 . 48 1 1 A 83 83 ARG HA H 83 3.932 4.192 -0.260 1
1 960 . 48 1 1 A 83 83 ARG C C 83 179.138 178.796 0.342 1
1 961 . 48 1 1 A 83 83 ARG CA C 83 60.443 59.104 1.339 1
1 962 . 48 1 1 A 83 83 ARG CB C 83 29.550 29.649 -0.099 1
1 965 . 48 1 1 A 83 83 ARG N N 83 123.035 119.676 3.359 1
1 967 . 48 1 1 A 84 84 ASP H H 84 7.791 8.263 -0.472 1
1 968 . 48 1 1 A 84 84 ASP HA H 84 4.353 4.405 -0.052 1
1 971 . 48 1 1 A 84 84 ASP C C 84 178.649 178.658 -0.009 1
1 972 . 48 1 1 A 84 84 ASP CA C 84 57.767 57.551 0.216 1
1 973 . 48 1 1 A 84 84 ASP CB C 84 41.305 41.631 -0.326 1
1 974 . 48 1 1 A 84 84 ASP N N 84 120.332 119.405 0.927 1
1 975 . 48 1 1 A 85 85 THR H H 85 8.370 8.186 0.184 1
1 976 . 48 1 1 A 85 85 THR HA H 85 3.730 3.950 -0.220 1
1 981 . 48 1 1 A 85 85 THR C C 85 175.198 176.454 -1.256 1
1 982 . 48 1 1 A 85 85 THR CA C 85 66.830 65.866 0.964 1
1 983 . 48 1 1 A 85 85 THR CB C 85 68.533 68.297 0.236 1
1 985 . 48 1 1 A 85 85 THR N N 85 117.360 115.643 1.717 1
1 986 . 48 1 1 A 86 86 ALA H H 86 8.845 8.447 0.398 1
1 987 . 48 1 1 A 86 86 ALA HA H 86 3.991 4.135 -0.144 1
1 991 . 48 1 1 A 86 86 ALA C C 86 179.980 180.032 -0.052 1
1 992 . 48 1 1 A 86 86 ALA CA C 86 55.769 55.674 0.095 1
1 993 . 48 1 1 A 86 86 ALA CB C 86 17.881 18.454 -0.573 1
1 994 . 48 1 1 A 86 86 ALA N N 86 123.613 122.913 0.700 1
1 995 . 48 1 1 A 87 87 LYS H H 87 7.686 8.421 -0.735 1
1 996 . 48 1 1 A 87 87 LYS HA H 87 4.099 3.971 0.128 1
1 1005 . 48 1 1 A 87 87 LYS C C 87 179.592 179.626 -0.034 1
1 1006 . 48 1 1 A 87 87 LYS CA C 87 59.708 59.783 -0.075 1
1 1007 . 48 1 1 A 87 87 LYS CB C 87 32.054 32.335 -0.281 1
1 1011 . 48 1 1 A 87 87 LYS N N 87 119.623 117.324 2.299 1
1 1012 . 48 1 1 A 88 88 ARG H H 88 7.683 7.709 -0.026 1
1 1013 . 48 1 1 A 88 88 ARG HA H 88 4.051 4.108 -0.057 1
1 1020 . 48 1 1 A 88 88 ARG C C 88 180.053 178.567 1.486 1
1 1021 . 48 1 1 A 88 88 ARG CA C 88 59.558 59.149 0.409 1
1 1022 . 48 1 1 A 88 88 ARG CB C 88 29.684 29.972 -0.288 1
1 1025 . 48 1 1 A 88 88 ARG N N 88 120.788 118.953 1.835 1
1 1026 . 48 1 1 A 89 89 ASN H H 89 8.973 8.182 0.791 1
1 1027 . 48 1 1 A 89 89 ASN HA H 89 4.354 4.618 -0.264 1
1 1032 . 48 1 1 A 89 89 ASN C C 89 178.382 178.469 -0.087 1
1 1033 . 48 1 1 A 89 89 ASN CA C 89 55.334 55.664 -0.330 1
1 1034 . 48 1 1 A 89 89 ASN CB C 89 37.864 38.235 -0.371 1
1 1035 . 48 1 1 A 89 89 ASN N N 89 121.012 117.374 3.638 1
1 1037 . 48 1 1 A 90 90 GLN H H 90 8.152 8.349 -0.197 1
1 1038 . 48 1 1 A 90 90 GLN HA H 90 4.020 4.042 -0.022 1
1 1045 . 48 1 1 A 90 90 GLN C C 90 179.075 179.217 -0.142 1
1 1046 . 48 1 1 A 90 90 GLN CA C 90 59.318 58.962 0.356 1
1 1047 . 48 1 1 A 90 90 GLN CB C 90 28.049 28.360 -0.311 1
1 1049 . 48 1 1 A 90 90 GLN N N 90 122.122 120.493 1.629 1
1 1051 . 48 1 1 A 91 91 GLN H H 91 7.514 8.194 -0.680 1
1 1052 . 48 1 1 A 91 91 GLN HA H 91 4.053 4.137 -0.084 1
1 1059 . 48 1 1 A 91 91 GLN C C 91 177.081 177.784 -0.703 1
1 1060 . 48 1 1 A 91 91 GLN CA C 91 58.031 57.648 0.383 1
1 1061 . 48 1 1 A 91 91 GLN CB C 91 28.365 27.236 1.129 1
1 1063 . 48 1 1 A 91 91 GLN N N 91 118.124 117.999 0.125 1
1 1065 . 48 1 1 A 92 92 ALA H H 92 7.704 7.645 0.059 1
1 1066 . 48 1 1 A 92 92 ALA HA H 92 4.246 4.311 -0.065 1
1 1070 . 48 1 1 A 92 92 ALA C C 92 178.450 178.067 0.383 1
1 1071 . 48 1 1 A 92 92 ALA CA C 92 52.671 52.789 -0.118 1
1 1072 . 48 1 1 A 92 92 ALA CB C 92 19.316 19.785 -0.469 1
1 1073 . 48 1 1 A 92 92 ALA N N 92 119.880 120.861 -0.981 1
1 1074 . 48 1 1 A 93 93 GLY H H 93 7.693 8.000 -0.307 1
1 1075 . 48 1 1 A 93 93 GLY HA2 H 93 3.941 3.957 -0.016 1
1 1076 . 48 1 1 A 93 93 GLY HA3 H 93 3.744 3.957 -0.213 1
1 1077 . 48 1 1 A 93 93 GLY C C 93 174.344 175.002 -0.658 1
1 1078 . 48 1 1 A 93 93 GLY CA C 93 45.949 46.333 -0.384 1
1 1079 . 48 1 1 A 93 93 GLY N N 93 105.347 106.087 -0.740 1
1 1080 . 48 1 1 A 94 94 ASN H H 94 7.076 8.207 -1.131 1
1 1081 . 48 1 1 A 94 94 ASN HA H 94 4.115 4.524 -0.409 1
1 1085 . 48 1 1 A 94 94 ASN C C 94 175.410 175.593 -0.183 1
1 1086 . 48 1 1 A 94 94 ASN CA C 94 52.651 52.642 0.009 1
1 1087 . 48 1 1 A 94 94 ASN CB C 94 38.330 39.595 -1.265 1
1 1088 . 48 1 1 A 94 94 ASN N N 94 115.747 116.301 -0.554 1
1 1090 . 48 1 1 A 95 95 GLY H H 95 8.236 8.408 -0.172 1
1 1091 . 48 1 1 A 95 95 GLY HA2 H 95 3.633 3.634 -0.001 1
1 1092 . 48 1 1 A 95 95 GLY HA3 H 95 3.633 3.824 -0.191 1
1 1093 . 48 1 1 A 95 95 GLY C C 95 174.450 173.685 0.765 1
1 1094 . 48 1 1 A 95 95 GLY CA C 95 45.522 45.417 0.105 1
1 1095 . 48 1 1 A 95 95 GLY N N 95 109.166 107.698 1.468 1
1 1096 . 48 1 1 A 96 96 TRP H H 96 7.899 7.725 0.174 1
1 1097 . 48 1 1 A 96 96 TRP HA H 96 5.241 5.063 0.178 1
1 1106 . 48 1 1 A 96 96 TRP C C 96 175.661 175.870 -0.209 1
1 1107 . 48 1 1 A 96 96 TRP CA C 96 55.090 56.550 -1.460 1
1 1108 . 48 1 1 A 96 96 TRP CB C 96 27.138 31.788 -4.650 1
1 1114 . 48 1 1 A 96 96 TRP N N 96 122.840 120.267 2.573 1
1 1116 . 48 1 1 A 97 97 ASP H H 97 7.344 9.039 -1.695 1
1 1117 . 48 1 1 A 97 97 ASP HA H 97 4.829 4.377 0.452 1
1 1120 . 48 1 1 A 97 97 ASP C C 97 175.019 176.042 -1.023 1
1 1121 . 48 1 1 A 97 97 ASP CA C 97 52.149 56.362 -4.213 1
1 1122 . 48 1 1 A 97 97 ASP CB C 97 42.697 38.635 4.062 1
1 1123 . 48 1 1 A 97 97 ASP N N 97 126.861 117.208 9.653 1
1 1124 . 48 1 1 A 98 98 PHE H H 98 8.566 8.506 0.060 1
1 1125 . 48 1 1 A 98 98 PHE HA H 98 3.727 4.232 -0.505 1
1 1133 . 48 1 1 A 98 98 PHE C C 98 177.443 177.502 -0.059 1
1 1134 . 48 1 1 A 98 98 PHE CA C 98 62.471 61.222 1.249 1
1 1135 . 48 1 1 A 98 98 PHE CB C 98 39.919 39.890 0.029 1
1 1141 . 48 1 1 A 98 98 PHE N N 98 117.781 121.012 -3.231 1
1 1142 . 48 1 1 A 99 99 ASP H H 99 8.259 8.223 0.036 1
1 1143 . 48 1 1 A 99 99 ASP HA H 99 3.960 4.854 -0.894 1
1 1146 . 48 1 1 A 99 99 ASP C C 99 178.132 178.961 -0.829 1
1 1147 . 48 1 1 A 99 99 ASP CA C 99 57.658 56.446 1.212 1
1 1148 . 48 1 1 A 99 99 ASP CB C 99 38.572 40.811 -2.239 1
1 1149 . 48 1 1 A 99 99 ASP N N 99 121.709 119.440 2.269 1
1 1150 . 48 1 1 A 100 100 MET H H 100 8.008 8.182 -0.174 1
1 1151 . 48 1 1 A 100 100 MET HA H 100 3.644 4.550 -0.906 1
1 1156 . 48 1 1 A 100 100 MET C C 100 180.008 176.341 3.667 1
1 1157 . 48 1 1 A 100 100 MET CA C 100 58.598 57.733 0.865 1
1 1158 . 48 1 1 A 100 100 MET CB C 100 33.423 33.218 0.205 1
1 1160 . 48 1 1 A 100 100 MET N N 100 119.668 116.566 3.102 1
1 1161 . 48 1 1 A 101 101 LEU H H 101 7.961 7.901 0.060 1
1 1162 . 48 1 1 A 101 101 LEU HA H 101 3.523 4.736 -1.213 1
1 1172 . 48 1 1 A 101 101 LEU C C 101 173.873 176.058 -2.185 1
1 1173 . 48 1 1 A 101 101 LEU CA C 101 58.743 53.635 5.108 1
1 1174 . 48 1 1 A 101 101 LEU CB C 101 42.632 44.048 -1.416 1
1 1178 . 48 1 1 A 101 101 LEU N N 101 119.752 120.159 -0.407 1
1 1179 . 48 1 1 A 102 102 THR H H 102 6.955 8.588 -1.633 1
1 1180 . 48 1 1 A 102 102 THR HA H 102 4.134 4.698 -0.564 1
1 1185 . 48 1 1 A 102 102 THR C C 102 176.513 174.457 2.056 1
1 1186 . 48 1 1 A 102 102 THR CA C 102 61.125 63.779 -2.654 1
1 1187 . 48 1 1 A 102 102 THR CB C 102 71.415 67.612 3.803 1
1 1189 . 48 1 1 A 102 102 THR N N 102 124.665 119.015 5.650 1
1 1190 . 48 1 1 A 103 103 GLY H H 103 7.816 8.896 -1.080 1
1 1191 . 48 1 1 A 103 103 GLY HA2 H 103 3.824 4.153 -0.329 1
1 1192 . 48 1 1 A 103 103 GLY HA3 H 103 3.824 4.248 -0.424 1
1 1193 . 48 1 1 A 103 103 GLY C C 103 174.126 172.993 1.133 1
1 1194 . 48 1 1 A 103 103 GLY CA C 103 47.805 45.706 2.099 1
1 1195 . 48 1 1 A 103 103 GLY N N 103 114.191 111.228 2.963 1
1 1196 . 48 1 1 A 104 104 SER H H 104 8.860 8.681 0.179 1
1 1197 . 48 1 1 A 104 104 SER HA H 104 4.758 4.675 0.083 1
1 1200 . 48 1 1 A 104 104 SER C C 104 174.591 174.736 -0.145 1
1 1201 . 48 1 1 A 104 104 SER CA C 104 56.755 56.711 0.044 1
1 1202 . 48 1 1 A 104 104 SER CB C 104 65.050 64.595 0.455 1
1 1203 . 48 1 1 A 104 104 SER N N 104 114.771 115.791 -1.020 1
1 1204 . 48 1 1 A 105 105 GLY H H 105 8.788 8.654 0.134 1
1 1205 . 48 1 1 A 105 105 GLY HA2 H 105 3.733 3.799 -0.066 1
1 1206 . 48 1 1 A 105 105 GLY HA3 H 105 3.733 3.815 -0.082 1
1 1207 . 48 1 1 A 105 105 GLY CA C 105 47.247 46.799 0.448 1
1 1208 . 48 1 1 A 105 105 GLY N N 105 110.394 108.156 2.238 1
1 1209 . 48 1 1 A 106 106 ASN HA H 106 4.454 4.605 -0.151 1
1 1212 . 48 1 1 A 106 106 ASN C C 106 175.180 175.713 -0.533 1
1 1213 . 48 1 1 A 106 106 ASN CA C 106 54.492 54.605 -0.113 1
1 1214 . 48 1 1 A 106 106 ASN CB C 106 37.282 39.828 -2.546 1
1 1215 . 48 1 1 A 107 107 TYR H H 107 8.241 7.629 0.612 1
1 1216 . 48 1 1 A 107 107 TYR HA H 107 4.335 4.645 -0.310 1
1 1223 . 48 1 1 A 107 107 TYR C C 107 173.954 175.927 -1.973 1
1 1224 . 48 1 1 A 107 107 TYR CA C 107 57.727 59.344 -1.617 1
1 1225 . 48 1 1 A 107 107 TYR CB C 107 37.063 39.675 -2.612 1
1 1230 . 48 1 1 A 107 107 TYR N N 107 120.708 114.862 5.846 1
1 1231 . 48 1 1 A 108 108 SER H H 108 7.117 7.901 -0.784 1
1 1232 . 48 1 1 A 108 108 SER HA H 108 4.221 4.299 -0.078 1
1 1235 . 48 1 1 A 108 108 SER C C 108 174.834 172.991 1.843 1
1 1236 . 48 1 1 A 108 108 SER CA C 108 59.859 59.741 0.118 1
1 1237 . 48 1 1 A 108 108 SER CB C 108 63.846 62.032 1.814 1
1 1238 . 48 1 1 A 108 108 SER N N 108 113.362 113.088 0.274 1
1 1239 . 48 1 1 A 109 109 SER H H 109 8.053 7.804 0.249 1
1 1240 . 48 1 1 A 109 109 SER HA H 109 4.560 4.556 0.004 1
1 1243 . 48 1 1 A 109 109 SER CA C 109 57.141 56.844 0.297 1
1 1244 . 48 1 1 A 109 109 SER CB C 109 64.874 64.945 -0.071 1
1 1245 . 48 1 1 A 109 109 SER N N 109 116.657 115.456 1.201 1
1 1246 . 48 1 1 A 110 110 THR HA H 110 3.541 3.831 -0.290 1
1 1251 . 48 1 1 A 110 110 THR C C 110 175.477 175.978 -0.501 1
1 1252 . 48 1 1 A 110 110 THR CA C 110 66.443 65.793 0.650 1
1 1253 . 48 1 1 A 110 110 THR CB C 110 68.091 68.455 -0.364 1
1 1255 . 48 1 1 A 111 111 ASP H H 111 8.224 8.275 -0.051 1
1 1256 . 48 1 1 A 111 111 ASP HA H 111 4.237 4.160 0.077 1
1 1259 . 48 1 1 A 111 111 ASP C C 111 177.520 178.317 -0.797 1
1 1260 . 48 1 1 A 111 111 ASP CA C 111 57.559 57.331 0.228 1
1 1261 . 48 1 1 A 111 111 ASP CB C 111 40.292 40.211 0.081 1
1 1262 . 48 1 1 A 111 111 ASP N N 111 119.490 120.068 -0.578 1
1 1263 . 48 1 1 A 112 112 ALA H H 112 7.431 8.008 -0.577 1
1 1264 . 48 1 1 A 112 112 ALA HA H 112 4.191 3.996 0.195 1
1 1268 . 48 1 1 A 112 112 ALA C C 112 180.646 179.557 1.089 1
1 1269 . 48 1 1 A 112 112 ALA CA C 112 54.534 54.997 -0.463 1
1 1270 . 48 1 1 A 112 112 ALA CB C 112 18.992 18.777 0.215 1
1 1271 . 48 1 1 A 112 112 ALA N N 112 119.710 122.852 -3.142 1
1 1272 . 48 1 1 A 113 113 GLN H H 113 7.576 7.427 0.149 1
1 1273 . 48 1 1 A 113 113 GLN HA H 113 3.562 4.082 -0.520 1
1 1278 . 48 1 1 A 113 113 GLN C C 113 176.756 177.838 -1.082 1
1 1279 . 48 1 1 A 113 113 GLN CA C 113 57.736 58.714 -0.978 1
1 1280 . 48 1 1 A 113 113 GLN CB C 113 29.110 28.245 0.865 1
1 1281 . 48 1 1 A 113 113 GLN N N 113 117.518 118.105 -0.587 1
1 1283 . 48 1 1 A 114 114 MET H H 114 8.192 8.239 -0.047 1
1 1284 . 48 1 1 A 114 114 MET HA H 114 4.231 3.875 0.356 1
1 1289 . 48 1 1 A 114 114 MET C C 114 175.648 178.108 -2.460 1
1 1290 . 48 1 1 A 114 114 MET CA C 114 57.446 58.666 -1.220 1
1 1291 . 48 1 1 A 114 114 MET CB C 114 33.570 31.876 1.694 1
1 1293 . 48 1 1 A 114 114 MET N N 114 111.509 118.931 -7.422 1
1 1294 . 48 1 1 A 115 115 GLN H H 115 6.940 7.329 -0.389 1
1 1295 . 48 1 1 A 115 115 GLN HA H 115 4.307 4.139 0.168 1
1 1302 . 48 1 1 A 115 115 GLN C C 115 176.270 175.850 0.420 1
1 1303 . 48 1 1 A 115 115 GLN CA C 115 54.680 58.627 -3.947 1
1 1304 . 48 1 1 A 115 115 GLN CB C 115 28.233 28.924 -0.691 1
1 1306 . 48 1 1 A 115 115 GLN N N 115 114.300 117.259 -2.959 1
1 1308 . 48 1 1 A 116 116 TYR H H 116 6.677 7.962 -1.285 1
1 1309 . 48 1 1 A 116 116 TYR HA H 116 4.193 4.297 -0.104 1
1 1312 . 48 1 1 A 116 116 TYR C C 116 175.268 174.339 0.929 1
1 1313 . 48 1 1 A 116 116 TYR CA C 116 54.357 58.777 -4.420 1
1 1314 . 48 1 1 A 116 116 TYR CB C 116 35.498 36.640 -1.142 1
1 1315 . 48 1 1 A 116 116 TYR N N 116 117.919 119.050 -1.131 1
1 1316 . 48 1 1 A 117 117 ASP H H 117 8.081 8.130 -0.049 1
1 1317 . 48 1 1 A 117 117 ASP HA H 117 4.665 4.884 -0.219 1
1 1320 . 48 1 1 A 117 117 ASP CA C 117 52.422 50.860 1.562 1
1 1321 . 48 1 1 A 117 117 ASP CB C 117 42.416 41.079 1.337 1
1 1322 . 48 1 1 A 117 117 ASP N N 117 120.887 121.083 -0.196 1
1 1323 . 48 1 1 A 118 118 PRO C C 118 179.180 179.131 0.049 1
1 1324 . 48 1 1 A 118 118 PRO CA C 118 65.942 65.703 0.239 1
1 1325 . 48 1 1 A 118 118 PRO CB C 118 32.197 31.644 0.553 1
1 1326 . 48 1 1 A 119 119 GLY H H 119 9.742 8.464 1.278 1
1 1327 . 48 1 1 A 119 119 GLY C C 119 175.622 175.508 0.114 1
1 1328 . 48 1 1 A 119 119 GLY CA C 119 46.785 46.961 -0.176 1
1 1329 . 48 1 1 A 119 119 GLY N N 119 106.412 106.160 0.252 1
1 1330 . 48 1 1 A 120 120 LEU H H 120 6.666 7.466 -0.800 1
1 1331 . 48 1 1 A 120 120 LEU HA H 120 3.365 3.734 -0.369 1
1 1341 . 48 1 1 A 120 120 LEU C C 120 179.262 178.564 0.698 1
1 1342 . 48 1 1 A 120 120 LEU CA C 120 56.605 56.993 -0.388 1
1 1343 . 48 1 1 A 120 120 LEU CB C 120 39.262 41.146 -1.884 1
1 1347 . 48 1 1 A 120 120 LEU N N 120 126.226 122.484 3.742 1
1 1348 . 48 1 1 A 121 121 PHE H H 121 7.356 8.697 -1.341 1
1 1349 . 48 1 1 A 121 121 PHE HA H 121 4.459 4.003 0.456 1
1 1352 . 48 1 1 A 121 121 PHE C C 121 179.716 178.208 1.508 1
1 1353 . 48 1 1 A 121 121 PHE CA C 121 62.838 62.040 0.798 1
1 1354 . 48 1 1 A 121 121 PHE CB C 121 37.603 39.334 -1.731 1
1 1355 . 48 1 1 A 121 121 PHE N N 121 117.437 119.090 -1.653 1
1 1356 . 48 1 1 A 122 122 ALA H H 122 7.926 8.375 -0.449 1
1 1357 . 48 1 1 A 122 122 ALA HA H 122 4.523 3.832 0.691 1
1 1361 . 48 1 1 A 122 122 ALA C C 122 180.435 179.824 0.611 1
1 1362 . 48 1 1 A 122 122 ALA CA C 122 55.527 55.145 0.382 1
1 1363 . 48 1 1 A 122 122 ALA CB C 122 17.814 18.146 -0.332 1
1 1364 . 48 1 1 A 122 122 ALA N N 122 121.068 121.403 -0.335 1
1 1365 . 48 1 1 A 123 123 GLN H H 123 7.507 8.278 -0.771 1
1 1366 . 48 1 1 A 123 123 GLN HA H 123 4.153 3.874 0.279 1
1 1371 . 48 1 1 A 123 123 GLN C C 123 180.561 178.534 2.027 1
1 1372 . 48 1 1 A 123 123 GLN CA C 123 59.948 59.110 0.838 1
1 1373 . 48 1 1 A 123 123 GLN CB C 123 29.135 28.192 0.943 1
1 1375 . 48 1 1 A 123 123 GLN N N 123 120.324 117.729 2.595 1
1 1376 . 48 1 1 A 124 124 ILE H H 124 8.318 8.137 0.181 1
1 1377 . 48 1 1 A 124 124 ILE HA H 124 3.635 3.923 -0.288 1
1 1387 . 48 1 1 A 124 124 ILE C C 124 176.481 178.169 -1.688 1
1 1388 . 48 1 1 A 124 124 ILE CA C 124 66.432 64.368 2.064 1
1 1389 . 48 1 1 A 124 124 ILE CB C 124 39.168 37.817 1.351 1
1 1393 . 48 1 1 A 124 124 ILE N N 124 123.747 118.281 5.466 1
1 1394 . 48 1 1 A 125 125 GLN H H 125 8.474 7.908 0.566 1
1 1395 . 48 1 1 A 125 125 GLN HA H 125 4.264 3.867 0.397 1
1 1402 . 48 1 1 A 125 125 GLN C C 125 178.947 177.765 1.182 1
1 1403 . 48 1 1 A 125 125 GLN CA C 125 59.651 58.519 1.132 1
1 1404 . 48 1 1 A 125 125 GLN CB C 125 28.880 28.497 0.383 1
1 1406 . 48 1 1 A 125 125 GLN N N 125 120.368 121.145 -0.777 1
1 1408 . 48 1 1 A 126 126 ALA H H 126 8.002 8.213 -0.211 1
1 1409 . 48 1 1 A 126 126 ALA HA H 126 4.144 4.031 0.113 1
1 1413 . 48 1 1 A 126 126 ALA C C 126 179.316 179.600 -0.284 1
1 1414 . 48 1 1 A 126 126 ALA CA C 126 55.036 54.944 0.092 1
1 1415 . 48 1 1 A 126 126 ALA CB C 126 18.087 18.102 -0.015 1
1 1416 . 48 1 1 A 126 126 ALA N N 126 121.661 121.197 0.464 1
1 1417 . 48 1 1 A 127 127 ALA H H 127 7.823 8.128 -0.305 1
1 1418 . 48 1 1 A 127 127 ALA HA H 127 4.162 4.016 0.146 1
1 1422 . 48 1 1 A 127 127 ALA C C 127 180.707 179.358 1.349 1
1 1423 . 48 1 1 A 127 127 ALA CA C 127 55.080 54.847 0.233 1
1 1424 . 48 1 1 A 127 127 ALA CB C 127 19.354 18.407 0.947 1
1 1425 . 48 1 1 A 127 127 ALA N N 127 119.853 119.773 0.080 1
1 1426 . 48 1 1 A 128 128 ALA H H 128 8.936 7.727 1.209 1
1 1427 . 48 1 1 A 128 128 ALA HA H 128 3.928 3.616 0.312 1
1 1431 . 48 1 1 A 128 128 ALA C C 128 181.031 179.234 1.797 1
1 1432 . 48 1 1 A 128 128 ALA CA C 128 55.502 54.545 0.957 1
1 1433 . 48 1 1 A 128 128 ALA CB C 128 16.609 17.624 -1.015 1
1 1434 . 48 1 1 A 128 128 ALA N N 128 121.355 120.197 1.158 1
1 1435 . 48 1 1 A 129 129 THR H H 129 8.543 7.441 1.102 1
1 1436 . 48 1 1 A 129 129 THR HA H 129 4.015 3.599 0.416 1
1 1441 . 48 1 1 A 129 129 THR C C 129 177.332 175.903 1.429 1
1 1442 . 48 1 1 A 129 129 THR CA C 129 65.893 64.747 1.146 1
1 1443 . 48 1 1 A 129 129 THR CB C 129 68.566 68.498 0.068 1
1 1445 . 48 1 1 A 129 129 THR N N 129 112.709 112.136 0.573 1
1 1446 . 48 1 1 A 130 130 LYS H H 130 8.126 7.549 0.577 1
1 1447 . 48 1 1 A 130 130 LYS HA H 130 4.000 3.964 0.036 1
1 1456 . 48 1 1 A 130 130 LYS C C 130 179.082 178.545 0.537 1
1 1457 . 48 1 1 A 130 130 LYS CA C 130 60.299 58.780 1.519 1
1 1458 . 48 1 1 A 130 130 LYS CB C 130 32.767 32.143 0.624 1
1 1462 . 48 1 1 A 130 130 LYS N N 130 123.879 120.514 3.365 1
1 1463 . 48 1 1 A 131 131 ALA H H 131 7.184 7.779 -0.595 1
1 1464 . 48 1 1 A 131 131 ALA HA H 131 4.005 4.244 -0.239 1
1 1468 . 48 1 1 A 131 131 ALA C C 131 178.482 179.560 -1.078 1
1 1469 . 48 1 1 A 131 131 ALA CA C 131 55.027 55.103 -0.076 1
1 1470 . 48 1 1 A 131 131 ALA CB C 131 18.669 19.628 -0.959 1
1 1471 . 48 1 1 A 131 131 ALA N N 131 118.590 120.790 -2.200 1
1 1472 . 48 1 1 A 132 132 TRP H H 132 7.977 8.643 -0.666 1
1 1473 . 48 1 1 A 132 132 TRP HA H 132 4.001 3.970 0.031 1
1 1480 . 48 1 1 A 132 132 TRP C C 132 177.332 175.649 1.683 1
1 1481 . 48 1 1 A 132 132 TRP CA C 132 60.431 57.219 3.212 1
1 1482 . 48 1 1 A 132 132 TRP CB C 132 27.786 27.491 0.295 1
1 1486 . 48 1 1 A 132 132 TRP N N 132 119.168 116.977 2.191 1
1 1488 . 48 1 1 A 133 133 ARG H H 133 8.006 8.284 -0.278 1
1 1489 . 48 1 1 A 133 133 ARG HA H 133 4.027 4.424 -0.397 1
1 1497 . 48 1 1 A 133 133 ARG C C 133 176.664 178.146 -1.482 1
1 1498 . 48 1 1 A 133 133 ARG CA C 133 59.355 57.291 2.064 1
1 1499 . 48 1 1 A 133 133 ARG CB C 133 30.451 32.506 -2.055 1
1 1502 . 48 1 1 A 133 133 ARG N N 133 113.062 120.674 -7.612 1
1 1504 . 48 1 1 A 134 134 LYS H H 134 7.322 7.799 -0.477 1
1 1505 . 48 1 1 A 134 134 LYS HA H 134 4.313 4.321 -0.008 1
1 1514 . 48 1 1 A 134 134 LYS C C 134 176.282 176.824 -0.542 1
1 1515 . 48 1 1 A 134 134 LYS CA C 134 54.922 57.289 -2.367 1
1 1516 . 48 1 1 A 134 134 LYS CB C 134 32.633 32.049 0.584 1
1 1520 . 48 1 1 A 134 134 LYS N N 134 118.170 115.914 2.256 1
1 1521 . 48 1 1 A 135 135 LEU H H 135 7.440 7.490 -0.050 1
1 1522 . 48 1 1 A 135 135 LEU HA H 135 4.174 4.756 -0.582 1
1 1532 . 48 1 1 A 135 135 LEU CA C 135 54.408 52.752 1.656 1
1 1533 . 48 1 1 A 135 135 LEU CB C 135 40.407 42.587 -2.180 1
1 1537 . 48 1 1 A 135 135 LEU N N 135 123.358 116.515 6.843 1
1 1538 . 48 1 1 A 136 136 PRO HA H 136 4.437 4.354 0.083 1
1 1545 . 48 1 1 A 136 136 PRO C C 136 177.106 177.025 0.081 1
1 1546 . 48 1 1 A 136 136 PRO CA C 136 62.889 65.445 -2.556 1
1 1547 . 48 1 1 A 136 136 PRO CB C 136 32.192 31.899 0.293 1
1 1550 . 48 1 1 A 137 137 VAL H H 137 8.219 7.759 0.460 1
1 1551 . 48 1 1 A 137 137 VAL HA H 137 4.077 4.143 -0.066 1
1 1559 . 48 1 1 A 137 137 VAL C C 137 176.305 176.484 -0.179 1
1 1560 . 48 1 1 A 137 137 VAL CA C 137 61.958 61.691 0.267 1
1 1561 . 48 1 1 A 137 137 VAL CB C 137 32.755 32.618 0.137 1
1 1564 . 48 1 1 A 137 137 VAL N N 137 120.079 116.744 3.335 1
1 1565 . 48 1 1 A 138 138 LYS H H 138 8.444 8.922 -0.478 1
1 1566 . 48 1 1 A 138 138 LYS HA H 138 4.316 3.986 0.330 1
1 1575 . 48 1 1 A 138 138 LYS C C 138 176.790 176.384 0.406 1
1 1576 . 48 1 1 A 138 138 LYS CA C 138 56.792 58.434 -1.642 1
1 1577 . 48 1 1 A 138 138 LYS CB C 138 33.205 32.628 0.577 1
1 1581 . 48 1 1 A 138 138 LYS N N 138 126.449 130.306 -3.857 1
1 1582 . 48 1 1 A 139 139 GLY H H 139 8.518 7.762 0.756 1
1 1583 . 48 1 1 A 139 139 GLY HA2 H 139 4.070 4.003 0.067 1
1 1584 . 48 1 1 A 139 139 GLY HA3 H 139 3.897 4.014 -0.117 1
1 1585 . 48 1 1 A 139 139 GLY C C 139 172.874 172.947 -0.073 1
1 1586 . 48 1 1 A 139 139 GLY CA C 139 45.157 45.440 -0.283 1
1 1587 . 48 1 1 A 139 139 GLY N N 139 112.617 106.323 6.294 1
1 6 . 49 1 1 A 2 2 VAL H H 2 8.992 7.698 1.294 1
1 7 . 49 1 1 A 2 2 VAL HA H 2 5.370 5.107 0.263 1
1 15 . 49 1 1 A 2 2 VAL C C 2 174.325 173.734 0.591 1
1 16 . 49 1 1 A 2 2 VAL CA C 2 61.267 60.470 0.797 1
1 17 . 49 1 1 A 2 2 VAL CB C 2 33.890 36.157 -2.267 1
1 20 . 49 1 1 A 2 2 VAL N N 2 126.939 119.532 7.407 1
1 21 . 49 1 1 A 3 3 THR H H 3 8.912 8.910 0.002 1
1 22 . 49 1 1 A 3 3 THR HA H 3 4.505 5.467 -0.962 1
1 27 . 49 1 1 A 3 3 THR C C 3 172.710 172.920 -0.210 1
1 28 . 49 1 1 A 3 3 THR CA C 3 59.689 59.733 -0.044 1
1 29 . 49 1 1 A 3 3 THR CB C 3 72.398 72.116 0.282 1
1 31 . 49 1 1 A 3 3 THR N N 3 118.091 122.157 -4.066 1
1 32 . 49 1 1 A 4 4 GLU H H 4 8.631 9.105 -0.474 1
1 33 . 49 1 1 A 4 4 GLU HA H 4 5.788 4.973 0.815 1
1 38 . 49 1 1 A 4 4 GLU C C 4 175.758 174.283 1.475 1
1 39 . 49 1 1 A 4 4 GLU CA C 4 54.902 54.137 0.765 1
1 40 . 49 1 1 A 4 4 GLU CB C 4 35.097 34.027 1.070 1
1 42 . 49 1 1 A 4 4 GLU N N 4 120.966 125.562 -4.596 1
1 43 . 49 1 1 A 5 5 THR H H 5 9.188 8.685 0.503 1
1 44 . 49 1 1 A 5 5 THR HA H 5 4.739 4.884 -0.145 1
1 49 . 49 1 1 A 5 5 THR C C 5 172.757 172.560 0.197 1
1 50 . 49 1 1 A 5 5 THR CA C 5 60.382 60.007 0.375 1
1 51 . 49 1 1 A 5 5 THR CB C 5 71.558 71.620 -0.062 1
1 53 . 49 1 1 A 5 5 THR N N 5 119.366 114.651 4.715 1
1 54 . 49 1 1 A 6 6 VAL H H 6 8.476 8.806 -0.330 1
1 55 . 49 1 1 A 6 6 VAL HA H 6 5.026 5.818 -0.792 1
1 63 . 49 1 1 A 6 6 VAL C C 6 176.674 173.827 2.847 1
1 64 . 49 1 1 A 6 6 VAL CA C 6 61.008 60.453 0.555 1
1 65 . 49 1 1 A 6 6 VAL CB C 6 33.861 33.990 -0.129 1
1 68 . 49 1 1 A 6 6 VAL N N 6 121.384 121.003 0.381 1
1 69 . 49 1 1 A 7 7 ASP H H 7 8.848 8.624 0.224 1
1 70 . 49 1 1 A 7 7 ASP HA H 7 4.797 4.977 -0.180 1
1 73 . 49 1 1 A 7 7 ASP CA C 7 52.834 53.337 -0.503 1
1 74 . 49 1 1 A 7 7 ASP CB C 7 42.219 42.809 -0.590 1
1 75 . 49 1 1 A 7 7 ASP N N 7 127.061 128.109 -1.048 1
1 76 . 49 1 1 A 8 8 GLY C C 8 175.143 175.236 -0.093 1
1 77 . 49 1 1 A 8 8 GLY CA C 8 46.553 47.256 -0.703 1
1 78 . 49 1 1 A 9 9 GLN H H 9 8.408 7.911 0.497 1
1 79 . 49 1 1 A 9 9 GLN HA H 9 4.541 4.229 0.312 1
1 86 . 49 1 1 A 9 9 GLN C C 9 176.463 177.102 -0.639 1
1 87 . 49 1 1 A 9 9 GLN CA C 9 55.167 55.276 -0.109 1
1 88 . 49 1 1 A 9 9 GLN CB C 9 29.376 27.626 1.750 1
1 90 . 49 1 1 A 9 9 GLN N N 9 118.300 118.867 -0.567 1
1 92 . 49 1 1 A 10 10 GLY H H 10 8.162 8.109 0.053 1
1 93 . 49 1 1 A 10 10 GLY HA2 H 10 4.174 3.950 0.224 1
1 94 . 49 1 1 A 10 10 GLY HA3 H 10 3.521 3.961 -0.440 1
1 95 . 49 1 1 A 10 10 GLY C C 10 174.092 173.957 0.135 1
1 96 . 49 1 1 A 10 10 GLY CA C 10 45.558 46.266 -0.708 1
1 97 . 49 1 1 A 10 10 GLY N N 10 108.747 110.710 -1.963 1
1 98 . 49 1 1 A 11 11 GLN H H 11 8.507 7.355 1.152 1
1 99 . 49 1 1 A 11 11 GLN HA H 11 4.202 4.856 -0.654 1
1 106 . 49 1 1 A 11 11 GLN C C 11 173.992 174.493 -0.501 1
1 107 . 49 1 1 A 11 11 GLN CA C 11 55.098 54.023 1.075 1
1 108 . 49 1 1 A 11 11 GLN CB C 11 29.097 32.030 -2.933 1
1 110 . 49 1 1 A 11 11 GLN N N 11 122.979 115.862 7.117 1
1 112 . 49 1 1 A 12 12 ALA H H 12 8.259 8.611 -0.352 1
1 113 . 49 1 1 A 12 12 ALA HA H 12 5.156 5.559 -0.403 1
1 117 . 49 1 1 A 12 12 ALA C C 12 177.284 176.247 1.037 1
1 118 . 49 1 1 A 12 12 ALA CA C 12 51.087 50.631 0.456 1
1 119 . 49 1 1 A 12 12 ALA CB C 12 20.500 20.953 -0.453 1
1 120 . 49 1 1 A 12 12 ALA N N 12 127.100 121.751 5.349 1
1 121 . 49 1 1 A 13 13 TRP H H 13 9.245 8.714 0.531 1
1 122 . 49 1 1 A 13 13 TRP HA H 13 4.717 5.256 -0.539 1
1 131 . 49 1 1 A 13 13 TRP C C 13 175.108 174.266 0.842 1
1 132 . 49 1 1 A 13 13 TRP CA C 13 55.966 55.507 0.459 1
1 133 . 49 1 1 A 13 13 TRP CB C 13 31.912 31.977 -0.065 1
1 139 . 49 1 1 A 13 13 TRP N N 13 123.088 119.732 3.356 1
1 141 . 49 1 1 A 14 14 ARG H H 14 8.575 8.667 -0.092 1
1 142 . 49 1 1 A 14 14 ARG HA H 14 5.335 4.101 1.234 1
1 150 . 49 1 1 A 14 14 ARG C C 14 175.191 174.081 1.110 1
1 151 . 49 1 1 A 14 14 ARG CA C 14 53.106 54.956 -1.850 1
1 152 . 49 1 1 A 14 14 ARG CB C 14 32.749 31.448 1.301 1
1 154 . 49 1 1 A 14 14 ARG N N 14 121.163 119.653 1.510 1
1 156 . 49 1 1 A 15 15 HIS H H 15 8.595 7.936 0.659 1
1 157 . 49 1 1 A 15 15 HIS HA H 15 4.790 5.040 -0.250 1
1 161 . 49 1 1 A 15 15 HIS C C 15 173.770 173.839 -0.069 1
1 162 . 49 1 1 A 15 15 HIS CA C 15 55.289 54.491 0.798 1
1 163 . 49 1 1 A 15 15 HIS CB C 15 33.208 33.769 -0.561 1
1 165 . 49 1 1 A 15 15 HIS N N 15 117.643 118.911 -1.268 1
1 166 . 49 1 1 A 16 16 HIS H H 16 8.993 8.708 0.285 1
1 167 . 49 1 1 A 16 16 HIS HA H 16 5.158 5.155 0.003 1
1 171 . 49 1 1 A 16 16 HIS C C 16 173.608 175.244 -1.636 1
1 172 . 49 1 1 A 16 16 HIS CA C 16 56.450 54.947 1.503 1
1 173 . 49 1 1 A 16 16 HIS CB C 16 34.171 31.856 2.315 1
1 175 . 49 1 1 A 16 16 HIS N N 16 123.520 118.140 5.380 1
1 176 . 49 1 1 A 17 17 ASN H H 17 7.829 9.245 -1.416 1
1 177 . 49 1 1 A 17 17 ASN HA H 17 4.713 5.344 -0.631 1
1 182 . 49 1 1 A 17 17 ASN C C 17 173.682 175.616 -1.934 1
1 183 . 49 1 1 A 17 17 ASN CA C 17 51.822 51.698 0.124 1
1 184 . 49 1 1 A 17 17 ASN CB C 17 43.176 41.629 1.547 1
1 185 . 49 1 1 A 17 17 ASN N N 17 122.213 119.814 2.399 1
1 187 . 49 1 1 A 18 18 GLY H H 18 8.423 8.411 0.012 1
1 188 . 49 1 1 A 18 18 GLY HA2 H 18 3.931 3.771 0.160 1
1 189 . 49 1 1 A 18 18 GLY HA3 H 18 3.707 3.975 -0.268 1
1 190 . 49 1 1 A 18 18 GLY C C 18 173.985 173.072 0.913 1
1 191 . 49 1 1 A 18 18 GLY CA C 18 43.949 45.333 -1.384 1
1 192 . 49 1 1 A 18 18 GLY N N 18 106.991 107.970 -0.979 1
1 193 . 49 1 1 A 19 19 PHE H H 19 8.338 8.257 0.081 1
1 194 . 49 1 1 A 19 19 PHE HA H 19 4.068 4.711 -0.643 1
1 197 . 49 1 1 A 19 19 PHE C C 19 176.568 174.951 1.617 1
1 198 . 49 1 1 A 19 19 PHE CA C 19 59.338 58.902 0.436 1
1 199 . 49 1 1 A 19 19 PHE CB C 19 40.201 39.177 1.024 1
1 200 . 49 1 1 A 19 19 PHE N N 19 116.857 120.813 -3.956 1
1 201 . 49 1 1 A 20 20 ASP H H 20 8.794 8.964 -0.170 1
1 202 . 49 1 1 A 20 20 ASP HA H 20 4.485 4.762 -0.277 1
1 205 . 49 1 1 A 20 20 ASP C C 20 177.379 177.108 0.271 1
1 206 . 49 1 1 A 20 20 ASP CA C 20 54.140 55.024 -0.884 1
1 207 . 49 1 1 A 20 20 ASP CB C 20 41.915 41.121 0.794 1
1 208 . 49 1 1 A 20 20 ASP N N 20 123.025 125.458 -2.433 1
1 209 . 49 1 1 A 21 21 PHE H H 21 8.862 9.169 -0.307 1
1 210 . 49 1 1 A 21 21 PHE HA H 21 4.087 4.129 -0.042 1
1 218 . 49 1 1 A 21 21 PHE C C 21 176.952 177.283 -0.331 1
1 219 . 49 1 1 A 21 21 PHE CA C 21 61.095 62.351 -1.256 1
1 220 . 49 1 1 A 21 21 PHE CB C 21 38.678 39.294 -0.616 1
1 226 . 49 1 1 A 21 21 PHE N N 21 127.163 125.481 1.682 1
1 227 . 49 1 1 A 22 22 ALA H H 22 8.561 8.343 0.218 1
1 228 . 49 1 1 A 22 22 ALA HA H 22 3.878 4.020 -0.142 1
1 232 . 49 1 1 A 22 22 ALA C C 22 180.710 179.839 0.871 1
1 233 . 49 1 1 A 22 22 ALA CA C 22 55.211 55.233 -0.022 1
1 234 . 49 1 1 A 22 22 ALA CB C 22 18.321 18.481 -0.160 1
1 235 . 49 1 1 A 22 22 ALA N N 22 120.293 121.206 -0.913 1
1 236 . 49 1 1 A 23 23 VAL H H 23 7.241 7.934 -0.693 1
1 237 . 49 1 1 A 23 23 VAL HA H 23 3.684 3.820 -0.136 1
1 245 . 49 1 1 A 23 23 VAL C C 23 177.101 177.805 -0.704 1
1 246 . 49 1 1 A 23 23 VAL CA C 23 65.237 65.412 -0.175 1
1 247 . 49 1 1 A 23 23 VAL CB C 23 31.780 31.552 0.228 1
1 250 . 49 1 1 A 23 23 VAL N N 23 118.775 116.111 2.664 1
1 251 . 49 1 1 A 24 24 ILE H H 24 6.761 8.242 -1.481 1
1 252 . 49 1 1 A 24 24 ILE HA H 24 3.196 3.513 -0.317 1
1 262 . 49 1 1 A 24 24 ILE C C 24 177.287 177.890 -0.603 1
1 263 . 49 1 1 A 24 24 ILE CA C 24 63.404 65.499 -2.095 1
1 264 . 49 1 1 A 24 24 ILE CB C 24 36.294 37.754 -1.460 1
1 268 . 49 1 1 A 24 24 ILE N N 24 119.036 121.673 -2.637 1
1 269 . 49 1 1 A 25 25 LYS H H 25 8.032 7.955 0.077 1
1 270 . 49 1 1 A 25 25 LYS HA H 25 3.809 3.593 0.216 1
1 279 . 49 1 1 A 25 25 LYS C C 25 179.450 178.733 0.717 1
1 280 . 49 1 1 A 25 25 LYS CA C 25 59.621 59.437 0.184 1
1 281 . 49 1 1 A 25 25 LYS CB C 25 32.259 31.738 0.521 1
1 285 . 49 1 1 A 25 25 LYS N N 25 118.368 119.651 -1.283 1
1 286 . 49 1 1 A 26 26 GLU H H 26 7.845 7.909 -0.064 1
1 287 . 49 1 1 A 26 26 GLU HA H 26 4.021 4.409 -0.388 1
1 292 . 49 1 1 A 26 26 GLU C C 26 179.191 179.379 -0.188 1
1 293 . 49 1 1 A 26 26 GLU CA C 26 59.530 58.849 0.681 1
1 294 . 49 1 1 A 26 26 GLU CB C 26 29.449 29.558 -0.109 1
1 296 . 49 1 1 A 26 26 GLU N N 26 120.522 118.695 1.827 1
1 297 . 49 1 1 A 27 27 LEU H H 27 8.165 8.145 0.020 1
1 298 . 49 1 1 A 27 27 LEU HA H 27 4.163 4.130 0.033 1
1 308 . 49 1 1 A 27 27 LEU C C 27 177.256 178.371 -1.115 1
1 309 . 49 1 1 A 27 27 LEU CA C 27 58.049 57.696 0.353 1
1 310 . 49 1 1 A 27 27 LEU CB C 27 41.365 41.763 -0.398 1
1 314 . 49 1 1 A 27 27 LEU N N 27 120.879 120.817 0.062 1
1 315 . 49 1 1 A 28 28 LYS H H 28 8.902 7.993 0.909 1
1 316 . 49 1 1 A 28 28 LYS HA H 28 4.199 4.304 -0.105 1
1 317 . 49 1 1 A 28 28 LYS C C 28 179.707 178.760 0.947 1
1 318 . 49 1 1 A 28 28 LYS CA C 28 60.097 59.262 0.835 1
1 319 . 49 1 1 A 28 28 LYS CB C 28 33.420 32.021 1.399 1
1 320 . 49 1 1 A 28 28 LYS N N 28 120.050 119.778 0.272 1
1 321 . 49 1 1 A 29 29 THR H H 29 8.294 8.064 0.230 1
1 322 . 49 1 1 A 29 29 THR HA H 29 3.892 3.877 0.015 1
1 327 . 49 1 1 A 29 29 THR C C 29 175.711 176.296 -0.585 1
1 328 . 49 1 1 A 29 29 THR CA C 29 66.846 66.609 0.237 1
1 329 . 49 1 1 A 29 29 THR CB C 29 68.794 68.578 0.216 1
1 331 . 49 1 1 A 29 29 THR N N 29 115.933 116.669 -0.736 1
1 332 . 49 1 1 A 30 30 ALA H H 30 8.244 8.655 -0.411 1
1 333 . 49 1 1 A 30 30 ALA HA H 30 4.241 4.314 -0.073 1
1 337 . 49 1 1 A 30 30 ALA C C 30 179.128 179.924 -0.796 1
1 338 . 49 1 1 A 30 30 ALA CA C 30 55.714 55.641 0.073 1
1 339 . 49 1 1 A 30 30 ALA CB C 30 18.955 18.660 0.295 1
1 340 . 49 1 1 A 30 30 ALA N N 30 124.617 122.965 1.652 1
1 341 . 49 1 1 A 31 31 ALA H H 31 8.968 8.648 0.320 1
1 342 . 49 1 1 A 31 31 ALA HA H 31 3.890 4.045 -0.155 1
1 346 . 49 1 1 A 31 31 ALA C C 31 180.352 179.821 0.531 1
1 347 . 49 1 1 A 31 31 ALA CA C 31 55.454 55.201 0.253 1
1 348 . 49 1 1 A 31 31 ALA CB C 31 17.124 18.099 -0.975 1
1 349 . 49 1 1 A 31 31 ALA N N 31 119.327 120.271 -0.944 1
1 350 . 49 1 1 A 32 32 SER H H 32 7.995 7.672 0.323 1
1 351 . 49 1 1 A 32 32 SER HA H 32 4.238 4.273 -0.035 1
1 354 . 49 1 1 A 32 32 SER C C 32 175.612 175.933 -0.321 1
1 355 . 49 1 1 A 32 32 SER CA C 32 61.203 61.251 -0.048 1
1 356 . 49 1 1 A 32 32 SER CB C 32 63.406 63.580 -0.174 1
1 357 . 49 1 1 A 32 32 SER N N 32 111.962 114.342 -2.380 1
1 358 . 49 1 1 A 33 33 GLN H H 33 8.333 7.542 0.791 1
1 359 . 49 1 1 A 33 33 GLN HA H 33 3.992 4.112 -0.120 1
1 366 . 49 1 1 A 33 33 GLN C C 33 177.486 177.439 0.047 1
1 367 . 49 1 1 A 33 33 GLN CA C 33 58.277 57.812 0.465 1
1 368 . 49 1 1 A 33 33 GLN CB C 33 29.140 29.023 0.117 1
1 370 . 49 1 1 A 33 33 GLN N N 33 119.527 120.283 -0.756 1
1 372 . 49 1 1 A 34 34 TYR H H 34 8.587 7.935 0.652 1
1 373 . 49 1 1 A 34 34 TYR HA H 34 4.792 4.517 0.275 1
1 380 . 49 1 1 A 34 34 TYR C C 34 176.499 176.742 -0.243 1
1 381 . 49 1 1 A 34 34 TYR CA C 34 57.711 59.464 -1.753 1
1 382 . 49 1 1 A 34 34 TYR CB C 34 39.561 39.153 0.408 1
1 387 . 49 1 1 A 34 34 TYR N N 34 114.610 117.138 -2.528 1
1 388 . 49 1 1 A 35 35 GLY H H 35 7.346 8.528 -1.182 1
1 389 . 49 1 1 A 35 35 GLY HA2 H 35 4.785 4.092 0.693 1
1 390 . 49 1 1 A 35 35 GLY HA3 H 35 4.007 4.096 -0.089 1
1 391 . 49 1 1 A 35 35 GLY C C 35 175.796 173.491 2.305 1
1 392 . 49 1 1 A 35 35 GLY CA C 35 44.355 44.762 -0.407 1
1 393 . 49 1 1 A 35 35 GLY N N 35 108.501 107.044 1.457 1
1 394 . 49 1 1 A 36 36 ALA H H 36 9.363 8.345 1.018 1
1 395 . 49 1 1 A 36 36 ALA HA H 36 4.217 4.576 -0.359 1
1 399 . 49 1 1 A 36 36 ALA C C 36 178.039 178.261 -0.222 1
1 400 . 49 1 1 A 36 36 ALA CA C 36 56.114 51.708 4.406 1
1 401 . 49 1 1 A 36 36 ALA CB C 36 19.179 20.211 -1.032 1
1 402 . 49 1 1 A 36 36 ALA N N 36 125.811 123.572 2.239 1
1 403 . 49 1 1 A 37 37 THR H H 37 8.070 8.674 -0.604 1
1 404 . 49 1 1 A 37 37 THR HA H 37 4.570 4.026 0.544 1
1 409 . 49 1 1 A 37 37 THR C C 37 173.685 173.751 -0.066 1
1 410 . 49 1 1 A 37 37 THR CA C 37 59.822 65.149 -5.327 1
1 411 . 49 1 1 A 37 37 THR CB C 37 68.267 66.850 1.417 1
1 413 . 49 1 1 A 37 37 THR N N 37 129.410 109.069 20.341 1
1 414 . 49 1 1 A 38 38 ALA H H 38 6.853 7.691 -0.838 1
1 415 . 49 1 1 A 38 38 ALA HA H 38 4.601 4.540 0.061 1
1 419 . 49 1 1 A 38 38 ALA CA C 38 50.758 50.280 0.478 1
1 420 . 49 1 1 A 38 38 ALA CB C 38 18.325 19.589 -1.264 1
1 421 . 49 1 1 A 38 38 ALA N N 38 124.674 124.646 0.028 1
1 422 . 49 1 1 A 40 40 TYR HA H 40 4.032 4.068 -0.036 1
1 429 . 49 1 1 A 40 40 TYR C C 40 176.456 177.256 -0.800 1
1 430 . 49 1 1 A 40 40 TYR CA C 40 61.010 61.768 -0.758 1
1 431 . 49 1 1 A 40 40 TYR CB C 40 39.286 38.755 0.531 1
1 436 . 49 1 1 A 41 41 THR H H 41 6.874 8.225 -1.351 1
1 437 . 49 1 1 A 41 41 THR HA H 41 3.616 3.917 -0.301 1
1 442 . 49 1 1 A 41 41 THR C C 41 176.930 177.279 -0.349 1
1 443 . 49 1 1 A 41 41 THR CA C 41 65.557 66.831 -1.274 1
1 444 . 49 1 1 A 41 41 THR CB C 41 68.228 68.510 -0.282 1
1 446 . 49 1 1 A 41 41 THR N N 41 115.143 113.990 1.153 1
1 447 . 49 1 1 A 42 42 LEU H H 42 8.623 7.420 1.203 1
1 448 . 49 1 1 A 42 42 LEU HA H 42 3.708 4.101 -0.393 1
1 458 . 49 1 1 A 42 42 LEU C C 42 178.206 179.025 -0.819 1
1 459 . 49 1 1 A 42 42 LEU CA C 42 57.417 57.763 -0.346 1
1 460 . 49 1 1 A 42 42 LEU CB C 42 41.342 41.225 0.117 1
1 464 . 49 1 1 A 42 42 LEU N N 42 120.418 117.807 2.611 1
1 465 . 49 1 1 A 43 43 ALA H H 43 7.735 7.779 -0.044 1
1 466 . 49 1 1 A 43 43 ALA HA H 43 4.020 4.048 -0.028 1
1 470 . 49 1 1 A 43 43 ALA C C 43 180.826 180.669 0.157 1
1 471 . 49 1 1 A 43 43 ALA CA C 43 54.925 55.059 -0.134 1
1 472 . 49 1 1 A 43 43 ALA CB C 43 17.506 18.271 -0.765 1
1 473 . 49 1 1 A 43 43 ALA N N 43 120.203 121.810 -1.607 1
1 474 . 49 1 1 A 44 44 ILE H H 44 7.149 7.451 -0.302 1
1 475 . 49 1 1 A 44 44 ILE HA H 44 3.603 3.596 0.007 1
1 485 . 49 1 1 A 44 44 ILE C C 44 178.594 178.225 0.369 1
1 486 . 49 1 1 A 44 44 ILE CA C 44 64.782 64.337 0.445 1
1 487 . 49 1 1 A 44 44 ILE CB C 44 37.472 36.849 0.623 1
1 491 . 49 1 1 A 44 44 ILE N N 44 118.881 119.328 -0.447 1
1 492 . 49 1 1 A 45 45 VAL H H 45 7.968 7.730 0.238 1
1 493 . 49 1 1 A 45 45 VAL HA H 45 2.925 3.418 -0.493 1
1 501 . 49 1 1 A 45 45 VAL C C 45 177.023 177.392 -0.369 1
1 502 . 49 1 1 A 45 45 VAL CA C 45 67.081 66.468 0.613 1
1 503 . 49 1 1 A 45 45 VAL CB C 45 30.854 31.188 -0.334 1
1 506 . 49 1 1 A 45 45 VAL N N 45 120.764 120.424 0.340 1
1 507 . 49 1 1 A 46 46 GLU H H 46 8.399 8.008 0.391 1
1 508 . 49 1 1 A 46 46 GLU HA H 46 3.848 3.863 -0.015 1
1 513 . 49 1 1 A 46 46 GLU C C 46 178.656 179.254 -0.598 1
1 514 . 49 1 1 A 46 46 GLU CA C 46 59.491 59.414 0.077 1
1 515 . 49 1 1 A 46 46 GLU CB C 46 28.991 29.008 -0.017 1
1 517 . 49 1 1 A 46 46 GLU N N 46 116.599 119.966 -3.367 1
1 518 . 49 1 1 A 47 47 SER H H 47 7.273 8.096 -0.823 1
1 519 . 49 1 1 A 47 47 SER HA H 47 4.287 4.082 0.205 1
1 521 . 49 1 1 A 47 47 SER CA C 47 61.047 62.580 -1.533 1
1 522 . 49 1 1 A 47 47 SER CB C 47 63.016 63.057 -0.041 1
1 523 . 49 1 1 A 47 47 SER N N 47 113.609 117.302 -3.693 1
1 524 . 49 1 1 A 48 48 VAL H H 48 8.006 8.126 -0.120 1
1 525 . 49 1 1 A 48 48 VAL HA H 48 3.556 3.833 -0.277 1
1 533 . 49 1 1 A 48 48 VAL C C 48 177.257 177.967 -0.710 1
1 534 . 49 1 1 A 48 48 VAL CA C 48 65.025 64.777 0.248 1
1 535 . 49 1 1 A 48 48 VAL CB C 48 31.841 31.822 0.019 1
1 538 . 49 1 1 A 48 48 VAL N N 48 122.327 118.478 3.849 1
1 539 . 49 1 1 A 49 49 ALA H H 49 8.369 7.705 0.664 1
1 540 . 49 1 1 A 49 49 ALA HA H 49 4.115 4.170 -0.055 1
1 544 . 49 1 1 A 49 49 ALA C C 49 177.307 177.957 -0.650 1
1 545 . 49 1 1 A 49 49 ALA CA C 49 53.253 53.747 -0.494 1
1 546 . 49 1 1 A 49 49 ALA CB C 49 20.131 18.198 1.933 1
1 547 . 49 1 1 A 49 49 ALA N N 49 118.050 124.164 -6.114 1
1 548 . 49 1 1 A 50 50 ASP H H 50 7.052 7.630 -0.578 1
1 549 . 49 1 1 A 50 50 ASP HA H 50 4.788 4.593 0.195 1
1 552 . 49 1 1 A 50 50 ASP C C 50 175.481 176.001 -0.520 1
1 553 . 49 1 1 A 50 50 ASP CA C 50 53.681 54.410 -0.729 1
1 554 . 49 1 1 A 50 50 ASP CB C 50 39.333 41.086 -1.753 1
1 555 . 49 1 1 A 50 50 ASP N N 50 116.997 117.278 -0.281 1
1 556 . 49 1 1 A 51 51 ASN H H 51 8.535 7.642 0.893 1
1 557 . 49 1 1 A 51 51 ASN HA H 51 4.628 4.803 -0.175 1
1 562 . 49 1 1 A 51 51 ASN C C 51 174.077 175.306 -1.229 1
1 563 . 49 1 1 A 51 51 ASN CA C 51 52.315 51.949 0.366 1
1 564 . 49 1 1 A 51 51 ASN CB C 51 41.928 39.735 2.193 1
1 565 . 49 1 1 A 51 51 ASN N N 51 118.626 117.320 1.306 1
1 567 . 49 1 1 A 52 52 TRP H H 52 8.555 8.299 0.256 1
1 574 . 49 1 1 A 52 52 TRP C C 52 173.269 175.850 -2.581 1
1 575 . 49 1 1 A 52 52 TRP CA C 52 55.031 58.003 -2.972 1
1 576 . 49 1 1 A 52 52 TRP CB C 52 26.801 29.197 -2.396 1
1 582 . 49 1 1 A 52 52 TRP N N 52 120.693 121.278 -0.585 1
1 584 . 49 1 1 A 53 53 LEU H H 53 7.847 9.000 -1.153 1
1 585 . 49 1 1 A 53 53 LEU HA H 53 4.859 5.241 -0.382 1
1 595 . 49 1 1 A 53 53 LEU C C 53 177.397 175.033 2.364 1
1 596 . 49 1 1 A 53 53 LEU CA C 53 53.619 53.551 0.068 1
1 597 . 49 1 1 A 53 53 LEU CB C 53 41.812 46.233 -4.421 1
1 601 . 49 1 1 A 53 53 LEU N N 53 124.741 125.404 -0.663 1
1 602 . 49 1 1 A 54 54 THR H H 54 8.850 9.189 -0.339 1
1 603 . 49 1 1 A 54 54 THR HA H 54 4.598 4.668 -0.070 1
1 608 . 49 1 1 A 54 54 THR CA C 54 60.531 58.657 1.874 1
1 609 . 49 1 1 A 54 54 THR CB C 54 67.183 69.572 -2.389 1
1 611 . 49 1 1 A 54 54 THR N N 54 113.407 115.514 -2.107 1
1 612 . 49 1 1 A 55 55 PRO HA H 55 4.511 4.059 0.452 1
1 619 . 49 1 1 A 55 55 PRO C C 55 179.383 178.894 0.489 1
1 620 . 49 1 1 A 55 55 PRO CA C 55 67.159 65.196 1.963 1
1 621 . 49 1 1 A 55 55 PRO CB C 55 32.095 31.591 0.504 1
1 622 . 49 1 1 A 56 56 THR H H 56 8.575 7.754 0.821 1
1 623 . 49 1 1 A 56 56 THR HA H 56 4.229 4.044 0.185 1
1 628 . 49 1 1 A 56 56 THR C C 56 176.668 176.391 0.277 1
1 629 . 49 1 1 A 56 56 THR CA C 56 66.943 65.633 1.310 1
1 630 . 49 1 1 A 56 56 THR CB C 56 68.129 68.374 -0.245 1
1 632 . 49 1 1 A 56 56 THR N N 56 114.855 112.971 1.884 1
1 633 . 49 1 1 A 57 57 ASP H H 57 8.730 8.197 0.533 1
1 634 . 49 1 1 A 57 57 ASP HA H 57 4.425 4.347 0.078 1
1 637 . 49 1 1 A 57 57 ASP C C 57 178.351 178.960 -0.609 1
1 638 . 49 1 1 A 57 57 ASP CA C 57 57.963 56.059 1.904 1
1 639 . 49 1 1 A 57 57 ASP CB C 57 40.134 39.851 0.283 1
1 640 . 49 1 1 A 57 57 ASP N N 57 126.239 119.217 7.022 1
1 641 . 49 1 1 A 58 58 TRP H H 58 8.244 8.332 -0.088 1
1 642 . 49 1 1 A 58 58 TRP HA H 58 4.030 4.493 -0.463 1
1 650 . 49 1 1 A 58 58 TRP C C 58 177.432 179.177 -1.745 1
1 651 . 49 1 1 A 58 58 TRP CA C 58 62.731 59.980 2.751 1
1 652 . 49 1 1 A 58 58 TRP CB C 58 29.122 29.388 -0.266 1
1 657 . 49 1 1 A 58 58 TRP N N 58 119.241 119.872 -0.631 1
1 659 . 49 1 1 A 59 59 ASN H H 59 8.098 8.458 -0.360 1
1 660 . 49 1 1 A 59 59 ASN HA H 59 4.424 4.329 0.095 1
1 663 . 49 1 1 A 59 59 ASN C C 59 176.952 177.951 -0.999 1
1 664 . 49 1 1 A 59 59 ASN CA C 59 58.135 56.474 1.661 1
1 665 . 49 1 1 A 59 59 ASN CB C 59 40.168 38.169 1.999 1
1 666 . 49 1 1 A 59 59 ASN N N 59 115.747 117.948 -2.201 1
1 667 . 49 1 1 A 60 60 THR H H 60 8.712 7.778 0.934 1
1 668 . 49 1 1 A 60 60 THR HA H 60 3.717 3.982 -0.265 1
1 673 . 49 1 1 A 60 60 THR C C 60 176.044 176.736 -0.692 1
1 674 . 49 1 1 A 60 60 THR CA C 60 66.576 67.410 -0.834 1
1 675 . 49 1 1 A 60 60 THR CB C 60 69.251 67.692 1.559 1
1 677 . 49 1 1 A 60 60 THR N N 60 114.896 117.454 -2.558 1
1 678 . 49 1 1 A 61 61 LEU H H 61 8.485 8.414 0.071 1
1 679 . 49 1 1 A 61 61 LEU HA H 61 3.391 4.049 -0.658 1
1 689 . 49 1 1 A 61 61 LEU C C 61 177.433 178.536 -1.103 1
1 690 . 49 1 1 A 61 61 LEU CA C 61 58.354 58.532 -0.178 1
1 691 . 49 1 1 A 61 61 LEU CB C 61 41.761 42.302 -0.541 1
1 695 . 49 1 1 A 61 61 LEU N N 61 123.433 121.979 1.454 1
1 696 . 49 1 1 A 62 62 VAL H H 62 8.073 8.376 -0.303 1
1 697 . 49 1 1 A 62 62 VAL HA H 62 3.207 3.767 -0.560 1
1 705 . 49 1 1 A 62 62 VAL C C 62 177.585 177.870 -0.285 1
1 706 . 49 1 1 A 62 62 VAL CA C 62 67.345 65.337 2.008 1
1 707 . 49 1 1 A 62 62 VAL CB C 62 30.905 30.604 0.301 1
1 710 . 49 1 1 A 62 62 VAL N N 62 116.018 118.426 -2.408 1
1 711 . 49 1 1 A 63 63 ARG H H 63 7.765 7.753 0.012 1
1 712 . 49 1 1 A 63 63 ARG HA H 63 3.602 3.977 -0.375 1
1 719 . 49 1 1 A 63 63 ARG C C 63 177.818 178.122 -0.304 1
1 720 . 49 1 1 A 63 63 ARG CA C 63 58.049 59.450 -1.401 1
1 721 . 49 1 1 A 63 63 ARG CB C 63 29.955 30.192 -0.237 1
1 724 . 49 1 1 A 63 63 ARG N N 63 116.700 121.585 -4.885 1
1 725 . 49 1 1 A 64 64 ALA H H 64 7.574 7.693 -0.119 1
1 726 . 49 1 1 A 64 64 ALA HA H 64 4.158 4.378 -0.220 1
1 730 . 49 1 1 A 64 64 ALA C C 64 179.886 179.426 0.460 1
1 731 . 49 1 1 A 64 64 ALA CA C 64 54.007 54.032 -0.025 1
1 732 . 49 1 1 A 64 64 ALA CB C 64 19.147 19.636 -0.489 1
1 733 . 49 1 1 A 64 64 ALA N N 64 117.555 121.640 -4.085 1
1 734 . 49 1 1 A 65 65 VAL H H 65 7.554 8.052 -0.498 1
1 735 . 49 1 1 A 65 65 VAL HA H 65 4.253 3.769 0.484 1
1 743 . 49 1 1 A 65 65 VAL C C 65 174.180 176.378 -2.198 1
1 744 . 49 1 1 A 65 65 VAL CA C 65 62.683 65.312 -2.629 1
1 745 . 49 1 1 A 65 65 VAL CB C 65 33.458 31.237 2.221 1
1 748 . 49 1 1 A 65 65 VAL N N 65 110.013 115.438 -5.425 1
1 749 . 49 1 1 A 66 66 LEU H H 66 7.792 7.198 0.594 1
1 750 . 49 1 1 A 66 66 LEU HA H 66 4.790 4.758 0.032 1
1 760 . 49 1 1 A 66 66 LEU C C 66 177.537 175.713 1.824 1
1 761 . 49 1 1 A 66 66 LEU CA C 66 52.823 52.695 0.128 1
1 762 . 49 1 1 A 66 66 LEU CB C 66 44.071 44.786 -0.715 1
1 766 . 49 1 1 A 66 66 LEU N N 66 118.967 121.062 -2.095 1
1 767 . 49 1 1 A 67 67 SER H H 67 9.208 8.401 0.807 1
1 768 . 49 1 1 A 67 67 SER HA H 67 4.414 4.729 -0.315 1
1 771 . 49 1 1 A 67 67 SER CA C 67 57.943 57.440 0.503 1
1 772 . 49 1 1 A 67 67 SER CB C 67 64.743 65.459 -0.716 1
1 773 . 49 1 1 A 67 67 SER N N 67 116.378 116.353 0.025 1
1 774 . 49 1 1 A 69 69 GLY HA2 H 69 3.916 3.713 0.203 1
1 775 . 49 1 1 A 69 69 GLY HA3 H 69 3.867 3.751 0.116 1
1 776 . 49 1 1 A 69 69 GLY C C 69 176.783 175.345 1.438 1
1 777 . 49 1 1 A 69 69 GLY CA C 69 46.977 47.011 -0.034 1
1 778 . 49 1 1 A 70 70 ASP H H 70 7.674 8.133 -0.459 1
1 779 . 49 1 1 A 70 70 ASP HA H 70 4.511 3.675 0.836 1
1 782 . 49 1 1 A 70 70 ASP C C 70 178.096 178.185 -0.089 1
1 783 . 49 1 1 A 70 70 ASP CA C 70 57.262 56.436 0.826 1
1 784 . 49 1 1 A 70 70 ASP CB C 70 40.594 39.661 0.933 1
1 785 . 49 1 1 A 70 70 ASP N N 70 123.930 122.155 1.775 1
1 786 . 49 1 1 A 71 71 HIS H H 71 8.729 8.113 0.616 1
1 787 . 49 1 1 A 71 71 HIS HA H 71 4.235 4.195 0.040 1
1 790 . 49 1 1 A 71 71 HIS C C 71 176.769 177.931 -1.162 1
1 791 . 49 1 1 A 71 71 HIS CA C 71 60.041 58.991 1.050 1
1 792 . 49 1 1 A 71 71 HIS CB C 71 30.682 30.315 0.367 1
1 793 . 49 1 1 A 71 71 HIS N N 71 121.003 117.036 3.967 1
1 794 . 49 1 1 A 72 72 LEU H H 72 7.620 7.922 -0.302 1
1 795 . 49 1 1 A 72 72 LEU HA H 72 3.769 3.960 -0.191 1
1 805 . 49 1 1 A 72 72 LEU C C 72 180.275 179.191 1.084 1
1 806 . 49 1 1 A 72 72 LEU CA C 72 58.192 58.036 0.156 1
1 807 . 49 1 1 A 72 72 LEU CB C 72 41.381 41.232 0.149 1
1 811 . 49 1 1 A 72 72 LEU N N 72 118.569 117.090 1.479 1
1 812 . 49 1 1 A 73 73 LEU H H 73 7.542 7.530 0.012 1
1 813 . 49 1 1 A 73 73 LEU HA H 73 4.107 4.267 -0.160 1
1 823 . 49 1 1 A 73 73 LEU C C 73 179.436 179.142 0.294 1
1 824 . 49 1 1 A 73 73 LEU CA C 73 58.026 57.226 0.800 1
1 825 . 49 1 1 A 73 73 LEU CB C 73 41.638 42.118 -0.480 1
1 829 . 49 1 1 A 73 73 LEU N N 73 121.418 120.385 1.033 1
1 830 . 49 1 1 A 74 74 TRP H H 74 8.786 8.020 0.766 1
1 831 . 49 1 1 A 74 74 TRP HA H 74 3.589 5.307 -1.718 1
1 840 . 49 1 1 A 74 74 TRP C C 74 176.816 178.710 -1.894 1
1 841 . 49 1 1 A 74 74 TRP CA C 74 63.046 59.879 3.167 1
1 842 . 49 1 1 A 74 74 TRP CB C 74 28.065 28.989 -0.924 1
1 848 . 49 1 1 A 74 74 TRP N N 74 121.111 118.221 2.890 1
1 850 . 49 1 1 A 75 75 LYS H H 75 8.939 7.793 1.146 1
1 851 . 49 1 1 A 75 75 LYS HA H 75 3.055 4.188 -1.133 1
1 860 . 49 1 1 A 75 75 LYS C C 75 177.967 179.370 -1.403 1
1 861 . 49 1 1 A 75 75 LYS CA C 75 60.029 58.736 1.293 1
1 862 . 49 1 1 A 75 75 LYS CB C 75 32.533 32.880 -0.347 1
1 866 . 49 1 1 A 75 75 LYS N N 75 119.783 118.573 1.210 1
1 867 . 49 1 1 A 76 76 SER H H 76 7.832 7.975 -0.143 1
1 868 . 49 1 1 A 76 76 SER HA H 76 4.040 4.354 -0.314 1
1 871 . 49 1 1 A 76 76 SER C C 76 177.816 177.054 0.762 1
1 872 . 49 1 1 A 76 76 SER CA C 76 62.105 62.264 -0.159 1
1 873 . 49 1 1 A 76 76 SER CB C 76 62.679 63.054 -0.375 1
1 874 . 49 1 1 A 76 76 SER N N 76 113.395 117.654 -4.259 1
1 875 . 49 1 1 A 77 77 GLU H H 77 7.590 7.850 -0.260 1
1 876 . 49 1 1 A 77 77 GLU HA H 77 4.042 4.332 -0.290 1
1 881 . 49 1 1 A 77 77 GLU C C 77 177.809 178.534 -0.725 1
1 882 . 49 1 1 A 77 77 GLU CA C 77 58.270 58.437 -0.167 1
1 883 . 49 1 1 A 77 77 GLU CB C 77 29.208 29.455 -0.247 1
1 885 . 49 1 1 A 77 77 GLU N N 77 121.574 121.664 -0.090 1
1 886 . 49 1 1 A 78 78 PHE H H 78 9.081 7.883 1.198 1
1 887 . 49 1 1 A 78 78 PHE HA H 78 3.778 4.198 -0.420 1
1 895 . 49 1 1 A 78 78 PHE C C 78 178.114 177.260 0.854 1
1 896 . 49 1 1 A 78 78 PHE CA C 78 60.629 61.420 -0.791 1
1 897 . 49 1 1 A 78 78 PHE CB C 78 38.295 38.896 -0.601 1
1 902 . 49 1 1 A 78 78 PHE N N 78 122.682 122.697 -0.015 1
1 903 . 49 1 1 A 79 79 PHE H H 79 8.890 8.158 0.732 1
1 904 . 49 1 1 A 79 79 PHE HA H 79 3.800 3.998 -0.198 1
1 912 . 49 1 1 A 79 79 PHE C C 79 178.354 178.215 0.139 1
1 913 . 49 1 1 A 79 79 PHE CA C 79 60.704 62.154 -1.450 1
1 914 . 49 1 1 A 79 79 PHE CB C 79 37.184 38.456 -1.272 1
1 920 . 49 1 1 A 79 79 PHE N N 79 121.056 117.976 3.080 1
1 921 . 49 1 1 A 80 80 GLU H H 80 7.793 8.348 -0.555 1
1 922 . 49 1 1 A 80 80 GLU HA H 80 4.082 3.978 0.104 1
1 927 . 49 1 1 A 80 80 GLU C C 80 179.068 179.491 -0.423 1
1 928 . 49 1 1 A 80 80 GLU CA C 80 59.735 59.556 0.179 1
1 929 . 49 1 1 A 80 80 GLU CB C 80 28.722 29.145 -0.423 1
1 931 . 49 1 1 A 80 80 GLU N N 80 120.312 119.086 1.226 1
1 932 . 49 1 1 A 81 81 ASN H H 81 8.624 8.684 -0.060 1
1 933 . 49 1 1 A 81 81 ASN HA H 81 4.521 4.523 -0.002 1
1 938 . 49 1 1 A 81 81 ASN C C 81 179.262 178.210 1.052 1
1 939 . 49 1 1 A 81 81 ASN CA C 81 55.504 56.334 -0.830 1
1 940 . 49 1 1 A 81 81 ASN CB C 81 37.517 37.724 -0.207 1
1 941 . 49 1 1 A 81 81 ASN N N 81 119.338 118.550 0.788 1
1 943 . 49 1 1 A 82 82 CYS H H 82 8.554 8.031 0.523 1
1 944 . 49 1 1 A 82 82 CYS HA H 82 3.792 3.993 -0.201 1
1 947 . 49 1 1 A 82 82 CYS C C 82 176.478 177.041 -0.563 1
1 948 . 49 1 1 A 82 82 CYS CA C 82 65.232 63.224 2.008 1
1 949 . 49 1 1 A 82 82 CYS CB C 82 26.762 26.831 -0.069 1
1 950 . 49 1 1 A 82 82 CYS N N 82 120.576 117.840 2.736 1
1 951 . 49 1 1 A 83 83 ARG H H 83 8.522 8.053 0.469 1
1 952 . 49 1 1 A 83 83 ARG HA H 83 3.932 4.119 -0.187 1
1 960 . 49 1 1 A 83 83 ARG C C 83 179.138 178.729 0.409 1
1 961 . 49 1 1 A 83 83 ARG CA C 83 60.443 58.941 1.502 1
1 962 . 49 1 1 A 83 83 ARG CB C 83 29.550 29.391 0.159 1
1 965 . 49 1 1 A 83 83 ARG N N 83 123.035 119.684 3.351 1
1 967 . 49 1 1 A 84 84 ASP H H 84 7.791 8.409 -0.618 1
1 968 . 49 1 1 A 84 84 ASP HA H 84 4.353 4.327 0.026 1
1 971 . 49 1 1 A 84 84 ASP C C 84 178.649 178.800 -0.151 1
1 972 . 49 1 1 A 84 84 ASP CA C 84 57.767 57.631 0.136 1
1 973 . 49 1 1 A 84 84 ASP CB C 84 41.305 41.956 -0.651 1
1 974 . 49 1 1 A 84 84 ASP N N 84 120.332 119.496 0.836 1
1 975 . 49 1 1 A 85 85 THR H H 85 8.370 8.057 0.313 1
1 976 . 49 1 1 A 85 85 THR HA H 85 3.730 3.885 -0.155 1
1 981 . 49 1 1 A 85 85 THR C C 85 175.198 176.322 -1.124 1
1 982 . 49 1 1 A 85 85 THR CA C 85 66.830 66.194 0.636 1
1 983 . 49 1 1 A 85 85 THR CB C 85 68.533 68.434 0.099 1
1 985 . 49 1 1 A 85 85 THR N N 85 117.360 115.410 1.950 1
1 986 . 49 1 1 A 86 86 ALA H H 86 8.845 8.418 0.427 1
1 987 . 49 1 1 A 86 86 ALA HA H 86 3.991 4.360 -0.369 1
1 991 . 49 1 1 A 86 86 ALA C C 86 179.980 179.787 0.193 1
1 992 . 49 1 1 A 86 86 ALA CA C 86 55.769 55.251 0.518 1
1 993 . 49 1 1 A 86 86 ALA CB C 86 17.881 18.363 -0.482 1
1 994 . 49 1 1 A 86 86 ALA N N 86 123.613 123.764 -0.151 1
1 995 . 49 1 1 A 87 87 LYS H H 87 7.686 8.257 -0.571 1
1 996 . 49 1 1 A 87 87 LYS HA H 87 4.099 4.079 0.020 1
1 1005 . 49 1 1 A 87 87 LYS C C 87 179.592 178.383 1.209 1
1 1006 . 49 1 1 A 87 87 LYS CA C 87 59.708 59.159 0.549 1
1 1007 . 49 1 1 A 87 87 LYS CB C 87 32.054 31.795 0.259 1
1 1011 . 49 1 1 A 87 87 LYS N N 87 119.623 116.297 3.326 1
1 1012 . 49 1 1 A 88 88 ARG H H 88 7.683 7.664 0.019 1
1 1013 . 49 1 1 A 88 88 ARG HA H 88 4.051 4.146 -0.095 1
1 1020 . 49 1 1 A 88 88 ARG C C 88 180.053 179.089 0.964 1
1 1021 . 49 1 1 A 88 88 ARG CA C 88 59.558 58.697 0.861 1
1 1022 . 49 1 1 A 88 88 ARG CB C 88 29.684 29.539 0.145 1
1 1025 . 49 1 1 A 88 88 ARG N N 88 120.788 119.294 1.494 1
1 1026 . 49 1 1 A 89 89 ASN H H 89 8.973 7.949 1.024 1
1 1027 . 49 1 1 A 89 89 ASN HA H 89 4.354 4.635 -0.281 1
1 1032 . 49 1 1 A 89 89 ASN C C 89 178.382 178.526 -0.144 1
1 1033 . 49 1 1 A 89 89 ASN CA C 89 55.334 55.902 -0.568 1
1 1034 . 49 1 1 A 89 89 ASN CB C 89 37.864 37.964 -0.100 1
1 1035 . 49 1 1 A 89 89 ASN N N 89 121.012 118.036 2.976 1
1 1037 . 49 1 1 A 90 90 GLN H H 90 8.152 7.837 0.315 1
1 1038 . 49 1 1 A 90 90 GLN HA H 90 4.020 4.194 -0.174 1
1 1045 . 49 1 1 A 90 90 GLN C C 90 179.075 178.921 0.154 1
1 1046 . 49 1 1 A 90 90 GLN CA C 90 59.318 58.922 0.396 1
1 1047 . 49 1 1 A 90 90 GLN CB C 90 28.049 28.564 -0.515 1
1 1049 . 49 1 1 A 90 90 GLN N N 90 122.122 120.418 1.704 1
1 1051 . 49 1 1 A 91 91 GLN H H 91 7.514 8.190 -0.676 1
1 1052 . 49 1 1 A 91 91 GLN HA H 91 4.053 4.073 -0.020 1
1 1059 . 49 1 1 A 91 91 GLN C C 91 177.081 177.994 -0.913 1
1 1060 . 49 1 1 A 91 91 GLN CA C 91 58.031 58.723 -0.692 1
1 1061 . 49 1 1 A 91 91 GLN CB C 91 28.365 27.724 0.641 1
1 1063 . 49 1 1 A 91 91 GLN N N 91 118.124 118.184 -0.060 1
1 1065 . 49 1 1 A 92 92 ALA H H 92 7.704 7.432 0.272 1
1 1066 . 49 1 1 A 92 92 ALA HA H 92 4.246 4.287 -0.041 1
1 1070 . 49 1 1 A 92 92 ALA C C 92 178.450 178.048 0.402 1
1 1071 . 49 1 1 A 92 92 ALA CA C 92 52.671 52.756 -0.085 1
1 1072 . 49 1 1 A 92 92 ALA CB C 92 19.316 19.666 -0.350 1
1 1073 . 49 1 1 A 92 92 ALA N N 92 119.880 119.681 0.199 1
1 1074 . 49 1 1 A 93 93 GLY H H 93 7.693 8.199 -0.506 1
1 1075 . 49 1 1 A 93 93 GLY HA2 H 93 3.941 3.952 -0.011 1
1 1076 . 49 1 1 A 93 93 GLY HA3 H 93 3.744 3.960 -0.216 1
1 1077 . 49 1 1 A 93 93 GLY C C 93 174.344 174.418 -0.074 1
1 1078 . 49 1 1 A 93 93 GLY CA C 93 45.949 46.456 -0.507 1
1 1079 . 49 1 1 A 93 93 GLY N N 93 105.347 107.165 -1.818 1
1 1080 . 49 1 1 A 94 94 ASN H H 94 7.076 8.349 -1.273 1
1 1081 . 49 1 1 A 94 94 ASN HA H 94 4.115 4.939 -0.824 1
1 1085 . 49 1 1 A 94 94 ASN C C 94 175.410 175.827 -0.417 1
1 1086 . 49 1 1 A 94 94 ASN CA C 94 52.651 52.002 0.649 1
1 1087 . 49 1 1 A 94 94 ASN CB C 94 38.330 40.141 -1.811 1
1 1088 . 49 1 1 A 94 94 ASN N N 94 115.747 118.216 -2.469 1
1 1090 . 49 1 1 A 95 95 GLY H H 95 8.236 8.384 -0.148 1
1 1091 . 49 1 1 A 95 95 GLY HA2 H 95 3.633 3.517 0.116 1
1 1092 . 49 1 1 A 95 95 GLY HA3 H 95 3.633 3.669 -0.036 1
1 1093 . 49 1 1 A 95 95 GLY C C 95 174.450 173.046 1.404 1
1 1094 . 49 1 1 A 95 95 GLY CA C 95 45.522 46.919 -1.397 1
1 1095 . 49 1 1 A 95 95 GLY N N 95 109.166 108.889 0.277 1
1 1096 . 49 1 1 A 96 96 TRP H H 96 7.899 7.922 -0.023 1
1 1097 . 49 1 1 A 96 96 TRP HA H 96 5.241 5.267 -0.026 1
1 1106 . 49 1 1 A 96 96 TRP C C 96 175.661 174.379 1.282 1
1 1107 . 49 1 1 A 96 96 TRP CA C 96 55.090 55.811 -0.721 1
1 1108 . 49 1 1 A 96 96 TRP CB C 96 27.138 34.513 -7.375 1
1 1114 . 49 1 1 A 96 96 TRP N N 96 122.840 119.614 3.226 1
1 1116 . 49 1 1 A 97 97 ASP H H 97 7.344 9.123 -1.779 1
1 1117 . 49 1 1 A 97 97 ASP HA H 97 4.829 5.366 -0.537 1
1 1120 . 49 1 1 A 97 97 ASP C C 97 175.019 176.658 -1.639 1
1 1121 . 49 1 1 A 97 97 ASP CA C 97 52.149 53.099 -0.950 1
1 1122 . 49 1 1 A 97 97 ASP CB C 97 42.697 44.201 -1.504 1
1 1123 . 49 1 1 A 97 97 ASP N N 97 126.861 121.355 5.506 1
1 1124 . 49 1 1 A 98 98 PHE H H 98 8.566 9.069 -0.503 1
1 1125 . 49 1 1 A 98 98 PHE HA H 98 3.727 4.405 -0.678 1
1 1133 . 49 1 1 A 98 98 PHE C C 98 177.443 176.711 0.732 1
1 1134 . 49 1 1 A 98 98 PHE CA C 98 62.471 59.895 2.576 1
1 1135 . 49 1 1 A 98 98 PHE CB C 98 39.919 38.075 1.844 1
1 1141 . 49 1 1 A 98 98 PHE N N 98 117.781 122.574 -4.793 1
1 1142 . 49 1 1 A 99 99 ASP H H 99 8.259 7.979 0.280 1
1 1143 . 49 1 1 A 99 99 ASP HA H 99 3.960 4.287 -0.327 1
1 1146 . 49 1 1 A 99 99 ASP C C 99 178.132 178.959 -0.827 1
1 1147 . 49 1 1 A 99 99 ASP CA C 99 57.658 56.726 0.932 1
1 1148 . 49 1 1 A 99 99 ASP CB C 99 38.572 40.238 -1.666 1
1 1149 . 49 1 1 A 99 99 ASP N N 99 121.709 121.653 0.056 1
1 1150 . 49 1 1 A 100 100 MET H H 100 8.008 7.635 0.373 1
1 1151 . 49 1 1 A 100 100 MET HA H 100 3.644 4.230 -0.586 1
1 1156 . 49 1 1 A 100 100 MET C C 100 180.008 176.757 3.251 1
1 1157 . 49 1 1 A 100 100 MET CA C 100 58.598 58.354 0.244 1
1 1158 . 49 1 1 A 100 100 MET CB C 100 33.423 32.791 0.632 1
1 1160 . 49 1 1 A 100 100 MET N N 100 119.668 118.678 0.990 1
1 1161 . 49 1 1 A 101 101 LEU H H 101 7.961 7.772 0.189 1
1 1162 . 49 1 1 A 101 101 LEU HA H 101 3.523 4.532 -1.009 1
1 1172 . 49 1 1 A 101 101 LEU C C 101 173.873 175.294 -1.421 1
1 1173 . 49 1 1 A 101 101 LEU CA C 101 58.743 53.861 4.882 1
1 1174 . 49 1 1 A 101 101 LEU CB C 101 42.632 41.561 1.071 1
1 1178 . 49 1 1 A 101 101 LEU N N 101 119.752 120.569 -0.817 1
1 1179 . 49 1 1 A 102 102 THR H H 102 6.955 8.443 -1.488 1
1 1180 . 49 1 1 A 102 102 THR HA H 102 4.134 4.431 -0.297 1
1 1185 . 49 1 1 A 102 102 THR C C 102 176.513 173.442 3.071 1
1 1186 . 49 1 1 A 102 102 THR CA C 102 61.125 60.289 0.836 1
1 1187 . 49 1 1 A 102 102 THR CB C 102 71.415 70.042 1.373 1
1 1189 . 49 1 1 A 102 102 THR N N 102 124.665 118.551 6.114 1
1 1190 . 49 1 1 A 103 103 GLY H H 103 7.816 8.891 -1.075 1
1 1191 . 49 1 1 A 103 103 GLY HA2 H 103 3.824 4.224 -0.400 1
1 1192 . 49 1 1 A 103 103 GLY HA3 H 103 3.824 4.304 -0.480 1
1 1193 . 49 1 1 A 103 103 GLY C C 103 174.126 174.512 -0.386 1
1 1194 . 49 1 1 A 103 103 GLY CA C 103 47.805 46.592 1.213 1
1 1195 . 49 1 1 A 103 103 GLY N N 103 114.191 112.556 1.635 1
1 1196 . 49 1 1 A 104 104 SER H H 104 8.860 8.090 0.770 1
1 1197 . 49 1 1 A 104 104 SER HA H 104 4.758 4.193 0.565 1
1 1200 . 49 1 1 A 104 104 SER C C 104 174.591 174.816 -0.225 1
1 1201 . 49 1 1 A 104 104 SER CA C 104 56.755 60.318 -3.563 1
1 1202 . 49 1 1 A 104 104 SER CB C 104 65.050 63.084 1.966 1
1 1203 . 49 1 1 A 104 104 SER N N 104 114.771 115.118 -0.347 1
1 1204 . 49 1 1 A 105 105 GLY H H 105 8.788 7.998 0.790 1
1 1205 . 49 1 1 A 105 105 GLY HA2 H 105 3.733 4.061 -0.328 1
1 1206 . 49 1 1 A 105 105 GLY HA3 H 105 3.733 4.070 -0.337 1
1 1207 . 49 1 1 A 105 105 GLY CA C 105 47.247 45.465 1.782 1
1 1208 . 49 1 1 A 105 105 GLY N N 105 110.394 108.825 1.569 1
1 1209 . 49 1 1 A 106 106 ASN HA H 106 4.454 4.995 -0.541 1
1 1212 . 49 1 1 A 106 106 ASN C C 106 175.180 176.074 -0.894 1
1 1213 . 49 1 1 A 106 106 ASN CA C 106 54.492 54.701 -0.209 1
1 1214 . 49 1 1 A 106 106 ASN CB C 106 37.282 40.515 -3.233 1
1 1215 . 49 1 1 A 107 107 TYR H H 107 8.241 7.784 0.457 1
1 1216 . 49 1 1 A 107 107 TYR HA H 107 4.335 4.721 -0.386 1
1 1223 . 49 1 1 A 107 107 TYR C C 107 173.954 176.120 -2.166 1
1 1224 . 49 1 1 A 107 107 TYR CA C 107 57.727 57.484 0.243 1
1 1225 . 49 1 1 A 107 107 TYR CB C 107 37.063 40.291 -3.228 1
1 1230 . 49 1 1 A 107 107 TYR N N 107 120.708 114.051 6.657 1
1 1231 . 49 1 1 A 108 108 SER H H 108 7.117 7.294 -0.177 1
1 1232 . 49 1 1 A 108 108 SER HA H 108 4.221 3.928 0.293 1
1 1235 . 49 1 1 A 108 108 SER C C 108 174.834 174.431 0.403 1
1 1236 . 49 1 1 A 108 108 SER CA C 108 59.859 58.939 0.920 1
1 1237 . 49 1 1 A 108 108 SER CB C 108 63.846 61.430 2.416 1
1 1238 . 49 1 1 A 108 108 SER N N 108 113.362 116.235 -2.873 1
1 1239 . 49 1 1 A 109 109 SER H H 109 8.053 7.911 0.142 1
1 1240 . 49 1 1 A 109 109 SER HA H 109 4.560 4.635 -0.075 1
1 1243 . 49 1 1 A 109 109 SER CA C 109 57.141 57.654 -0.513 1
1 1244 . 49 1 1 A 109 109 SER CB C 109 64.874 63.673 1.201 1
1 1245 . 49 1 1 A 109 109 SER N N 109 116.657 117.165 -0.508 1
1 1246 . 49 1 1 A 110 110 THR HA H 110 3.541 3.900 -0.359 1
1 1251 . 49 1 1 A 110 110 THR C C 110 175.477 175.955 -0.478 1
1 1252 . 49 1 1 A 110 110 THR CA C 110 66.443 65.867 0.576 1
1 1253 . 49 1 1 A 110 110 THR CB C 110 68.091 68.649 -0.558 1
1 1255 . 49 1 1 A 111 111 ASP H H 111 8.224 8.178 0.046 1
1 1256 . 49 1 1 A 111 111 ASP HA H 111 4.237 4.428 -0.191 1
1 1259 . 49 1 1 A 111 111 ASP C C 111 177.520 178.018 -0.498 1
1 1260 . 49 1 1 A 111 111 ASP CA C 111 57.559 57.285 0.274 1
1 1261 . 49 1 1 A 111 111 ASP CB C 111 40.292 41.151 -0.859 1
1 1262 . 49 1 1 A 111 111 ASP N N 111 119.490 121.312 -1.822 1
1 1263 . 49 1 1 A 112 112 ALA H H 112 7.431 8.483 -1.052 1
1 1264 . 49 1 1 A 112 112 ALA HA H 112 4.191 4.057 0.134 1
1 1268 . 49 1 1 A 112 112 ALA C C 112 180.646 179.945 0.701 1
1 1269 . 49 1 1 A 112 112 ALA CA C 112 54.534 55.041 -0.507 1
1 1270 . 49 1 1 A 112 112 ALA CB C 112 18.992 18.202 0.790 1
1 1271 . 49 1 1 A 112 112 ALA N N 112 119.710 121.720 -2.010 1
1 1272 . 49 1 1 A 113 113 GLN H H 113 7.576 7.517 0.059 1
1 1273 . 49 1 1 A 113 113 GLN HA H 113 3.562 4.125 -0.563 1
1 1278 . 49 1 1 A 113 113 GLN C C 113 176.756 178.467 -1.711 1
1 1279 . 49 1 1 A 113 113 GLN CA C 113 57.736 59.054 -1.318 1
1 1280 . 49 1 1 A 113 113 GLN CB C 113 29.110 28.388 0.722 1
1 1281 . 49 1 1 A 113 113 GLN N N 113 117.518 118.464 -0.946 1
1 1283 . 49 1 1 A 114 114 MET H H 114 8.192 8.205 -0.013 1
1 1284 . 49 1 1 A 114 114 MET HA H 114 4.231 4.298 -0.067 1
1 1289 . 49 1 1 A 114 114 MET C C 114 175.648 177.341 -1.693 1
1 1290 . 49 1 1 A 114 114 MET CA C 114 57.446 58.048 -0.602 1
1 1291 . 49 1 1 A 114 114 MET CB C 114 33.570 32.366 1.204 1
1 1293 . 49 1 1 A 114 114 MET N N 114 111.509 119.480 -7.971 1
1 1294 . 49 1 1 A 115 115 GLN H H 115 6.940 7.868 -0.928 1
1 1295 . 49 1 1 A 115 115 GLN HA H 115 4.307 4.281 0.026 1
1 1302 . 49 1 1 A 115 115 GLN C C 115 176.270 175.450 0.820 1
1 1303 . 49 1 1 A 115 115 GLN CA C 115 54.680 54.915 -0.235 1
1 1304 . 49 1 1 A 115 115 GLN CB C 115 28.233 27.811 0.422 1
1 1306 . 49 1 1 A 115 115 GLN N N 115 114.300 114.768 -0.468 1
1 1308 . 49 1 1 A 116 116 TYR H H 116 6.677 7.686 -1.009 1
1 1309 . 49 1 1 A 116 116 TYR HA H 116 4.193 4.482 -0.289 1
1 1312 . 49 1 1 A 116 116 TYR C C 116 175.268 175.409 -0.141 1
1 1313 . 49 1 1 A 116 116 TYR CA C 116 54.357 57.890 -3.533 1
1 1314 . 49 1 1 A 116 116 TYR CB C 116 35.498 38.853 -3.355 1
1 1315 . 49 1 1 A 116 116 TYR N N 116 117.919 119.564 -1.645 1
1 1316 . 49 1 1 A 117 117 ASP H H 117 8.081 9.099 -1.018 1
1 1317 . 49 1 1 A 117 117 ASP HA H 117 4.665 4.911 -0.246 1
1 1320 . 49 1 1 A 117 117 ASP CA C 117 52.422 52.900 -0.478 1
1 1321 . 49 1 1 A 117 117 ASP CB C 117 42.416 40.521 1.895 1
1 1322 . 49 1 1 A 117 117 ASP N N 117 120.887 122.998 -2.111 1
1 1323 . 49 1 1 A 118 118 PRO C C 118 179.180 178.543 0.637 1
1 1324 . 49 1 1 A 118 118 PRO CA C 118 65.942 65.573 0.369 1
1 1325 . 49 1 1 A 118 118 PRO CB C 118 32.197 31.783 0.414 1
1 1326 . 49 1 1 A 119 119 GLY H H 119 9.742 8.500 1.242 1
1 1327 . 49 1 1 A 119 119 GLY C C 119 175.622 175.087 0.535 1
1 1328 . 49 1 1 A 119 119 GLY CA C 119 46.785 46.275 0.510 1
1 1329 . 49 1 1 A 119 119 GLY N N 119 106.412 106.561 -0.149 1
1 1330 . 49 1 1 A 120 120 LEU H H 120 6.666 7.644 -0.978 1
1 1331 . 49 1 1 A 120 120 LEU HA H 120 3.365 3.467 -0.102 1
1 1341 . 49 1 1 A 120 120 LEU C C 120 179.262 178.403 0.859 1
1 1342 . 49 1 1 A 120 120 LEU CA C 120 56.605 56.835 -0.230 1
1 1343 . 49 1 1 A 120 120 LEU CB C 120 39.262 41.559 -2.297 1
1 1347 . 49 1 1 A 120 120 LEU N N 120 126.226 122.952 3.274 1
1 1348 . 49 1 1 A 121 121 PHE H H 121 7.356 8.849 -1.493 1
1 1349 . 49 1 1 A 121 121 PHE HA H 121 4.459 3.828 0.631 1
1 1352 . 49 1 1 A 121 121 PHE C C 121 179.716 177.692 2.024 1
1 1353 . 49 1 1 A 121 121 PHE CA C 121 62.838 62.050 0.788 1
1 1354 . 49 1 1 A 121 121 PHE CB C 121 37.603 39.088 -1.485 1
1 1355 . 49 1 1 A 121 121 PHE N N 121 117.437 119.524 -2.087 1
1 1356 . 49 1 1 A 122 122 ALA H H 122 7.926 8.007 -0.081 1
1 1357 . 49 1 1 A 122 122 ALA HA H 122 4.523 3.743 0.780 1
1 1361 . 49 1 1 A 122 122 ALA C C 122 180.435 179.321 1.114 1
1 1362 . 49 1 1 A 122 122 ALA CA C 122 55.527 55.258 0.269 1
1 1363 . 49 1 1 A 122 122 ALA CB C 122 17.814 17.928 -0.114 1
1 1364 . 49 1 1 A 122 122 ALA N N 122 121.068 121.366 -0.298 1
1 1365 . 49 1 1 A 123 123 GLN H H 123 7.507 7.684 -0.177 1
1 1366 . 49 1 1 A 123 123 GLN HA H 123 4.153 3.980 0.173 1
1 1371 . 49 1 1 A 123 123 GLN C C 123 180.561 177.751 2.810 1
1 1372 . 49 1 1 A 123 123 GLN CA C 123 59.948 58.360 1.588 1
1 1373 . 49 1 1 A 123 123 GLN CB C 123 29.135 27.941 1.194 1
1 1375 . 49 1 1 A 123 123 GLN N N 123 120.324 116.038 4.286 1
1 1376 . 49 1 1 A 124 124 ILE H H 124 8.318 7.916 0.402 1
1 1377 . 49 1 1 A 124 124 ILE HA H 124 3.635 3.833 -0.198 1
1 1387 . 49 1 1 A 124 124 ILE C C 124 176.481 178.098 -1.617 1
1 1388 . 49 1 1 A 124 124 ILE CA C 124 66.432 64.294 2.138 1
1 1389 . 49 1 1 A 124 124 ILE CB C 124 39.168 37.808 1.360 1
1 1393 . 49 1 1 A 124 124 ILE N N 124 123.747 116.546 7.201 1
1 1394 . 49 1 1 A 125 125 GLN H H 125 8.474 7.891 0.583 1
1 1395 . 49 1 1 A 125 125 GLN HA H 125 4.264 3.922 0.342 1
1 1402 . 49 1 1 A 125 125 GLN C C 125 178.947 177.732 1.215 1
1 1403 . 49 1 1 A 125 125 GLN CA C 125 59.651 58.453 1.198 1
1 1404 . 49 1 1 A 125 125 GLN CB C 125 28.880 28.480 0.400 1
1 1406 . 49 1 1 A 125 125 GLN N N 125 120.368 121.102 -0.734 1
1 1408 . 49 1 1 A 126 126 ALA H H 126 8.002 7.759 0.243 1
1 1409 . 49 1 1 A 126 126 ALA HA H 126 4.144 3.983 0.161 1
1 1413 . 49 1 1 A 126 126 ALA C C 126 179.316 179.822 -0.506 1
1 1414 . 49 1 1 A 126 126 ALA CA C 126 55.036 54.978 0.058 1
1 1415 . 49 1 1 A 126 126 ALA CB C 126 18.087 18.006 0.081 1
1 1416 . 49 1 1 A 126 126 ALA N N 126 121.661 121.034 0.627 1
1 1417 . 49 1 1 A 127 127 ALA H H 127 7.823 8.095 -0.272 1
1 1418 . 49 1 1 A 127 127 ALA HA H 127 4.162 3.977 0.185 1
1 1422 . 49 1 1 A 127 127 ALA C C 127 180.707 179.406 1.301 1
1 1423 . 49 1 1 A 127 127 ALA CA C 127 55.080 54.870 0.210 1
1 1424 . 49 1 1 A 127 127 ALA CB C 127 19.354 18.204 1.150 1
1 1425 . 49 1 1 A 127 127 ALA N N 127 119.853 119.974 -0.121 1
1 1426 . 49 1 1 A 128 128 ALA H H 128 8.936 7.795 1.141 1
1 1427 . 49 1 1 A 128 128 ALA HA H 128 3.928 3.642 0.286 1
1 1431 . 49 1 1 A 128 128 ALA C C 128 181.031 179.329 1.702 1
1 1432 . 49 1 1 A 128 128 ALA CA C 128 55.502 54.574 0.928 1
1 1433 . 49 1 1 A 128 128 ALA CB C 128 16.609 17.733 -1.124 1
1 1434 . 49 1 1 A 128 128 ALA N N 128 121.355 120.208 1.147 1
1 1435 . 49 1 1 A 129 129 THR H H 129 8.543 7.422 1.121 1
1 1436 . 49 1 1 A 129 129 THR HA H 129 4.015 3.602 0.413 1
1 1441 . 49 1 1 A 129 129 THR C C 129 177.332 176.377 0.955 1
1 1442 . 49 1 1 A 129 129 THR CA C 129 65.893 65.042 0.851 1
1 1443 . 49 1 1 A 129 129 THR CB C 129 68.566 68.478 0.088 1
1 1445 . 49 1 1 A 129 129 THR N N 129 112.709 112.174 0.535 1
1 1446 . 49 1 1 A 130 130 LYS H H 130 8.126 7.426 0.700 1
1 1447 . 49 1 1 A 130 130 LYS HA H 130 4.000 4.011 -0.011 1
1 1456 . 49 1 1 A 130 130 LYS C C 130 179.082 178.632 0.450 1
1 1457 . 49 1 1 A 130 130 LYS CA C 130 60.299 58.454 1.845 1
1 1458 . 49 1 1 A 130 130 LYS CB C 130 32.767 31.947 0.820 1
1 1462 . 49 1 1 A 130 130 LYS N N 130 123.879 120.530 3.349 1
1 1463 . 49 1 1 A 131 131 ALA H H 131 7.184 7.617 -0.433 1
1 1464 . 49 1 1 A 131 131 ALA HA H 131 4.005 4.245 -0.240 1
1 1468 . 49 1 1 A 131 131 ALA C C 131 178.482 179.539 -1.057 1
1 1469 . 49 1 1 A 131 131 ALA CA C 131 55.027 55.071 -0.044 1
1 1470 . 49 1 1 A 131 131 ALA CB C 131 18.669 19.634 -0.965 1
1 1471 . 49 1 1 A 131 131 ALA N N 131 118.590 121.227 -2.637 1
1 1472 . 49 1 1 A 132 132 TRP H H 132 7.977 8.538 -0.561 1
1 1473 . 49 1 1 A 132 132 TRP HA H 132 4.001 4.256 -0.255 1
1 1480 . 49 1 1 A 132 132 TRP C C 132 177.332 175.708 1.624 1
1 1481 . 49 1 1 A 132 132 TRP CA C 132 60.431 57.361 3.070 1
1 1482 . 49 1 1 A 132 132 TRP CB C 132 27.786 27.627 0.159 1
1 1486 . 49 1 1 A 132 132 TRP N N 132 119.168 116.980 2.188 1
1 1488 . 49 1 1 A 133 133 ARG H H 133 8.006 8.015 -0.009 1
1 1489 . 49 1 1 A 133 133 ARG HA H 133 4.027 4.314 -0.287 1
1 1497 . 49 1 1 A 133 133 ARG C C 133 176.664 177.915 -1.251 1
1 1498 . 49 1 1 A 133 133 ARG CA C 133 59.355 57.083 2.272 1
1 1499 . 49 1 1 A 133 133 ARG CB C 133 30.451 32.057 -1.606 1
1 1502 . 49 1 1 A 133 133 ARG N N 133 113.062 120.636 -7.574 1
1 1504 . 49 1 1 A 134 134 LYS H H 134 7.322 7.695 -0.373 1
1 1505 . 49 1 1 A 134 134 LYS HA H 134 4.313 4.392 -0.079 1
1 1514 . 49 1 1 A 134 134 LYS C C 134 176.282 176.234 0.048 1
1 1515 . 49 1 1 A 134 134 LYS CA C 134 54.922 57.167 -2.245 1
1 1516 . 49 1 1 A 134 134 LYS CB C 134 32.633 31.971 0.662 1
1 1520 . 49 1 1 A 134 134 LYS N N 134 118.170 118.591 -0.421 1
1 1521 . 49 1 1 A 135 135 LEU H H 135 7.440 8.058 -0.618 1
1 1522 . 49 1 1 A 135 135 LEU HA H 135 4.174 4.449 -0.275 1
1 1532 . 49 1 1 A 135 135 LEU CA C 135 54.408 52.434 1.974 1
1 1533 . 49 1 1 A 135 135 LEU CB C 135 40.407 41.906 -1.499 1
1 1537 . 49 1 1 A 135 135 LEU N N 135 123.358 121.874 1.484 1
1 1538 . 49 1 1 A 136 136 PRO HA H 136 4.437 4.596 -0.159 1
1 1545 . 49 1 1 A 136 136 PRO C C 136 177.106 176.521 0.585 1
1 1546 . 49 1 1 A 136 136 PRO CA C 136 62.889 62.237 0.652 1
1 1547 . 49 1 1 A 136 136 PRO CB C 136 32.192 33.152 -0.960 1
1 1550 . 49 1 1 A 137 137 VAL H H 137 8.219 8.289 -0.070 1
1 1551 . 49 1 1 A 137 137 VAL HA H 137 4.077 3.989 0.088 1
1 1559 . 49 1 1 A 137 137 VAL C C 137 176.305 176.570 -0.265 1
1 1560 . 49 1 1 A 137 137 VAL CA C 137 61.958 63.013 -1.055 1
1 1561 . 49 1 1 A 137 137 VAL CB C 137 32.755 32.285 0.470 1
1 1564 . 49 1 1 A 137 137 VAL N N 137 120.079 121.105 -1.026 1
1 1565 . 49 1 1 A 138 138 LYS H H 138 8.444 8.912 -0.468 1
1 1566 . 49 1 1 A 138 138 LYS HA H 138 4.316 4.187 0.129 1
1 1575 . 49 1 1 A 138 138 LYS C C 138 176.790 177.812 -1.022 1
1 1576 . 49 1 1 A 138 138 LYS CA C 138 56.792 58.920 -2.128 1
1 1577 . 49 1 1 A 138 138 LYS CB C 138 33.205 33.579 -0.374 1
1 1581 . 49 1 1 A 138 138 LYS N N 138 126.449 130.619 -4.170 1
1 1582 . 49 1 1 A 139 139 GLY H H 139 8.518 7.753 0.765 1
1 1583 . 49 1 1 A 139 139 GLY HA2 H 139 4.070 4.089 -0.019 1
1 1584 . 49 1 1 A 139 139 GLY HA3 H 139 3.897 4.094 -0.197 1
1 1585 . 49 1 1 A 139 139 GLY C C 139 172.874 174.064 -1.190 1
1 1586 . 49 1 1 A 139 139 GLY CA C 139 45.157 46.223 -1.066 1
1 1587 . 49 1 1 A 139 139 GLY N N 139 112.617 106.812 5.805 1
1 6 . 50 1 1 A 2 2 VAL H H 2 8.992 8.078 0.914 1
1 7 . 50 1 1 A 2 2 VAL HA H 2 5.370 4.526 0.844 1
1 15 . 50 1 1 A 2 2 VAL C C 2 174.325 176.153 -1.828 1
1 16 . 50 1 1 A 2 2 VAL CA C 2 61.267 61.214 0.053 1
1 17 . 50 1 1 A 2 2 VAL CB C 2 33.890 33.498 0.392 1
1 20 . 50 1 1 A 2 2 VAL N N 2 126.939 117.284 9.655 1
1 21 . 50 1 1 A 3 3 THR H H 3 8.912 8.673 0.239 1
1 22 . 50 1 1 A 3 3 THR HA H 3 4.505 5.051 -0.546 1
1 27 . 50 1 1 A 3 3 THR C C 3 172.710 174.564 -1.854 1
1 28 . 50 1 1 A 3 3 THR CA C 3 59.689 60.445 -0.756 1
1 29 . 50 1 1 A 3 3 THR CB C 3 72.398 70.756 1.642 1
1 31 . 50 1 1 A 3 3 THR N N 3 118.091 118.684 -0.593 1
1 32 . 50 1 1 A 4 4 GLU H H 4 8.631 9.074 -0.443 1
1 33 . 50 1 1 A 4 4 GLU HA H 4 5.788 5.557 0.231 1
1 38 . 50 1 1 A 4 4 GLU C C 4 175.758 174.353 1.405 1
1 39 . 50 1 1 A 4 4 GLU CA C 4 54.902 54.758 0.144 1
1 40 . 50 1 1 A 4 4 GLU CB C 4 35.097 33.923 1.174 1
1 42 . 50 1 1 A 4 4 GLU N N 4 120.966 119.366 1.600 1
1 43 . 50 1 1 A 5 5 THR H H 5 9.188 8.485 0.703 1
1 44 . 50 1 1 A 5 5 THR HA H 5 4.739 4.821 -0.082 1
1 49 . 50 1 1 A 5 5 THR C C 5 172.757 171.959 0.798 1
1 50 . 50 1 1 A 5 5 THR CA C 5 60.382 60.449 -0.067 1
1 51 . 50 1 1 A 5 5 THR CB C 5 71.558 70.143 1.415 1
1 53 . 50 1 1 A 5 5 THR N N 5 119.366 114.411 4.955 1
1 54 . 50 1 1 A 6 6 VAL H H 6 8.476 8.405 0.071 1
1 55 . 50 1 1 A 6 6 VAL HA H 6 5.026 5.915 -0.889 1
1 63 . 50 1 1 A 6 6 VAL C C 6 176.674 174.972 1.702 1
1 64 . 50 1 1 A 6 6 VAL CA C 6 61.008 60.985 0.023 1
1 65 . 50 1 1 A 6 6 VAL CB C 6 33.861 34.520 -0.659 1
1 68 . 50 1 1 A 6 6 VAL N N 6 121.384 122.800 -1.416 1
1 69 . 50 1 1 A 7 7 ASP H H 7 8.848 8.811 0.037 1
1 70 . 50 1 1 A 7 7 ASP HA H 7 4.797 4.767 0.030 1
1 73 . 50 1 1 A 7 7 ASP CA C 7 52.834 54.605 -1.771 1
1 74 . 50 1 1 A 7 7 ASP CB C 7 42.219 42.307 -0.088 1
1 75 . 50 1 1 A 7 7 ASP N N 7 127.061 127.360 -0.299 1
1 76 . 50 1 1 A 8 8 GLY C C 8 175.143 174.459 0.684 1
1 77 . 50 1 1 A 8 8 GLY CA C 8 46.553 47.050 -0.497 1
1 78 . 50 1 1 A 9 9 GLN H H 9 8.408 7.742 0.666 1
1 79 . 50 1 1 A 9 9 GLN HA H 9 4.541 4.211 0.330 1
1 86 . 50 1 1 A 9 9 GLN C C 9 176.463 177.026 -0.563 1
1 87 . 50 1 1 A 9 9 GLN CA C 9 55.167 55.080 0.087 1
1 88 . 50 1 1 A 9 9 GLN CB C 9 29.376 27.743 1.633 1
1 90 . 50 1 1 A 9 9 GLN N N 9 118.300 116.243 2.057 1
1 92 . 50 1 1 A 10 10 GLY H H 10 8.162 8.232 -0.070 1
1 93 . 50 1 1 A 10 10 GLY HA2 H 10 4.174 3.874 0.300 1
1 94 . 50 1 1 A 10 10 GLY HA3 H 10 3.521 3.875 -0.354 1
1 95 . 50 1 1 A 10 10 GLY C C 10 174.092 174.411 -0.319 1
1 96 . 50 1 1 A 10 10 GLY CA C 10 45.558 46.097 -0.539 1
1 97 . 50 1 1 A 10 10 GLY N N 10 108.747 110.422 -1.675 1
1 98 . 50 1 1 A 11 11 GLN H H 11 8.507 7.306 1.201 1
1 99 . 50 1 1 A 11 11 GLN HA H 11 4.202 4.184 0.018 1
1 106 . 50 1 1 A 11 11 GLN C C 11 173.992 173.723 0.269 1
1 107 . 50 1 1 A 11 11 GLN CA C 11 55.098 54.138 0.960 1
1 108 . 50 1 1 A 11 11 GLN CB C 11 29.097 29.773 -0.676 1
1 110 . 50 1 1 A 11 11 GLN N N 11 122.979 119.155 3.824 1
1 112 . 50 1 1 A 12 12 ALA H H 12 8.259 8.614 -0.355 1
1 113 . 50 1 1 A 12 12 ALA HA H 12 5.156 5.208 -0.052 1
1 117 . 50 1 1 A 12 12 ALA C C 12 177.284 176.107 1.177 1
1 118 . 50 1 1 A 12 12 ALA CA C 12 51.087 50.531 0.556 1
1 119 . 50 1 1 A 12 12 ALA CB C 12 20.500 19.390 1.110 1
1 120 . 50 1 1 A 12 12 ALA N N 12 127.100 127.636 -0.536 1
1 121 . 50 1 1 A 13 13 TRP H H 13 9.245 8.398 0.847 1
1 122 . 50 1 1 A 13 13 TRP HA H 13 4.717 5.238 -0.521 1
1 131 . 50 1 1 A 13 13 TRP C C 13 175.108 174.261 0.847 1
1 132 . 50 1 1 A 13 13 TRP CA C 13 55.966 55.269 0.697 1
1 133 . 50 1 1 A 13 13 TRP CB C 13 31.912 32.415 -0.503 1
1 139 . 50 1 1 A 13 13 TRP N N 13 123.088 120.893 2.195 1
1 141 . 50 1 1 A 14 14 ARG H H 14 8.575 8.930 -0.355 1
1 142 . 50 1 1 A 14 14 ARG HA H 14 5.335 4.520 0.815 1
1 150 . 50 1 1 A 14 14 ARG C C 14 175.191 174.047 1.144 1
1 151 . 50 1 1 A 14 14 ARG CA C 14 53.106 54.693 -1.587 1
1 152 . 50 1 1 A 14 14 ARG CB C 14 32.749 32.974 -0.225 1
1 154 . 50 1 1 A 14 14 ARG N N 14 121.163 119.259 1.904 1
1 156 . 50 1 1 A 15 15 HIS H H 15 8.595 8.086 0.509 1
1 157 . 50 1 1 A 15 15 HIS HA H 15 4.790 5.214 -0.424 1
1 161 . 50 1 1 A 15 15 HIS C C 15 173.770 174.118 -0.348 1
1 162 . 50 1 1 A 15 15 HIS CA C 15 55.289 54.589 0.700 1
1 163 . 50 1 1 A 15 15 HIS CB C 15 33.208 33.070 0.138 1
1 165 . 50 1 1 A 15 15 HIS N N 15 117.643 118.733 -1.090 1
1 166 . 50 1 1 A 16 16 HIS H H 16 8.993 8.940 0.053 1
1 167 . 50 1 1 A 16 16 HIS HA H 16 5.158 4.780 0.378 1
1 171 . 50 1 1 A 16 16 HIS C C 16 173.608 173.693 -0.085 1
1 172 . 50 1 1 A 16 16 HIS CA C 16 56.450 55.143 1.307 1
1 173 . 50 1 1 A 16 16 HIS CB C 16 34.171 31.065 3.106 1
1 175 . 50 1 1 A 16 16 HIS N N 16 123.520 123.241 0.279 1
1 176 . 50 1 1 A 17 17 ASN H H 17 7.829 8.575 -0.746 1
1 177 . 50 1 1 A 17 17 ASN HA H 17 4.713 5.058 -0.345 1
1 182 . 50 1 1 A 17 17 ASN C C 17 173.682 174.400 -0.718 1
1 183 . 50 1 1 A 17 17 ASN CA C 17 51.822 51.414 0.408 1
1 184 . 50 1 1 A 17 17 ASN CB C 17 43.176 41.602 1.574 1
1 185 . 50 1 1 A 17 17 ASN N N 17 122.213 126.228 -4.015 1
1 187 . 50 1 1 A 18 18 GLY H H 18 8.423 8.409 0.014 1
1 188 . 50 1 1 A 18 18 GLY HA2 H 18 3.931 3.908 0.023 1
1 189 . 50 1 1 A 18 18 GLY HA3 H 18 3.707 4.003 -0.296 1
1 190 . 50 1 1 A 18 18 GLY C C 18 173.985 172.890 1.095 1
1 191 . 50 1 1 A 18 18 GLY CA C 18 43.949 45.094 -1.145 1
1 192 . 50 1 1 A 18 18 GLY N N 18 106.991 109.199 -2.208 1
1 193 . 50 1 1 A 19 19 PHE H H 19 8.338 8.751 -0.413 1
1 194 . 50 1 1 A 19 19 PHE HA H 19 4.068 4.812 -0.744 1
1 197 . 50 1 1 A 19 19 PHE C C 19 176.568 175.190 1.378 1
1 198 . 50 1 1 A 19 19 PHE CA C 19 59.338 58.148 1.190 1
1 199 . 50 1 1 A 19 19 PHE CB C 19 40.201 40.071 0.130 1
1 200 . 50 1 1 A 19 19 PHE N N 19 116.857 120.559 -3.702 1
1 201 . 50 1 1 A 20 20 ASP H H 20 8.794 9.104 -0.310 1
1 202 . 50 1 1 A 20 20 ASP HA H 20 4.485 4.822 -0.337 1
1 205 . 50 1 1 A 20 20 ASP C C 20 177.379 176.939 0.440 1
1 206 . 50 1 1 A 20 20 ASP CA C 20 54.140 54.960 -0.820 1
1 207 . 50 1 1 A 20 20 ASP CB C 20 41.915 40.898 1.017 1
1 208 . 50 1 1 A 20 20 ASP N N 20 123.025 123.595 -0.570 1
1 209 . 50 1 1 A 21 21 PHE H H 21 8.862 9.087 -0.225 1
1 210 . 50 1 1 A 21 21 PHE HA H 21 4.087 4.105 -0.018 1
1 218 . 50 1 1 A 21 21 PHE C C 21 176.952 177.227 -0.275 1
1 219 . 50 1 1 A 21 21 PHE CA C 21 61.095 61.952 -0.857 1
1 220 . 50 1 1 A 21 21 PHE CB C 21 38.678 39.322 -0.644 1
1 226 . 50 1 1 A 21 21 PHE N N 21 127.163 125.864 1.299 1
1 227 . 50 1 1 A 22 22 ALA H H 22 8.561 8.430 0.131 1
1 228 . 50 1 1 A 22 22 ALA HA H 22 3.878 4.031 -0.153 1
1 232 . 50 1 1 A 22 22 ALA C C 22 180.710 179.883 0.827 1
1 233 . 50 1 1 A 22 22 ALA CA C 22 55.211 55.245 -0.034 1
1 234 . 50 1 1 A 22 22 ALA CB C 22 18.321 18.573 -0.252 1
1 235 . 50 1 1 A 22 22 ALA N N 22 120.293 121.314 -1.021 1
1 236 . 50 1 1 A 23 23 VAL H H 23 7.241 7.448 -0.207 1
1 237 . 50 1 1 A 23 23 VAL HA H 23 3.684 3.793 -0.109 1
1 245 . 50 1 1 A 23 23 VAL C C 23 177.101 177.806 -0.705 1
1 246 . 50 1 1 A 23 23 VAL CA C 23 65.237 65.075 0.162 1
1 247 . 50 1 1 A 23 23 VAL CB C 23 31.780 31.410 0.370 1
1 250 . 50 1 1 A 23 23 VAL N N 23 118.775 116.007 2.768 1
1 251 . 50 1 1 A 24 24 ILE H H 24 6.761 8.230 -1.469 1
1 252 . 50 1 1 A 24 24 ILE HA H 24 3.196 3.569 -0.373 1
1 262 . 50 1 1 A 24 24 ILE C C 24 177.287 177.769 -0.482 1
1 263 . 50 1 1 A 24 24 ILE CA C 24 63.404 65.003 -1.599 1
1 264 . 50 1 1 A 24 24 ILE CB C 24 36.294 37.264 -0.970 1
1 268 . 50 1 1 A 24 24 ILE N N 24 119.036 121.367 -2.331 1
1 269 . 50 1 1 A 25 25 LYS H H 25 8.032 7.980 0.052 1
1 270 . 50 1 1 A 25 25 LYS HA H 25 3.809 3.658 0.151 1
1 279 . 50 1 1 A 25 25 LYS C C 25 179.450 178.776 0.674 1
1 280 . 50 1 1 A 25 25 LYS CA C 25 59.621 59.373 0.248 1
1 281 . 50 1 1 A 25 25 LYS CB C 25 32.259 32.124 0.135 1
1 285 . 50 1 1 A 25 25 LYS N N 25 118.368 120.170 -1.802 1
1 286 . 50 1 1 A 26 26 GLU H H 26 7.845 7.814 0.031 1
1 287 . 50 1 1 A 26 26 GLU HA H 26 4.021 4.056 -0.035 1
1 292 . 50 1 1 A 26 26 GLU C C 26 179.191 179.445 -0.254 1
1 293 . 50 1 1 A 26 26 GLU CA C 26 59.530 59.089 0.441 1
1 294 . 50 1 1 A 26 26 GLU CB C 26 29.449 29.529 -0.080 1
1 296 . 50 1 1 A 26 26 GLU N N 26 120.522 120.059 0.463 1
1 297 . 50 1 1 A 27 27 LEU H H 27 8.165 7.788 0.377 1
1 298 . 50 1 1 A 27 27 LEU HA H 27 4.163 4.091 0.072 1
1 308 . 50 1 1 A 27 27 LEU C C 27 177.256 178.264 -1.008 1
1 309 . 50 1 1 A 27 27 LEU CA C 27 58.049 57.665 0.384 1
1 310 . 50 1 1 A 27 27 LEU CB C 27 41.365 41.757 -0.392 1
1 314 . 50 1 1 A 27 27 LEU N N 27 120.879 121.239 -0.360 1
1 315 . 50 1 1 A 28 28 LYS H H 28 8.902 8.405 0.497 1
1 316 . 50 1 1 A 28 28 LYS HA H 28 4.199 4.404 -0.205 1
1 317 . 50 1 1 A 28 28 LYS C C 28 179.707 178.868 0.839 1
1 318 . 50 1 1 A 28 28 LYS CA C 28 60.097 59.802 0.295 1
1 319 . 50 1 1 A 28 28 LYS CB C 28 33.420 32.080 1.340 1
1 320 . 50 1 1 A 28 28 LYS N N 28 120.050 119.867 0.183 1
1 321 . 50 1 1 A 29 29 THR H H 29 8.294 8.173 0.121 1
1 322 . 50 1 1 A 29 29 THR HA H 29 3.892 3.977 -0.085 1
1 327 . 50 1 1 A 29 29 THR C C 29 175.711 176.408 -0.697 1
1 328 . 50 1 1 A 29 29 THR CA C 29 66.846 66.510 0.336 1
1 329 . 50 1 1 A 29 29 THR CB C 29 68.794 68.752 0.042 1
1 331 . 50 1 1 A 29 29 THR N N 29 115.933 116.935 -1.002 1
1 332 . 50 1 1 A 30 30 ALA H H 30 8.244 8.807 -0.563 1
1 333 . 50 1 1 A 30 30 ALA HA H 30 4.241 4.223 0.018 1
1 337 . 50 1 1 A 30 30 ALA C C 30 179.128 179.405 -0.277 1
1 338 . 50 1 1 A 30 30 ALA CA C 30 55.714 55.695 0.019 1
1 339 . 50 1 1 A 30 30 ALA CB C 30 18.955 18.126 0.829 1
1 340 . 50 1 1 A 30 30 ALA N N 30 124.617 123.105 1.512 1
1 341 . 50 1 1 A 31 31 ALA H H 31 8.968 8.638 0.330 1
1 342 . 50 1 1 A 31 31 ALA HA H 31 3.890 4.022 -0.132 1
1 346 . 50 1 1 A 31 31 ALA C C 31 180.352 179.746 0.606 1
1 347 . 50 1 1 A 31 31 ALA CA C 31 55.454 55.420 0.034 1
1 348 . 50 1 1 A 31 31 ALA CB C 31 17.124 18.478 -1.354 1
1 349 . 50 1 1 A 31 31 ALA N N 31 119.327 120.047 -0.720 1
1 350 . 50 1 1 A 32 32 SER H H 32 7.995 7.877 0.118 1
1 351 . 50 1 1 A 32 32 SER HA H 32 4.238 4.248 -0.010 1
1 354 . 50 1 1 A 32 32 SER C C 32 175.612 176.582 -0.970 1
1 355 . 50 1 1 A 32 32 SER CA C 32 61.203 61.007 0.196 1
1 356 . 50 1 1 A 32 32 SER CB C 32 63.406 62.835 0.571 1
1 357 . 50 1 1 A 32 32 SER N N 32 111.962 112.669 -0.707 1
1 358 . 50 1 1 A 33 33 GLN H H 33 8.333 7.822 0.511 1
1 359 . 50 1 1 A 33 33 GLN HA H 33 3.992 4.331 -0.339 1
1 366 . 50 1 1 A 33 33 GLN C C 33 177.486 177.272 0.214 1
1 367 . 50 1 1 A 33 33 GLN CA C 33 58.277 57.882 0.395 1
1 368 . 50 1 1 A 33 33 GLN CB C 33 29.140 30.076 -0.936 1
1 370 . 50 1 1 A 33 33 GLN N N 33 119.527 120.968 -1.441 1
1 372 . 50 1 1 A 34 34 TYR H H 34 8.587 8.362 0.225 1
1 373 . 50 1 1 A 34 34 TYR HA H 34 4.792 4.614 0.178 1
1 380 . 50 1 1 A 34 34 TYR C C 34 176.499 176.647 -0.148 1
1 381 . 50 1 1 A 34 34 TYR CA C 34 57.711 58.802 -1.091 1
1 382 . 50 1 1 A 34 34 TYR CB C 34 39.561 39.201 0.360 1
1 387 . 50 1 1 A 34 34 TYR N N 34 114.610 114.629 -0.019 1
1 388 . 50 1 1 A 35 35 GLY H H 35 7.346 8.347 -1.001 1
1 389 . 50 1 1 A 35 35 GLY HA2 H 35 4.785 4.085 0.700 1
1 390 . 50 1 1 A 35 35 GLY HA3 H 35 4.007 4.091 -0.084 1
1 391 . 50 1 1 A 35 35 GLY C C 35 175.796 173.061 2.735 1
1 392 . 50 1 1 A 35 35 GLY CA C 35 44.355 44.876 -0.521 1
1 393 . 50 1 1 A 35 35 GLY N N 35 108.501 106.716 1.785 1
1 394 . 50 1 1 A 36 36 ALA H H 36 9.363 8.273 1.090 1
1 395 . 50 1 1 A 36 36 ALA HA H 36 4.217 4.737 -0.520 1
1 399 . 50 1 1 A 36 36 ALA C C 36 178.039 177.214 0.825 1
1 400 . 50 1 1 A 36 36 ALA CA C 36 56.114 51.776 4.338 1
1 401 . 50 1 1 A 36 36 ALA CB C 36 19.179 19.559 -0.380 1
1 402 . 50 1 1 A 36 36 ALA N N 36 125.811 122.658 3.153 1
1 403 . 50 1 1 A 37 37 THR H H 37 8.070 8.865 -0.795 1
1 404 . 50 1 1 A 37 37 THR HA H 37 4.570 4.521 0.049 1
1 409 . 50 1 1 A 37 37 THR C C 37 173.685 174.248 -0.563 1
1 410 . 50 1 1 A 37 37 THR CA C 37 59.822 62.956 -3.134 1
1 411 . 50 1 1 A 37 37 THR CB C 37 68.267 71.676 -3.409 1
1 413 . 50 1 1 A 37 37 THR N N 37 129.410 118.978 10.432 1
1 414 . 50 1 1 A 38 38 ALA H H 38 6.853 7.827 -0.974 1
1 415 . 50 1 1 A 38 38 ALA HA H 38 4.601 4.567 0.034 1
1 419 . 50 1 1 A 38 38 ALA CA C 38 50.758 50.747 0.011 1
1 420 . 50 1 1 A 38 38 ALA CB C 38 18.325 19.064 -0.739 1
1 421 . 50 1 1 A 38 38 ALA N N 38 124.674 124.528 0.146 1
1 422 . 50 1 1 A 40 40 TYR HA H 40 4.032 4.036 -0.004 1
1 429 . 50 1 1 A 40 40 TYR C C 40 176.456 177.270 -0.814 1
1 430 . 50 1 1 A 40 40 TYR CA C 40 61.010 61.854 -0.844 1
1 431 . 50 1 1 A 40 40 TYR CB C 40 39.286 38.708 0.578 1
1 436 . 50 1 1 A 41 41 THR H H 41 6.874 8.286 -1.412 1
1 437 . 50 1 1 A 41 41 THR HA H 41 3.616 3.718 -0.102 1
1 442 . 50 1 1 A 41 41 THR C C 41 176.930 176.522 0.408 1
1 443 . 50 1 1 A 41 41 THR CA C 41 65.557 65.382 0.175 1
1 444 . 50 1 1 A 41 41 THR CB C 41 68.228 69.192 -0.964 1
1 446 . 50 1 1 A 41 41 THR N N 41 115.143 113.963 1.180 1
1 447 . 50 1 1 A 42 42 LEU H H 42 8.623 7.393 1.230 1
1 448 . 50 1 1 A 42 42 LEU HA H 42 3.708 4.071 -0.363 1
1 458 . 50 1 1 A 42 42 LEU C C 42 178.206 179.086 -0.880 1
1 459 . 50 1 1 A 42 42 LEU CA C 42 57.417 57.456 -0.039 1
1 460 . 50 1 1 A 42 42 LEU CB C 42 41.342 41.240 0.102 1
1 464 . 50 1 1 A 42 42 LEU N N 42 120.418 118.912 1.506 1
1 465 . 50 1 1 A 43 43 ALA H H 43 7.735 7.890 -0.155 1
1 466 . 50 1 1 A 43 43 ALA HA H 43 4.020 3.937 0.083 1
1 470 . 50 1 1 A 43 43 ALA C C 43 180.826 180.328 0.498 1
1 471 . 50 1 1 A 43 43 ALA CA C 43 54.925 55.043 -0.118 1
1 472 . 50 1 1 A 43 43 ALA CB C 43 17.506 18.206 -0.700 1
1 473 . 50 1 1 A 43 43 ALA N N 43 120.203 121.958 -1.755 1
1 474 . 50 1 1 A 44 44 ILE H H 44 7.149 7.312 -0.163 1
1 475 . 50 1 1 A 44 44 ILE HA H 44 3.603 3.500 0.103 1
1 485 . 50 1 1 A 44 44 ILE C C 44 178.594 177.938 0.656 1
1 486 . 50 1 1 A 44 44 ILE CA C 44 64.782 64.508 0.274 1
1 487 . 50 1 1 A 44 44 ILE CB C 44 37.472 37.546 -0.074 1
1 491 . 50 1 1 A 44 44 ILE N N 44 118.881 119.507 -0.626 1
1 492 . 50 1 1 A 45 45 VAL H H 45 7.968 7.535 0.433 1
1 493 . 50 1 1 A 45 45 VAL HA H 45 2.925 3.290 -0.365 1
1 501 . 50 1 1 A 45 45 VAL C C 45 177.023 176.841 0.182 1
1 502 . 50 1 1 A 45 45 VAL CA C 45 67.081 66.841 0.240 1
1 503 . 50 1 1 A 45 45 VAL CB C 45 30.854 30.817 0.037 1
1 506 . 50 1 1 A 45 45 VAL N N 45 120.764 119.420 1.344 1
1 507 . 50 1 1 A 46 46 GLU H H 46 8.399 8.237 0.162 1
1 508 . 50 1 1 A 46 46 GLU HA H 46 3.848 3.804 0.044 1
1 513 . 50 1 1 A 46 46 GLU C C 46 178.656 179.110 -0.454 1
1 514 . 50 1 1 A 46 46 GLU CA C 46 59.491 59.326 0.165 1
1 515 . 50 1 1 A 46 46 GLU CB C 46 28.991 29.169 -0.178 1
1 517 . 50 1 1 A 46 46 GLU N N 46 116.599 119.737 -3.138 1
1 518 . 50 1 1 A 47 47 SER H H 47 7.273 7.640 -0.367 1
1 519 . 50 1 1 A 47 47 SER HA H 47 4.287 4.093 0.194 1
1 521 . 50 1 1 A 47 47 SER CA C 47 61.047 62.251 -1.204 1
1 522 . 50 1 1 A 47 47 SER CB C 47 63.016 62.934 0.082 1
1 523 . 50 1 1 A 47 47 SER N N 47 113.609 117.894 -4.285 1
1 524 . 50 1 1 A 48 48 VAL H H 48 8.006 8.305 -0.299 1
1 525 . 50 1 1 A 48 48 VAL HA H 48 3.556 3.513 0.043 1
1 533 . 50 1 1 A 48 48 VAL C C 48 177.257 177.387 -0.130 1
1 534 . 50 1 1 A 48 48 VAL CA C 48 65.025 66.541 -1.516 1
1 535 . 50 1 1 A 48 48 VAL CB C 48 31.841 31.424 0.417 1
1 538 . 50 1 1 A 48 48 VAL N N 48 122.327 121.107 1.220 1
1 539 . 50 1 1 A 49 49 ALA H H 49 8.369 7.559 0.810 1
1 540 . 50 1 1 A 49 49 ALA HA H 49 4.115 4.154 -0.039 1
1 544 . 50 1 1 A 49 49 ALA C C 49 177.307 177.330 -0.023 1
1 545 . 50 1 1 A 49 49 ALA CA C 49 53.253 53.125 0.128 1
1 546 . 50 1 1 A 49 49 ALA CB C 49 20.131 18.000 2.131 1
1 547 . 50 1 1 A 49 49 ALA N N 49 118.050 120.714 -2.664 1
1 548 . 50 1 1 A 50 50 ASP H H 50 7.052 7.614 -0.562 1
1 549 . 50 1 1 A 50 50 ASP HA H 50 4.788 4.468 0.320 1
1 552 . 50 1 1 A 50 50 ASP C C 50 175.481 176.017 -0.536 1
1 553 . 50 1 1 A 50 50 ASP CA C 50 53.681 54.258 -0.577 1
1 554 . 50 1 1 A 50 50 ASP CB C 50 39.333 41.088 -1.755 1
1 555 . 50 1 1 A 50 50 ASP N N 50 116.997 117.149 -0.152 1
1 556 . 50 1 1 A 51 51 ASN H H 51 8.535 7.545 0.990 1
1 557 . 50 1 1 A 51 51 ASN HA H 51 4.628 4.864 -0.236 1
1 562 . 50 1 1 A 51 51 ASN C C 51 174.077 175.219 -1.142 1
1 563 . 50 1 1 A 51 51 ASN CA C 51 52.315 52.019 0.296 1
1 564 . 50 1 1 A 51 51 ASN CB C 51 41.928 40.043 1.885 1
1 565 . 50 1 1 A 51 51 ASN N N 51 118.626 117.487 1.139 1
1 567 . 50 1 1 A 52 52 TRP H H 52 8.555 9.035 -0.480 1
1 574 . 50 1 1 A 52 52 TRP C C 52 173.269 176.650 -3.381 1
1 575 . 50 1 1 A 52 52 TRP CA C 52 55.031 56.723 -1.692 1
1 576 . 50 1 1 A 52 52 TRP CB C 52 26.801 29.640 -2.839 1
1 582 . 50 1 1 A 52 52 TRP N N 52 120.693 120.741 -0.048 1
1 584 . 50 1 1 A 53 53 LEU H H 53 7.847 8.900 -1.053 1
1 585 . 50 1 1 A 53 53 LEU HA H 53 4.859 5.415 -0.556 1
1 595 . 50 1 1 A 53 53 LEU C C 53 177.397 175.906 1.491 1
1 596 . 50 1 1 A 53 53 LEU CA C 53 53.619 53.602 0.017 1
1 597 . 50 1 1 A 53 53 LEU CB C 53 41.812 46.257 -4.445 1
1 601 . 50 1 1 A 53 53 LEU N N 53 124.741 120.641 4.100 1
1 602 . 50 1 1 A 54 54 THR H H 54 8.850 8.888 -0.038 1
1 603 . 50 1 1 A 54 54 THR HA H 54 4.598 4.917 -0.319 1
1 608 . 50 1 1 A 54 54 THR CA C 54 60.531 61.962 -1.431 1
1 609 . 50 1 1 A 54 54 THR CB C 54 67.183 69.176 -1.993 1
1 611 . 50 1 1 A 54 54 THR N N 54 113.407 116.700 -3.293 1
1 612 . 50 1 1 A 55 55 PRO HA H 55 4.511 3.789 0.722 1
1 619 . 50 1 1 A 55 55 PRO C C 55 179.383 178.620 0.763 1
1 620 . 50 1 1 A 55 55 PRO CA C 55 67.159 64.639 2.520 1
1 621 . 50 1 1 A 55 55 PRO CB C 55 32.095 31.501 0.594 1
1 622 . 50 1 1 A 56 56 THR H H 56 8.575 7.713 0.862 1
1 623 . 50 1 1 A 56 56 THR HA H 56 4.229 4.097 0.132 1
1 628 . 50 1 1 A 56 56 THR C C 56 176.668 175.541 1.127 1
1 629 . 50 1 1 A 56 56 THR CA C 56 66.943 65.376 1.567 1
1 630 . 50 1 1 A 56 56 THR CB C 56 68.129 68.177 -0.048 1
1 632 . 50 1 1 A 56 56 THR N N 56 114.855 112.037 2.818 1
1 633 . 50 1 1 A 57 57 ASP H H 57 8.730 7.845 0.885 1
1 634 . 50 1 1 A 57 57 ASP HA H 57 4.425 4.389 0.036 1
1 637 . 50 1 1 A 57 57 ASP C C 57 178.351 178.912 -0.561 1
1 638 . 50 1 1 A 57 57 ASP CA C 57 57.963 56.546 1.417 1
1 639 . 50 1 1 A 57 57 ASP CB C 57 40.134 40.434 -0.300 1
1 640 . 50 1 1 A 57 57 ASP N N 57 126.239 120.346 5.893 1
1 641 . 50 1 1 A 58 58 TRP H H 58 8.244 7.923 0.321 1
1 642 . 50 1 1 A 58 58 TRP HA H 58 4.030 4.522 -0.492 1
1 650 . 50 1 1 A 58 58 TRP C C 58 177.432 179.465 -2.033 1
1 651 . 50 1 1 A 58 58 TRP CA C 58 62.731 59.995 2.736 1
1 652 . 50 1 1 A 58 58 TRP CB C 58 29.122 29.105 0.017 1
1 657 . 50 1 1 A 58 58 TRP N N 58 119.241 120.749 -1.508 1
1 659 . 50 1 1 A 59 59 ASN H H 59 8.098 8.235 -0.137 1
1 660 . 50 1 1 A 59 59 ASN HA H 59 4.424 4.478 -0.054 1
1 663 . 50 1 1 A 59 59 ASN C C 59 176.952 178.130 -1.178 1
1 664 . 50 1 1 A 59 59 ASN CA C 59 58.135 56.330 1.805 1
1 665 . 50 1 1 A 59 59 ASN CB C 59 40.168 37.670 2.498 1
1 666 . 50 1 1 A 59 59 ASN N N 59 115.747 117.360 -1.613 1
1 667 . 50 1 1 A 60 60 THR H H 60 8.712 7.832 0.880 1
1 668 . 50 1 1 A 60 60 THR HA H 60 3.717 4.029 -0.312 1
1 673 . 50 1 1 A 60 60 THR C C 60 176.044 176.620 -0.576 1
1 674 . 50 1 1 A 60 60 THR CA C 60 66.576 67.041 -0.465 1
1 675 . 50 1 1 A 60 60 THR CB C 60 69.251 67.916 1.335 1
1 677 . 50 1 1 A 60 60 THR N N 60 114.896 118.761 -3.865 1
1 678 . 50 1 1 A 61 61 LEU H H 61 8.485 8.524 -0.039 1
1 679 . 50 1 1 A 61 61 LEU HA H 61 3.391 4.077 -0.686 1
1 689 . 50 1 1 A 61 61 LEU C C 61 177.433 178.601 -1.168 1
1 690 . 50 1 1 A 61 61 LEU CA C 61 58.354 58.552 -0.198 1
1 691 . 50 1 1 A 61 61 LEU CB C 61 41.761 42.234 -0.473 1
1 695 . 50 1 1 A 61 61 LEU N N 61 123.433 122.122 1.311 1
1 696 . 50 1 1 A 62 62 VAL H H 62 8.073 8.404 -0.331 1
1 697 . 50 1 1 A 62 62 VAL HA H 62 3.207 3.801 -0.594 1
1 705 . 50 1 1 A 62 62 VAL C C 62 177.585 177.561 0.024 1
1 706 . 50 1 1 A 62 62 VAL CA C 62 67.345 65.153 2.192 1
1 707 . 50 1 1 A 62 62 VAL CB C 62 30.905 30.528 0.377 1
1 710 . 50 1 1 A 62 62 VAL N N 62 116.018 118.558 -2.540 1
1 711 . 50 1 1 A 63 63 ARG H H 63 7.765 7.901 -0.136 1
1 712 . 50 1 1 A 63 63 ARG HA H 63 3.602 3.943 -0.341 1
1 719 . 50 1 1 A 63 63 ARG C C 63 177.818 178.558 -0.740 1
1 720 . 50 1 1 A 63 63 ARG CA C 63 58.049 59.785 -1.736 1
1 721 . 50 1 1 A 63 63 ARG CB C 63 29.955 30.059 -0.104 1
1 724 . 50 1 1 A 63 63 ARG N N 63 116.700 122.027 -5.327 1
1 725 . 50 1 1 A 64 64 ALA H H 64 7.574 7.818 -0.244 1
1 726 . 50 1 1 A 64 64 ALA HA H 64 4.158 4.102 0.056 1
1 730 . 50 1 1 A 64 64 ALA C C 64 179.886 180.033 -0.147 1
1 731 . 50 1 1 A 64 64 ALA CA C 64 54.007 55.164 -1.157 1
1 732 . 50 1 1 A 64 64 ALA CB C 64 19.147 18.591 0.556 1
1 733 . 50 1 1 A 64 64 ALA N N 64 117.555 121.901 -4.346 1
1 734 . 50 1 1 A 65 65 VAL H H 65 7.554 7.971 -0.417 1
1 735 . 50 1 1 A 65 65 VAL HA H 65 4.253 3.836 0.417 1
1 743 . 50 1 1 A 65 65 VAL C C 65 174.180 175.620 -1.440 1
1 744 . 50 1 1 A 65 65 VAL CA C 65 62.683 65.046 -2.363 1
1 745 . 50 1 1 A 65 65 VAL CB C 65 33.458 31.497 1.961 1
1 748 . 50 1 1 A 65 65 VAL N N 65 110.013 116.258 -6.245 1
1 749 . 50 1 1 A 66 66 LEU H H 66 7.792 7.636 0.156 1
1 750 . 50 1 1 A 66 66 LEU HA H 66 4.790 4.630 0.160 1
1 760 . 50 1 1 A 66 66 LEU C C 66 177.537 174.522 3.015 1
1 761 . 50 1 1 A 66 66 LEU CA C 66 52.823 53.217 -0.394 1
1 762 . 50 1 1 A 66 66 LEU CB C 66 44.071 45.305 -1.234 1
1 766 . 50 1 1 A 66 66 LEU N N 66 118.967 121.578 -2.611 1
1 767 . 50 1 1 A 67 67 SER H H 67 9.208 8.387 0.821 1
1 768 . 50 1 1 A 67 67 SER HA H 67 4.414 4.938 -0.524 1
1 771 . 50 1 1 A 67 67 SER CA C 67 57.943 57.080 0.863 1
1 772 . 50 1 1 A 67 67 SER CB C 67 64.743 67.275 -2.532 1
1 773 . 50 1 1 A 67 67 SER N N 67 116.378 115.026 1.352 1
1 774 . 50 1 1 A 69 69 GLY HA2 H 69 3.916 3.758 0.158 1
1 775 . 50 1 1 A 69 69 GLY HA3 H 69 3.867 3.794 0.073 1
1 776 . 50 1 1 A 69 69 GLY C C 69 176.783 175.556 1.227 1
1 777 . 50 1 1 A 69 69 GLY CA C 69 46.977 46.782 0.195 1
1 778 . 50 1 1 A 70 70 ASP H H 70 7.674 8.180 -0.506 1
1 779 . 50 1 1 A 70 70 ASP HA H 70 4.511 3.645 0.866 1
1 782 . 50 1 1 A 70 70 ASP C C 70 178.096 178.206 -0.110 1
1 783 . 50 1 1 A 70 70 ASP CA C 70 57.262 56.350 0.912 1
1 784 . 50 1 1 A 70 70 ASP CB C 70 40.594 39.635 0.959 1
1 785 . 50 1 1 A 70 70 ASP N N 70 123.930 121.850 2.080 1
1 786 . 50 1 1 A 71 71 HIS H H 71 8.729 7.866 0.863 1
1 787 . 50 1 1 A 71 71 HIS HA H 71 4.235 4.187 0.048 1
1 790 . 50 1 1 A 71 71 HIS C C 71 176.769 176.664 0.105 1
1 791 . 50 1 1 A 71 71 HIS CA C 71 60.041 60.033 0.008 1
1 792 . 50 1 1 A 71 71 HIS CB C 71 30.682 30.353 0.329 1
1 793 . 50 1 1 A 71 71 HIS N N 71 121.003 119.533 1.470 1
1 794 . 50 1 1 A 72 72 LEU H H 72 7.620 7.986 -0.366 1
1 795 . 50 1 1 A 72 72 LEU HA H 72 3.769 3.918 -0.149 1
1 805 . 50 1 1 A 72 72 LEU C C 72 180.275 179.228 1.047 1
1 806 . 50 1 1 A 72 72 LEU CA C 72 58.192 58.014 0.178 1
1 807 . 50 1 1 A 72 72 LEU CB C 72 41.381 41.242 0.139 1
1 811 . 50 1 1 A 72 72 LEU N N 72 118.569 118.530 0.039 1
1 812 . 50 1 1 A 73 73 LEU H H 73 7.542 7.571 -0.029 1
1 813 . 50 1 1 A 73 73 LEU HA H 73 4.107 4.257 -0.150 1
1 823 . 50 1 1 A 73 73 LEU C C 73 179.436 179.195 0.241 1
1 824 . 50 1 1 A 73 73 LEU CA C 73 58.026 57.211 0.815 1
1 825 . 50 1 1 A 73 73 LEU CB C 73 41.638 42.124 -0.486 1
1 829 . 50 1 1 A 73 73 LEU N N 73 121.418 120.402 1.016 1
1 830 . 50 1 1 A 74 74 TRP H H 74 8.786 7.924 0.862 1
1 831 . 50 1 1 A 74 74 TRP HA H 74 3.589 5.493 -1.904 1
1 840 . 50 1 1 A 74 74 TRP C C 74 176.816 178.725 -1.909 1
1 841 . 50 1 1 A 74 74 TRP CA C 74 63.046 59.738 3.308 1
1 842 . 50 1 1 A 74 74 TRP CB C 74 28.065 28.986 -0.921 1
1 848 . 50 1 1 A 74 74 TRP N N 74 121.111 118.145 2.966 1
1 850 . 50 1 1 A 75 75 LYS H H 75 8.939 7.635 1.304 1
1 851 . 50 1 1 A 75 75 LYS HA H 75 3.055 4.168 -1.113 1
1 860 . 50 1 1 A 75 75 LYS C C 75 177.967 179.078 -1.111 1
1 861 . 50 1 1 A 75 75 LYS CA C 75 60.029 58.712 1.317 1
1 862 . 50 1 1 A 75 75 LYS CB C 75 32.533 32.902 -0.369 1
1 866 . 50 1 1 A 75 75 LYS N N 75 119.783 118.592 1.191 1
1 867 . 50 1 1 A 76 76 SER H H 76 7.832 7.799 0.033 1
1 868 . 50 1 1 A 76 76 SER HA H 76 4.040 4.320 -0.280 1
1 871 . 50 1 1 A 76 76 SER C C 76 177.816 176.755 1.061 1
1 872 . 50 1 1 A 76 76 SER CA C 76 62.105 61.517 0.588 1
1 873 . 50 1 1 A 76 76 SER CB C 76 62.679 62.989 -0.310 1
1 874 . 50 1 1 A 76 76 SER N N 76 113.395 114.843 -1.448 1
1 875 . 50 1 1 A 77 77 GLU H H 77 7.590 7.692 -0.102 1
1 876 . 50 1 1 A 77 77 GLU HA H 77 4.042 4.338 -0.296 1
1 881 . 50 1 1 A 77 77 GLU C C 77 177.809 178.657 -0.848 1
1 882 . 50 1 1 A 77 77 GLU CA C 77 58.270 58.323 -0.053 1
1 883 . 50 1 1 A 77 77 GLU CB C 77 29.208 29.446 -0.238 1
1 885 . 50 1 1 A 77 77 GLU N N 77 121.574 122.080 -0.506 1
1 886 . 50 1 1 A 78 78 PHE H H 78 9.081 7.884 1.197 1
1 887 . 50 1 1 A 78 78 PHE HA H 78 3.778 4.250 -0.472 1
1 895 . 50 1 1 A 78 78 PHE C C 78 178.114 177.270 0.844 1
1 896 . 50 1 1 A 78 78 PHE CA C 78 60.629 61.507 -0.878 1
1 897 . 50 1 1 A 78 78 PHE CB C 78 38.295 39.026 -0.731 1
1 902 . 50 1 1 A 78 78 PHE N N 78 122.682 122.865 -0.183 1
1 903 . 50 1 1 A 79 79 PHE H H 79 8.890 8.065 0.825 1
1 904 . 50 1 1 A 79 79 PHE HA H 79 3.800 4.069 -0.269 1
1 912 . 50 1 1 A 79 79 PHE C C 79 178.354 178.184 0.170 1
1 913 . 50 1 1 A 79 79 PHE CA C 79 60.704 62.086 -1.382 1
1 914 . 50 1 1 A 79 79 PHE CB C 79 37.184 38.515 -1.331 1
1 920 . 50 1 1 A 79 79 PHE N N 79 121.056 118.322 2.734 1
1 921 . 50 1 1 A 80 80 GLU H H 80 7.793 8.258 -0.465 1
1 922 . 50 1 1 A 80 80 GLU HA H 80 4.082 4.045 0.037 1
1 927 . 50 1 1 A 80 80 GLU C C 80 179.068 179.381 -0.313 1
1 928 . 50 1 1 A 80 80 GLU CA C 80 59.735 59.353 0.382 1
1 929 . 50 1 1 A 80 80 GLU CB C 80 28.722 29.293 -0.571 1
1 931 . 50 1 1 A 80 80 GLU N N 80 120.312 118.756 1.556 1
1 932 . 50 1 1 A 81 81 ASN H H 81 8.624 8.690 -0.066 1
1 933 . 50 1 1 A 81 81 ASN HA H 81 4.521 4.499 0.022 1
1 938 . 50 1 1 A 81 81 ASN C C 81 179.262 178.136 1.126 1
1 939 . 50 1 1 A 81 81 ASN CA C 81 55.504 56.359 -0.855 1
1 940 . 50 1 1 A 81 81 ASN CB C 81 37.517 37.889 -0.372 1
1 941 . 50 1 1 A 81 81 ASN N N 81 119.338 118.295 1.043 1
1 943 . 50 1 1 A 82 82 CYS H H 82 8.554 8.016 0.538 1
1 944 . 50 1 1 A 82 82 CYS HA H 82 3.792 4.115 -0.323 1
1 947 . 50 1 1 A 82 82 CYS C C 82 176.478 176.830 -0.352 1
1 948 . 50 1 1 A 82 82 CYS CA C 82 65.232 63.391 1.841 1
1 949 . 50 1 1 A 82 82 CYS CB C 82 26.762 27.305 -0.543 1
1 950 . 50 1 1 A 82 82 CYS N N 82 120.576 117.595 2.981 1
1 951 . 50 1 1 A 83 83 ARG H H 83 8.522 7.922 0.600 1
1 952 . 50 1 1 A 83 83 ARG HA H 83 3.932 4.150 -0.218 1
1 960 . 50 1 1 A 83 83 ARG C C 83 179.138 178.693 0.445 1
1 961 . 50 1 1 A 83 83 ARG CA C 83 60.443 59.060 1.383 1
1 962 . 50 1 1 A 83 83 ARG CB C 83 29.550 29.844 -0.294 1
1 965 . 50 1 1 A 83 83 ARG N N 83 123.035 119.700 3.335 1
1 967 . 50 1 1 A 84 84 ASP H H 84 7.791 8.339 -0.548 1
1 968 . 50 1 1 A 84 84 ASP HA H 84 4.353 4.386 -0.033 1
1 971 . 50 1 1 A 84 84 ASP C C 84 178.649 178.511 0.138 1
1 972 . 50 1 1 A 84 84 ASP CA C 84 57.767 57.546 0.221 1
1 973 . 50 1 1 A 84 84 ASP CB C 84 41.305 41.550 -0.245 1
1 974 . 50 1 1 A 84 84 ASP N N 84 120.332 119.437 0.895 1
1 975 . 50 1 1 A 85 85 THR H H 85 8.370 8.165 0.205 1
1 976 . 50 1 1 A 85 85 THR HA H 85 3.730 3.925 -0.195 1
1 981 . 50 1 1 A 85 85 THR C C 85 175.198 176.406 -1.208 1
1 982 . 50 1 1 A 85 85 THR CA C 85 66.830 65.536 1.294 1
1 983 . 50 1 1 A 85 85 THR CB C 85 68.533 68.293 0.240 1
1 985 . 50 1 1 A 85 85 THR N N 85 117.360 115.597 1.763 1
1 986 . 50 1 1 A 86 86 ALA H H 86 8.845 8.403 0.442 1
1 987 . 50 1 1 A 86 86 ALA HA H 86 3.991 4.058 -0.067 1
1 991 . 50 1 1 A 86 86 ALA C C 86 179.980 179.436 0.544 1
1 992 . 50 1 1 A 86 86 ALA CA C 86 55.769 55.549 0.220 1
1 993 . 50 1 1 A 86 86 ALA CB C 86 17.881 18.343 -0.462 1
1 994 . 50 1 1 A 86 86 ALA N N 86 123.613 123.607 0.006 1
1 995 . 50 1 1 A 87 87 LYS H H 87 7.686 8.328 -0.642 1
1 996 . 50 1 1 A 87 87 LYS HA H 87 4.099 4.068 0.031 1
1 1005 . 50 1 1 A 87 87 LYS C C 87 179.592 178.504 1.088 1
1 1006 . 50 1 1 A 87 87 LYS CA C 87 59.708 59.148 0.560 1
1 1007 . 50 1 1 A 87 87 LYS CB C 87 32.054 31.911 0.143 1
1 1011 . 50 1 1 A 87 87 LYS N N 87 119.623 116.493 3.130 1
1 1012 . 50 1 1 A 88 88 ARG H H 88 7.683 7.838 -0.155 1
1 1013 . 50 1 1 A 88 88 ARG HA H 88 4.051 4.151 -0.100 1
1 1020 . 50 1 1 A 88 88 ARG C C 88 180.053 178.617 1.436 1
1 1021 . 50 1 1 A 88 88 ARG CA C 88 59.558 58.999 0.559 1
1 1022 . 50 1 1 A 88 88 ARG CB C 88 29.684 29.989 -0.305 1
1 1025 . 50 1 1 A 88 88 ARG N N 88 120.788 119.216 1.572 1
1 1026 . 50 1 1 A 89 89 ASN H H 89 8.973 8.083 0.890 1
1 1027 . 50 1 1 A 89 89 ASN HA H 89 4.354 4.653 -0.299 1
1 1032 . 50 1 1 A 89 89 ASN C C 89 178.382 178.574 -0.192 1
1 1033 . 50 1 1 A 89 89 ASN CA C 89 55.334 55.874 -0.540 1
1 1034 . 50 1 1 A 89 89 ASN CB C 89 37.864 38.233 -0.369 1
1 1035 . 50 1 1 A 89 89 ASN N N 89 121.012 117.480 3.532 1
1 1037 . 50 1 1 A 90 90 GLN H H 90 8.152 7.826 0.326 1
1 1038 . 50 1 1 A 90 90 GLN HA H 90 4.020 4.234 -0.214 1
1 1045 . 50 1 1 A 90 90 GLN C C 90 179.075 178.589 0.486 1
1 1046 . 50 1 1 A 90 90 GLN CA C 90 59.318 58.732 0.586 1
1 1047 . 50 1 1 A 90 90 GLN CB C 90 28.049 28.643 -0.594 1
1 1049 . 50 1 1 A 90 90 GLN N N 90 122.122 120.733 1.389 1
1 1051 . 50 1 1 A 91 91 GLN H H 91 7.514 8.401 -0.887 1
1 1052 . 50 1 1 A 91 91 GLN HA H 91 4.053 4.096 -0.043 1
1 1059 . 50 1 1 A 91 91 GLN C C 91 177.081 177.899 -0.818 1
1 1060 . 50 1 1 A 91 91 GLN CA C 91 58.031 58.795 -0.764 1
1 1061 . 50 1 1 A 91 91 GLN CB C 91 28.365 27.826 0.539 1
1 1063 . 50 1 1 A 91 91 GLN N N 91 118.124 118.357 -0.233 1
1 1065 . 50 1 1 A 92 92 ALA H H 92 7.704 7.574 0.130 1
1 1066 . 50 1 1 A 92 92 ALA HA H 92 4.246 4.323 -0.077 1
1 1070 . 50 1 1 A 92 92 ALA C C 92 178.450 178.156 0.294 1
1 1071 . 50 1 1 A 92 92 ALA CA C 92 52.671 52.389 0.282 1
1 1072 . 50 1 1 A 92 92 ALA CB C 92 19.316 19.583 -0.267 1
1 1073 . 50 1 1 A 92 92 ALA N N 92 119.880 119.737 0.143 1
1 1074 . 50 1 1 A 93 93 GLY H H 93 7.693 7.839 -0.146 1
1 1075 . 50 1 1 A 93 93 GLY HA2 H 93 3.941 3.963 -0.022 1
1 1076 . 50 1 1 A 93 93 GLY HA3 H 93 3.744 3.973 -0.229 1
1 1077 . 50 1 1 A 93 93 GLY C C 93 174.344 174.917 -0.573 1
1 1078 . 50 1 1 A 93 93 GLY CA C 93 45.949 46.438 -0.489 1
1 1079 . 50 1 1 A 93 93 GLY N N 93 105.347 107.809 -2.462 1
1 1080 . 50 1 1 A 94 94 ASN H H 94 7.076 8.565 -1.489 1
1 1081 . 50 1 1 A 94 94 ASN HA H 94 4.115 4.818 -0.703 1
1 1085 . 50 1 1 A 94 94 ASN C C 94 175.410 175.792 -0.382 1
1 1086 . 50 1 1 A 94 94 ASN CA C 94 52.651 52.714 -0.063 1
1 1087 . 50 1 1 A 94 94 ASN CB C 94 38.330 39.926 -1.596 1
1 1088 . 50 1 1 A 94 94 ASN N N 94 115.747 117.862 -2.115 1
1 1090 . 50 1 1 A 95 95 GLY H H 95 8.236 8.240 -0.004 1
1 1091 . 50 1 1 A 95 95 GLY HA2 H 95 3.633 3.399 0.234 1
1 1092 . 50 1 1 A 95 95 GLY HA3 H 95 3.633 3.599 0.034 1
1 1093 . 50 1 1 A 95 95 GLY C C 95 174.450 173.013 1.437 1
1 1094 . 50 1 1 A 95 95 GLY CA C 95 45.522 46.520 -0.998 1
1 1095 . 50 1 1 A 95 95 GLY N N 95 109.166 108.499 0.667 1
1 1096 . 50 1 1 A 96 96 TRP H H 96 7.899 7.868 0.031 1
1 1097 . 50 1 1 A 96 96 TRP HA H 96 5.241 5.212 0.029 1
1 1106 . 50 1 1 A 96 96 TRP C C 96 175.661 174.399 1.262 1
1 1107 . 50 1 1 A 96 96 TRP CA C 96 55.090 55.702 -0.612 1
1 1108 . 50 1 1 A 96 96 TRP CB C 96 27.138 34.489 -7.351 1
1 1114 . 50 1 1 A 96 96 TRP N N 96 122.840 118.946 3.894 1
1 1116 . 50 1 1 A 97 97 ASP H H 97 7.344 9.075 -1.731 1
1 1117 . 50 1 1 A 97 97 ASP HA H 97 4.829 5.341 -0.512 1
1 1120 . 50 1 1 A 97 97 ASP C C 97 175.019 176.583 -1.564 1
1 1121 . 50 1 1 A 97 97 ASP CA C 97 52.149 53.114 -0.965 1
1 1122 . 50 1 1 A 97 97 ASP CB C 97 42.697 44.307 -1.610 1
1 1123 . 50 1 1 A 97 97 ASP N N 97 126.861 120.682 6.179 1
1 1124 . 50 1 1 A 98 98 PHE H H 98 8.566 9.166 -0.600 1
1 1125 . 50 1 1 A 98 98 PHE HA H 98 3.727 4.424 -0.697 1
1 1133 . 50 1 1 A 98 98 PHE C C 98 177.443 177.092 0.351 1
1 1134 . 50 1 1 A 98 98 PHE CA C 98 62.471 60.153 2.318 1
1 1135 . 50 1 1 A 98 98 PHE CB C 98 39.919 38.120 1.799 1
1 1141 . 50 1 1 A 98 98 PHE N N 98 117.781 122.560 -4.779 1
1 1142 . 50 1 1 A 99 99 ASP H H 99 8.259 8.596 -0.337 1
1 1143 . 50 1 1 A 99 99 ASP HA H 99 3.960 4.060 -0.100 1
1 1146 . 50 1 1 A 99 99 ASP C C 99 178.132 178.400 -0.268 1
1 1147 . 50 1 1 A 99 99 ASP CA C 99 57.658 57.229 0.429 1
1 1148 . 50 1 1 A 99 99 ASP CB C 99 38.572 41.010 -2.438 1
1 1149 . 50 1 1 A 99 99 ASP N N 99 121.709 121.026 0.683 1
1 1150 . 50 1 1 A 100 100 MET H H 100 8.008 8.197 -0.189 1
1 1151 . 50 1 1 A 100 100 MET HA H 100 3.644 4.382 -0.738 1
1 1156 . 50 1 1 A 100 100 MET C C 100 180.008 177.280 2.728 1
1 1157 . 50 1 1 A 100 100 MET CA C 100 58.598 58.251 0.347 1
1 1158 . 50 1 1 A 100 100 MET CB C 100 33.423 32.943 0.480 1
1 1160 . 50 1 1 A 100 100 MET N N 100 119.668 117.800 1.868 1
1 1161 . 50 1 1 A 101 101 LEU H H 101 7.961 7.805 0.156 1
1 1162 . 50 1 1 A 101 101 LEU HA H 101 3.523 4.479 -0.956 1
1 1172 . 50 1 1 A 101 101 LEU C C 101 173.873 175.040 -1.167 1
1 1173 . 50 1 1 A 101 101 LEU CA C 101 58.743 54.227 4.516 1
1 1174 . 50 1 1 A 101 101 LEU CB C 101 42.632 41.269 1.363 1
1 1178 . 50 1 1 A 101 101 LEU N N 101 119.752 120.375 -0.623 1
1 1179 . 50 1 1 A 102 102 THR H H 102 6.955 8.110 -1.155 1
1 1180 . 50 1 1 A 102 102 THR HA H 102 4.134 4.627 -0.493 1
1 1185 . 50 1 1 A 102 102 THR C C 102 176.513 173.458 3.055 1
1 1186 . 50 1 1 A 102 102 THR CA C 102 61.125 61.194 -0.069 1
1 1187 . 50 1 1 A 102 102 THR CB C 102 71.415 70.770 0.645 1
1 1189 . 50 1 1 A 102 102 THR N N 102 124.665 116.102 8.563 1
1 1190 . 50 1 1 A 103 103 GLY H H 103 7.816 9.169 -1.353 1
1 1191 . 50 1 1 A 103 103 GLY HA2 H 103 3.824 4.028 -0.204 1
1 1192 . 50 1 1 A 103 103 GLY HA3 H 103 3.824 4.152 -0.328 1
1 1193 . 50 1 1 A 103 103 GLY C C 103 174.126 175.097 -0.971 1
1 1194 . 50 1 1 A 103 103 GLY CA C 103 47.805 46.761 1.044 1
1 1195 . 50 1 1 A 103 103 GLY N N 103 114.191 109.571 4.620 1
1 1196 . 50 1 1 A 104 104 SER H H 104 8.860 7.353 1.507 1
1 1197 . 50 1 1 A 104 104 SER HA H 104 4.758 4.465 0.293 1
1 1200 . 50 1 1 A 104 104 SER C C 104 174.591 175.153 -0.562 1
1 1201 . 50 1 1 A 104 104 SER CA C 104 56.755 60.987 -4.232 1
1 1202 . 50 1 1 A 104 104 SER CB C 104 65.050 63.611 1.439 1
1 1203 . 50 1 1 A 104 104 SER N N 104 114.771 116.120 -1.349 1
1 1204 . 50 1 1 A 105 105 GLY H H 105 8.788 7.905 0.883 1
1 1205 . 50 1 1 A 105 105 GLY HA2 H 105 3.733 3.941 -0.208 1
1 1206 . 50 1 1 A 105 105 GLY HA3 H 105 3.733 3.956 -0.223 1
1 1207 . 50 1 1 A 105 105 GLY CA C 105 47.247 46.282 0.965 1
1 1208 . 50 1 1 A 105 105 GLY N N 105 110.394 108.406 1.988 1
1 1209 . 50 1 1 A 106 106 ASN HA H 106 4.454 4.621 -0.167 1
1 1212 . 50 1 1 A 106 106 ASN C C 106 175.180 176.405 -1.225 1
1 1213 . 50 1 1 A 106 106 ASN CA C 106 54.492 54.180 0.312 1
1 1214 . 50 1 1 A 106 106 ASN CB C 106 37.282 39.844 -2.562 1
1 1215 . 50 1 1 A 107 107 TYR H H 107 8.241 8.589 -0.348 1
1 1216 . 50 1 1 A 107 107 TYR HA H 107 4.335 4.661 -0.326 1
1 1223 . 50 1 1 A 107 107 TYR C C 107 173.954 176.415 -2.461 1
1 1224 . 50 1 1 A 107 107 TYR CA C 107 57.727 57.724 0.003 1
1 1225 . 50 1 1 A 107 107 TYR CB C 107 37.063 39.644 -2.581 1
1 1230 . 50 1 1 A 107 107 TYR N N 107 120.708 115.696 5.012 1
1 1231 . 50 1 1 A 108 108 SER H H 108 7.117 7.442 -0.325 1
1 1232 . 50 1 1 A 108 108 SER HA H 108 4.221 4.364 -0.143 1
1 1235 . 50 1 1 A 108 108 SER C C 108 174.834 174.033 0.801 1
1 1236 . 50 1 1 A 108 108 SER CA C 108 59.859 61.381 -1.522 1
1 1237 . 50 1 1 A 108 108 SER CB C 108 63.846 63.445 0.401 1
1 1238 . 50 1 1 A 108 108 SER N N 108 113.362 115.038 -1.676 1
1 1239 . 50 1 1 A 109 109 SER H H 109 8.053 7.840 0.213 1
1 1240 . 50 1 1 A 109 109 SER HA H 109 4.560 4.205 0.355 1
1 1243 . 50 1 1 A 109 109 SER CA C 109 57.141 60.802 -3.661 1
1 1244 . 50 1 1 A 109 109 SER CB C 109 64.874 61.842 3.032 1
1 1245 . 50 1 1 A 109 109 SER N N 109 116.657 114.997 1.660 1
1 1246 . 50 1 1 A 110 110 THR HA H 110 3.541 3.903 -0.362 1
1 1251 . 50 1 1 A 110 110 THR C C 110 175.477 176.095 -0.618 1
1 1252 . 50 1 1 A 110 110 THR CA C 110 66.443 65.804 0.639 1
1 1253 . 50 1 1 A 110 110 THR CB C 110 68.091 68.481 -0.390 1
1 1255 . 50 1 1 A 111 111 ASP H H 111 8.224 8.070 0.154 1
1 1256 . 50 1 1 A 111 111 ASP HA H 111 4.237 4.309 -0.072 1
1 1259 . 50 1 1 A 111 111 ASP C C 111 177.520 178.377 -0.857 1
1 1260 . 50 1 1 A 111 111 ASP CA C 111 57.559 56.915 0.644 1
1 1261 . 50 1 1 A 111 111 ASP CB C 111 40.292 41.247 -0.955 1
1 1262 . 50 1 1 A 111 111 ASP N N 111 119.490 121.081 -1.591 1
1 1263 . 50 1 1 A 112 112 ALA H H 112 7.431 8.013 -0.582 1
1 1264 . 50 1 1 A 112 112 ALA HA H 112 4.191 4.025 0.166 1
1 1268 . 50 1 1 A 112 112 ALA C C 112 180.646 179.785 0.861 1
1 1269 . 50 1 1 A 112 112 ALA CA C 112 54.534 54.663 -0.129 1
1 1270 . 50 1 1 A 112 112 ALA CB C 112 18.992 18.127 0.865 1
1 1271 . 50 1 1 A 112 112 ALA N N 112 119.710 121.086 -1.376 1
1 1272 . 50 1 1 A 113 113 GLN H H 113 7.576 7.818 -0.242 1
1 1273 . 50 1 1 A 113 113 GLN HA H 113 3.562 3.695 -0.133 1
1 1278 . 50 1 1 A 113 113 GLN C C 113 176.756 177.660 -0.904 1
1 1279 . 50 1 1 A 113 113 GLN CA C 113 57.736 58.342 -0.606 1
1 1280 . 50 1 1 A 113 113 GLN CB C 113 29.110 27.643 1.467 1
1 1281 . 50 1 1 A 113 113 GLN N N 113 117.518 115.994 1.524 1
1 1283 . 50 1 1 A 114 114 MET H H 114 8.192 7.610 0.582 1
1 1284 . 50 1 1 A 114 114 MET HA H 114 4.231 4.231 0.000 1
1 1289 . 50 1 1 A 114 114 MET C C 114 175.648 177.202 -1.554 1
1 1290 . 50 1 1 A 114 114 MET CA C 114 57.446 57.450 -0.004 1
1 1291 . 50 1 1 A 114 114 MET CB C 114 33.570 32.794 0.776 1
1 1293 . 50 1 1 A 114 114 MET N N 114 111.509 119.670 -8.161 1
1 1294 . 50 1 1 A 115 115 GLN H H 115 6.940 7.207 -0.267 1
1 1295 . 50 1 1 A 115 115 GLN HA H 115 4.307 4.516 -0.209 1
1 1302 . 50 1 1 A 115 115 GLN C C 115 176.270 175.099 1.171 1
1 1303 . 50 1 1 A 115 115 GLN CA C 115 54.680 55.161 -0.481 1
1 1304 . 50 1 1 A 115 115 GLN CB C 115 28.233 29.077 -0.844 1
1 1306 . 50 1 1 A 115 115 GLN N N 115 114.300 116.506 -2.206 1
1 1308 . 50 1 1 A 116 116 TYR H H 116 6.677 7.456 -0.779 1
1 1309 . 50 1 1 A 116 116 TYR HA H 116 4.193 4.485 -0.292 1
1 1312 . 50 1 1 A 116 116 TYR C C 116 175.268 175.724 -0.456 1
1 1313 . 50 1 1 A 116 116 TYR CA C 116 54.357 59.610 -5.253 1
1 1314 . 50 1 1 A 116 116 TYR CB C 116 35.498 38.894 -3.396 1
1 1315 . 50 1 1 A 116 116 TYR N N 116 117.919 121.132 -3.213 1
1 1316 . 50 1 1 A 117 117 ASP H H 117 8.081 8.718 -0.637 1
1 1317 . 50 1 1 A 117 117 ASP HA H 117 4.665 4.953 -0.288 1
1 1320 . 50 1 1 A 117 117 ASP CA C 117 52.422 52.163 0.259 1
1 1321 . 50 1 1 A 117 117 ASP CB C 117 42.416 42.233 0.183 1
1 1322 . 50 1 1 A 117 117 ASP N N 117 120.887 125.835 -4.948 1
1 1323 . 50 1 1 A 118 118 PRO C C 118 179.180 178.818 0.362 1
1 1324 . 50 1 1 A 118 118 PRO CA C 118 65.942 66.021 -0.079 1
1 1325 . 50 1 1 A 118 118 PRO CB C 118 32.197 32.033 0.164 1
1 1326 . 50 1 1 A 119 119 GLY H H 119 9.742 8.595 1.147 1
1 1327 . 50 1 1 A 119 119 GLY C C 119 175.622 174.983 0.639 1
1 1328 . 50 1 1 A 119 119 GLY CA C 119 46.785 46.238 0.547 1
1 1329 . 50 1 1 A 119 119 GLY N N 119 106.412 106.120 0.292 1
1 1330 . 50 1 1 A 120 120 LEU H H 120 6.666 7.644 -0.978 1
1 1331 . 50 1 1 A 120 120 LEU HA H 120 3.365 3.336 0.029 1
1 1341 . 50 1 1 A 120 120 LEU C C 120 179.262 178.438 0.824 1
1 1342 . 50 1 1 A 120 120 LEU CA C 120 56.605 57.411 -0.806 1
1 1343 . 50 1 1 A 120 120 LEU CB C 120 39.262 41.756 -2.494 1
1 1347 . 50 1 1 A 120 120 LEU N N 120 126.226 122.579 3.647 1
1 1348 . 50 1 1 A 121 121 PHE H H 121 7.356 8.695 -1.339 1
1 1349 . 50 1 1 A 121 121 PHE HA H 121 4.459 3.771 0.688 1
1 1352 . 50 1 1 A 121 121 PHE C C 121 179.716 176.707 3.009 1
1 1353 . 50 1 1 A 121 121 PHE CA C 121 62.838 62.114 0.724 1
1 1354 . 50 1 1 A 121 121 PHE CB C 121 37.603 38.923 -1.320 1
1 1355 . 50 1 1 A 121 121 PHE N N 121 117.437 119.621 -2.184 1
1 1356 . 50 1 1 A 122 122 ALA H H 122 7.926 7.934 -0.008 1
1 1357 . 50 1 1 A 122 122 ALA HA H 122 4.523 3.738 0.785 1
1 1361 . 50 1 1 A 122 122 ALA C C 122 180.435 179.662 0.773 1
1 1362 . 50 1 1 A 122 122 ALA CA C 122 55.527 55.308 0.219 1
1 1363 . 50 1 1 A 122 122 ALA CB C 122 17.814 17.998 -0.184 1
1 1364 . 50 1 1 A 122 122 ALA N N 122 121.068 120.794 0.274 1
1 1365 . 50 1 1 A 123 123 GLN H H 123 7.507 7.586 -0.079 1
1 1366 . 50 1 1 A 123 123 GLN HA H 123 4.153 3.925 0.228 1
1 1371 . 50 1 1 A 123 123 GLN C C 123 180.561 178.911 1.650 1
1 1372 . 50 1 1 A 123 123 GLN CA C 123 59.948 58.706 1.242 1
1 1373 . 50 1 1 A 123 123 GLN CB C 123 29.135 28.232 0.903 1
1 1375 . 50 1 1 A 123 123 GLN N N 123 120.324 117.375 2.949 1
1 1376 . 50 1 1 A 124 124 ILE H H 124 8.318 8.063 0.255 1
1 1377 . 50 1 1 A 124 124 ILE HA H 124 3.635 3.619 0.016 1
1 1387 . 50 1 1 A 124 124 ILE C C 124 176.481 177.693 -1.212 1
1 1388 . 50 1 1 A 124 124 ILE CA C 124 66.432 65.250 1.182 1
1 1389 . 50 1 1 A 124 124 ILE CB C 124 39.168 37.568 1.600 1
1 1393 . 50 1 1 A 124 124 ILE N N 124 123.747 121.046 2.701 1
1 1394 . 50 1 1 A 125 125 GLN H H 125 8.474 8.013 0.461 1
1 1395 . 50 1 1 A 125 125 GLN HA H 125 4.264 3.765 0.499 1
1 1402 . 50 1 1 A 125 125 GLN C C 125 178.947 177.751 1.196 1
1 1403 . 50 1 1 A 125 125 GLN CA C 125 59.651 58.412 1.239 1
1 1404 . 50 1 1 A 125 125 GLN CB C 125 28.880 28.416 0.464 1
1 1406 . 50 1 1 A 125 125 GLN N N 125 120.368 120.442 -0.074 1
1 1408 . 50 1 1 A 126 126 ALA H H 126 8.002 7.814 0.188 1
1 1409 . 50 1 1 A 126 126 ALA HA H 126 4.144 3.958 0.186 1
1 1413 . 50 1 1 A 126 126 ALA C C 126 179.316 179.440 -0.124 1
1 1414 . 50 1 1 A 126 126 ALA CA C 126 55.036 54.932 0.104 1
1 1415 . 50 1 1 A 126 126 ALA CB C 126 18.087 17.885 0.202 1
1 1416 . 50 1 1 A 126 126 ALA N N 126 121.661 121.057 0.604 1
1 1417 . 50 1 1 A 127 127 ALA H H 127 7.823 7.750 0.073 1
1 1418 . 50 1 1 A 127 127 ALA HA H 127 4.162 3.997 0.165 1
1 1422 . 50 1 1 A 127 127 ALA C C 127 180.707 179.512 1.195 1
1 1423 . 50 1 1 A 127 127 ALA CA C 127 55.080 54.804 0.276 1
1 1424 . 50 1 1 A 127 127 ALA CB C 127 19.354 18.327 1.027 1
1 1425 . 50 1 1 A 127 127 ALA N N 127 119.853 119.721 0.132 1
1 1426 . 50 1 1 A 128 128 ALA H H 128 8.936 8.004 0.932 1
1 1427 . 50 1 1 A 128 128 ALA HA H 128 3.928 3.975 -0.047 1
1 1431 . 50 1 1 A 128 128 ALA C C 128 181.031 179.422 1.609 1
1 1432 . 50 1 1 A 128 128 ALA CA C 128 55.502 54.797 0.705 1
1 1433 . 50 1 1 A 128 128 ALA CB C 128 16.609 17.934 -1.325 1
1 1434 . 50 1 1 A 128 128 ALA N N 128 121.355 120.513 0.842 1
1 1435 . 50 1 1 A 129 129 THR H H 129 8.543 7.363 1.180 1
1 1436 . 50 1 1 A 129 129 THR HA H 129 4.015 3.570 0.445 1
1 1441 . 50 1 1 A 129 129 THR C C 129 177.332 176.321 1.011 1
1 1442 . 50 1 1 A 129 129 THR CA C 129 65.893 65.082 0.811 1
1 1443 . 50 1 1 A 129 129 THR CB C 129 68.566 68.358 0.208 1
1 1445 . 50 1 1 A 129 129 THR N N 129 112.709 112.141 0.568 1
1 1446 . 50 1 1 A 130 130 LYS H H 130 8.126 7.438 0.688 1
1 1447 . 50 1 1 A 130 130 LYS HA H 130 4.000 4.001 -0.001 1
1 1456 . 50 1 1 A 130 130 LYS C C 130 179.082 178.450 0.632 1
1 1457 . 50 1 1 A 130 130 LYS CA C 130 60.299 58.455 1.844 1
1 1458 . 50 1 1 A 130 130 LYS CB C 130 32.767 31.943 0.824 1
1 1462 . 50 1 1 A 130 130 LYS N N 130 123.879 120.437 3.442 1
1 1463 . 50 1 1 A 131 131 ALA H H 131 7.184 7.831 -0.647 1
1 1464 . 50 1 1 A 131 131 ALA HA H 131 4.005 4.249 -0.244 1
1 1468 . 50 1 1 A 131 131 ALA C C 131 178.482 179.550 -1.068 1
1 1469 . 50 1 1 A 131 131 ALA CA C 131 55.027 55.218 -0.191 1
1 1470 . 50 1 1 A 131 131 ALA CB C 131 18.669 19.518 -0.849 1
1 1471 . 50 1 1 A 131 131 ALA N N 131 118.590 121.275 -2.685 1
1 1472 . 50 1 1 A 132 132 TRP H H 132 7.977 8.544 -0.567 1
1 1473 . 50 1 1 A 132 132 TRP HA H 132 4.001 4.253 -0.252 1
1 1480 . 50 1 1 A 132 132 TRP C C 132 177.332 175.835 1.497 1
1 1481 . 50 1 1 A 132 132 TRP CA C 132 60.431 57.406 3.025 1
1 1482 . 50 1 1 A 132 132 TRP CB C 132 27.786 27.594 0.192 1
1 1486 . 50 1 1 A 132 132 TRP N N 132 119.168 117.169 1.999 1
1 1488 . 50 1 1 A 133 133 ARG H H 133 8.006 8.163 -0.157 1
1 1489 . 50 1 1 A 133 133 ARG HA H 133 4.027 4.391 -0.364 1
1 1497 . 50 1 1 A 133 133 ARG C C 133 176.664 177.891 -1.227 1
1 1498 . 50 1 1 A 133 133 ARG CA C 133 59.355 57.192 2.163 1
1 1499 . 50 1 1 A 133 133 ARG CB C 133 30.451 32.094 -1.643 1
1 1502 . 50 1 1 A 133 133 ARG N N 133 113.062 120.704 -7.642 1
1 1504 . 50 1 1 A 134 134 LYS H H 134 7.322 8.039 -0.717 1
1 1505 . 50 1 1 A 134 134 LYS HA H 134 4.313 4.472 -0.159 1
1 1514 . 50 1 1 A 134 134 LYS C C 134 176.282 176.218 0.064 1
1 1515 . 50 1 1 A 134 134 LYS CA C 134 54.922 56.492 -1.570 1
1 1516 . 50 1 1 A 134 134 LYS CB C 134 32.633 31.344 1.289 1
1 1520 . 50 1 1 A 134 134 LYS N N 134 118.170 119.143 -0.973 1
1 1521 . 50 1 1 A 135 135 LEU H H 135 7.440 7.868 -0.428 1
1 1522 . 50 1 1 A 135 135 LEU HA H 135 4.174 4.554 -0.380 1
1 1532 . 50 1 1 A 135 135 LEU CA C 135 54.408 53.053 1.355 1
1 1533 . 50 1 1 A 135 135 LEU CB C 135 40.407 41.063 -0.656 1
1 1537 . 50 1 1 A 135 135 LEU N N 135 123.358 121.025 2.333 1
1 1538 . 50 1 1 A 136 136 PRO HA H 136 4.437 4.624 -0.187 1
1 1545 . 50 1 1 A 136 136 PRO C C 136 177.106 175.479 1.627 1
1 1546 . 50 1 1 A 136 136 PRO CA C 136 62.889 62.475 0.414 1
1 1547 . 50 1 1 A 136 136 PRO CB C 136 32.192 33.096 -0.904 1
1 1550 . 50 1 1 A 137 137 VAL H H 137 8.219 8.197 0.022 1
1 1551 . 50 1 1 A 137 137 VAL HA H 137 4.077 4.706 -0.629 1
1 1559 . 50 1 1 A 137 137 VAL C C 137 176.305 175.109 1.196 1
1 1560 . 50 1 1 A 137 137 VAL CA C 137 61.958 59.763 2.195 1
1 1561 . 50 1 1 A 137 137 VAL CB C 137 32.755 35.049 -2.294 1
1 1564 . 50 1 1 A 137 137 VAL N N 137 120.079 119.472 0.607 1
1 1565 . 50 1 1 A 138 138 LYS H H 138 8.444 8.737 -0.293 1
1 1566 . 50 1 1 A 138 138 LYS HA H 138 4.316 4.286 0.030 1
1 1575 . 50 1 1 A 138 138 LYS C C 138 176.790 176.441 0.349 1
1 1576 . 50 1 1 A 138 138 LYS CA C 138 56.792 57.605 -0.813 1
1 1577 . 50 1 1 A 138 138 LYS CB C 138 33.205 32.841 0.364 1
1 1581 . 50 1 1 A 138 138 LYS N N 138 126.449 125.441 1.008 1
1 1582 . 50 1 1 A 139 139 GLY H H 139 8.518 7.350 1.168 1
1 1583 . 50 1 1 A 139 139 GLY HA2 H 139 4.070 3.992 0.078 1
1 1584 . 50 1 1 A 139 139 GLY HA3 H 139 3.897 4.001 -0.104 1
1 1585 . 50 1 1 A 139 139 GLY C C 139 172.874 171.354 1.520 1
1 1586 . 50 1 1 A 139 139 GLY CA C 139 45.157 45.088 0.069 1
1 1587 . 50 1 1 A 139 139 GLY N N 139 112.617 103.924 8.693 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 127 1.160 1
2 1 1 1 "RMS(OBS, PRED)" CA 136 1.469 1
3 1 1 1 "RMS(OBS, PRED)" CB 125 1.491 1
4 1 1 1 "RMS(OBS, PRED)" H 128 0.650 1
5 1 1 1 "RMS(OBS, PRED)" HA 141 0.387 1
6 1 1 1 "RMS(OBS, PRED)" N 128 3.053 1
7 1 2 1 "RMS(OBS, PRED)" C 127 1.125 1
8 1 2 1 "RMS(OBS, PRED)" CA 136 1.360 1
9 1 2 1 "RMS(OBS, PRED)" CB 125 1.429 1
10 1 2 1 "RMS(OBS, PRED)" H 128 0.629 1
11 1 2 1 "RMS(OBS, PRED)" HA 141 0.409 1
12 1 2 1 "RMS(OBS, PRED)" N 128 3.062 1
13 1 3 1 "RMS(OBS, PRED)" C 127 1.142 1
14 1 3 1 "RMS(OBS, PRED)" CA 136 1.400 1
15 1 3 1 "RMS(OBS, PRED)" CB 125 1.560 1
16 1 3 1 "RMS(OBS, PRED)" H 128 0.670 1
17 1 3 1 "RMS(OBS, PRED)" HA 141 0.407 1
18 1 3 1 "RMS(OBS, PRED)" N 128 3.326 1
19 1 4 1 "RMS(OBS, PRED)" C 127 1.154 1
20 1 4 1 "RMS(OBS, PRED)" CA 136 1.456 1
21 1 4 1 "RMS(OBS, PRED)" CB 125 1.357 1
22 1 4 1 "RMS(OBS, PRED)" H 128 0.692 1
23 1 4 1 "RMS(OBS, PRED)" HA 141 0.387 1
24 1 4 1 "RMS(OBS, PRED)" N 128 3.166 1
25 1 5 1 "RMS(OBS, PRED)" C 127 1.161 1
26 1 5 1 "RMS(OBS, PRED)" CA 136 1.428 1
27 1 5 1 "RMS(OBS, PRED)" CB 125 1.431 1
28 1 5 1 "RMS(OBS, PRED)" H 128 0.640 1
29 1 5 1 "RMS(OBS, PRED)" HA 141 0.390 1
30 1 5 1 "RMS(OBS, PRED)" N 128 3.048 1
31 1 6 1 "RMS(OBS, PRED)" C 127 1.072 1
32 1 6 1 "RMS(OBS, PRED)" CA 136 1.512 1
33 1 6 1 "RMS(OBS, PRED)" CB 125 1.379 1
34 1 6 1 "RMS(OBS, PRED)" H 128 0.651 1
35 1 6 1 "RMS(OBS, PRED)" HA 141 0.407 1
36 1 6 1 "RMS(OBS, PRED)" N 128 3.142 1
37 1 7 1 "RMS(OBS, PRED)" C 127 1.166 1
38 1 7 1 "RMS(OBS, PRED)" CA 136 1.481 1
39 1 7 1 "RMS(OBS, PRED)" CB 125 1.348 1
40 1 7 1 "RMS(OBS, PRED)" H 128 0.668 1
41 1 7 1 "RMS(OBS, PRED)" HA 141 0.361 1
42 1 7 1 "RMS(OBS, PRED)" N 128 3.480 1
43 1 8 1 "RMS(OBS, PRED)" C 127 1.152 1
44 1 8 1 "RMS(OBS, PRED)" CA 136 1.427 1
45 1 8 1 "RMS(OBS, PRED)" CB 125 1.451 1
46 1 8 1 "RMS(OBS, PRED)" H 128 0.632 1
47 1 8 1 "RMS(OBS, PRED)" HA 141 0.384 1
48 1 8 1 "RMS(OBS, PRED)" N 128 3.036 1
49 1 9 1 "RMS(OBS, PRED)" C 127 1.116 1
50 1 9 1 "RMS(OBS, PRED)" CA 136 1.473 1
51 1 9 1 "RMS(OBS, PRED)" CB 125 1.357 1
52 1 9 1 "RMS(OBS, PRED)" H 128 0.663 1
53 1 9 1 "RMS(OBS, PRED)" HA 141 0.387 1
54 1 9 1 "RMS(OBS, PRED)" N 128 3.401 1
55 1 10 1 "RMS(OBS, PRED)" C 127 1.132 1
56 1 10 1 "RMS(OBS, PRED)" CA 136 1.351 1
57 1 10 1 "RMS(OBS, PRED)" CB 125 1.372 1
58 1 10 1 "RMS(OBS, PRED)" H 128 0.676 1
59 1 10 1 "RMS(OBS, PRED)" HA 141 0.370 1
60 1 10 1 "RMS(OBS, PRED)" N 128 2.938 1
61 1 11 1 "RMS(OBS, PRED)" C 127 1.184 1
62 1 11 1 "RMS(OBS, PRED)" CA 136 1.466 1
63 1 11 1 "RMS(OBS, PRED)" CB 125 1.211 1
64 1 11 1 "RMS(OBS, PRED)" H 128 0.634 1
65 1 11 1 "RMS(OBS, PRED)" HA 141 0.372 1
66 1 11 1 "RMS(OBS, PRED)" N 128 3.332 1
67 1 12 1 "RMS(OBS, PRED)" C 127 1.118 1
68 1 12 1 "RMS(OBS, PRED)" CA 136 1.513 1
69 1 12 1 "RMS(OBS, PRED)" CB 125 1.384 1
70 1 12 1 "RMS(OBS, PRED)" H 128 0.633 1
71 1 12 1 "RMS(OBS, PRED)" HA 141 0.378 1
72 1 12 1 "RMS(OBS, PRED)" N 128 3.024 1
73 1 13 1 "RMS(OBS, PRED)" C 127 1.136 1
74 1 13 1 "RMS(OBS, PRED)" CA 136 1.489 1
75 1 13 1 "RMS(OBS, PRED)" CB 125 1.256 1
76 1 13 1 "RMS(OBS, PRED)" H 128 0.692 1
77 1 13 1 "RMS(OBS, PRED)" HA 141 0.398 1
78 1 13 1 "RMS(OBS, PRED)" N 128 3.350 1
79 1 14 1 "RMS(OBS, PRED)" C 127 1.162 1
80 1 14 1 "RMS(OBS, PRED)" CA 136 1.358 1
81 1 14 1 "RMS(OBS, PRED)" CB 125 1.281 1
82 1 14 1 "RMS(OBS, PRED)" H 128 0.657 1
83 1 14 1 "RMS(OBS, PRED)" HA 141 0.379 1
84 1 14 1 "RMS(OBS, PRED)" N 128 3.065 1
85 1 15 1 "RMS(OBS, PRED)" C 127 1.107 1
86 1 15 1 "RMS(OBS, PRED)" CA 136 1.492 1
87 1 15 1 "RMS(OBS, PRED)" CB 125 1.276 1
88 1 15 1 "RMS(OBS, PRED)" H 128 0.670 1
89 1 15 1 "RMS(OBS, PRED)" HA 141 0.379 1
90 1 15 1 "RMS(OBS, PRED)" N 128 3.169 1
91 1 16 1 "RMS(OBS, PRED)" C 127 1.166 1
92 1 16 1 "RMS(OBS, PRED)" CA 136 1.413 1
93 1 16 1 "RMS(OBS, PRED)" CB 125 1.412 1
94 1 16 1 "RMS(OBS, PRED)" H 128 0.678 1
95 1 16 1 "RMS(OBS, PRED)" HA 141 0.386 1
96 1 16 1 "RMS(OBS, PRED)" N 128 3.082 1
97 1 17 1 "RMS(OBS, PRED)" C 127 1.134 1
98 1 17 1 "RMS(OBS, PRED)" CA 136 1.380 1
99 1 17 1 "RMS(OBS, PRED)" CB 125 1.359 1
100 1 17 1 "RMS(OBS, PRED)" H 128 0.683 1
101 1 17 1 "RMS(OBS, PRED)" HA 141 0.389 1
102 1 17 1 "RMS(OBS, PRED)" N 128 3.118 1
103 1 18 1 "RMS(OBS, PRED)" C 127 1.157 1
104 1 18 1 "RMS(OBS, PRED)" CA 136 1.452 1
105 1 18 1 "RMS(OBS, PRED)" CB 125 1.328 1
106 1 18 1 "RMS(OBS, PRED)" H 128 0.669 1
107 1 18 1 "RMS(OBS, PRED)" HA 141 0.411 1
108 1 18 1 "RMS(OBS, PRED)" N 128 3.187 1
109 1 19 1 "RMS(OBS, PRED)" C 127 1.111 1
110 1 19 1 "RMS(OBS, PRED)" CA 136 1.411 1
111 1 19 1 "RMS(OBS, PRED)" CB 125 1.384 1
112 1 19 1 "RMS(OBS, PRED)" H 128 0.661 1
113 1 19 1 "RMS(OBS, PRED)" HA 141 0.370 1
114 1 19 1 "RMS(OBS, PRED)" N 128 3.062 1
115 1 20 1 "RMS(OBS, PRED)" C 127 1.103 1
116 1 20 1 "RMS(OBS, PRED)" CA 136 1.400 1
117 1 20 1 "RMS(OBS, PRED)" CB 125 1.443 1
118 1 20 1 "RMS(OBS, PRED)" H 128 0.709 1
119 1 20 1 "RMS(OBS, PRED)" HA 141 0.342 1
120 1 20 1 "RMS(OBS, PRED)" N 128 3.164 1
121 1 21 1 "RMS(OBS, PRED)" C 127 1.055 1
122 1 21 1 "RMS(OBS, PRED)" CA 136 1.462 1
123 1 21 1 "RMS(OBS, PRED)" CB 125 1.441 1
124 1 21 1 "RMS(OBS, PRED)" H 128 0.642 1
125 1 21 1 "RMS(OBS, PRED)" HA 141 0.401 1
126 1 21 1 "RMS(OBS, PRED)" N 128 3.097 1
127 1 22 1 "RMS(OBS, PRED)" C 127 1.179 1
128 1 22 1 "RMS(OBS, PRED)" CA 136 1.466 1
129 1 22 1 "RMS(OBS, PRED)" CB 125 1.494 1
130 1 22 1 "RMS(OBS, PRED)" H 128 0.669 1
131 1 22 1 "RMS(OBS, PRED)" HA 141 0.385 1
132 1 22 1 "RMS(OBS, PRED)" N 128 3.282 1
133 1 23 1 "RMS(OBS, PRED)" C 127 1.181 1
134 1 23 1 "RMS(OBS, PRED)" CA 136 1.366 1
135 1 23 1 "RMS(OBS, PRED)" CB 125 1.345 1
136 1 23 1 "RMS(OBS, PRED)" H 128 0.622 1
137 1 23 1 "RMS(OBS, PRED)" HA 141 0.411 1
138 1 23 1 "RMS(OBS, PRED)" N 128 3.084 1
139 1 24 1 "RMS(OBS, PRED)" C 127 1.192 1
140 1 24 1 "RMS(OBS, PRED)" CA 136 1.419 1
141 1 24 1 "RMS(OBS, PRED)" CB 125 1.206 1
142 1 24 1 "RMS(OBS, PRED)" H 128 0.656 1
143 1 24 1 "RMS(OBS, PRED)" HA 141 0.377 1
144 1 24 1 "RMS(OBS, PRED)" N 128 3.118 1
145 1 25 1 "RMS(OBS, PRED)" C 127 1.167 1
146 1 25 1 "RMS(OBS, PRED)" CA 136 1.376 1
147 1 25 1 "RMS(OBS, PRED)" CB 125 1.279 1
148 1 25 1 "RMS(OBS, PRED)" H 128 0.682 1
149 1 25 1 "RMS(OBS, PRED)" HA 141 0.397 1
150 1 25 1 "RMS(OBS, PRED)" N 128 3.246 1
151 1 26 1 "RMS(OBS, PRED)" C 127 1.113 1
152 1 26 1 "RMS(OBS, PRED)" CA 136 1.563 1
153 1 26 1 "RMS(OBS, PRED)" CB 125 1.351 1
154 1 26 1 "RMS(OBS, PRED)" H 128 0.659 1
155 1 26 1 "RMS(OBS, PRED)" HA 141 0.380 1
156 1 26 1 "RMS(OBS, PRED)" N 128 3.141 1
157 1 27 1 "RMS(OBS, PRED)" C 127 1.133 1
158 1 27 1 "RMS(OBS, PRED)" CA 136 1.463 1
159 1 27 1 "RMS(OBS, PRED)" CB 125 1.253 1
160 1 27 1 "RMS(OBS, PRED)" H 128 0.641 1
161 1 27 1 "RMS(OBS, PRED)" HA 141 0.401 1
162 1 27 1 "RMS(OBS, PRED)" N 128 3.307 1
163 1 28 1 "RMS(OBS, PRED)" C 127 1.148 1
164 1 28 1 "RMS(OBS, PRED)" CA 136 1.483 1
165 1 28 1 "RMS(OBS, PRED)" CB 125 1.325 1
166 1 28 1 "RMS(OBS, PRED)" H 128 0.676 1
167 1 28 1 "RMS(OBS, PRED)" HA 141 0.384 1
168 1 28 1 "RMS(OBS, PRED)" N 128 3.273 1
169 1 29 1 "RMS(OBS, PRED)" C 127 1.131 1
170 1 29 1 "RMS(OBS, PRED)" CA 136 1.578 1
171 1 29 1 "RMS(OBS, PRED)" CB 125 1.448 1
172 1 29 1 "RMS(OBS, PRED)" H 128 0.659 1
173 1 29 1 "RMS(OBS, PRED)" HA 141 0.400 1
174 1 29 1 "RMS(OBS, PRED)" N 128 3.166 1
175 1 30 1 "RMS(OBS, PRED)" C 127 1.077 1
176 1 30 1 "RMS(OBS, PRED)" CA 136 1.424 1
177 1 30 1 "RMS(OBS, PRED)" CB 125 1.368 1
178 1 30 1 "RMS(OBS, PRED)" H 128 0.659 1
179 1 30 1 "RMS(OBS, PRED)" HA 141 0.404 1
180 1 30 1 "RMS(OBS, PRED)" N 128 3.099 1
181 1 31 1 "RMS(OBS, PRED)" C 127 1.090 1
182 1 31 1 "RMS(OBS, PRED)" CA 136 1.392 1
183 1 31 1 "RMS(OBS, PRED)" CB 125 1.437 1
184 1 31 1 "RMS(OBS, PRED)" H 128 0.645 1
185 1 31 1 "RMS(OBS, PRED)" HA 141 0.412 1
186 1 31 1 "RMS(OBS, PRED)" N 128 3.097 1
187 1 32 1 "RMS(OBS, PRED)" C 127 1.145 1
188 1 32 1 "RMS(OBS, PRED)" CA 136 1.373 1
189 1 32 1 "RMS(OBS, PRED)" CB 125 1.417 1
190 1 32 1 "RMS(OBS, PRED)" H 128 0.702 1
191 1 32 1 "RMS(OBS, PRED)" HA 141 0.425 1
192 1 32 1 "RMS(OBS, PRED)" N 128 3.382 1
193 1 33 1 "RMS(OBS, PRED)" C 127 1.098 1
194 1 33 1 "RMS(OBS, PRED)" CA 136 1.455 1
195 1 33 1 "RMS(OBS, PRED)" CB 125 1.366 1
196 1 33 1 "RMS(OBS, PRED)" H 128 0.645 1
197 1 33 1 "RMS(OBS, PRED)" HA 141 0.414 1
198 1 33 1 "RMS(OBS, PRED)" N 128 3.039 1
199 1 34 1 "RMS(OBS, PRED)" C 127 1.160 1
200 1 34 1 "RMS(OBS, PRED)" CA 136 1.499 1
201 1 34 1 "RMS(OBS, PRED)" CB 125 1.394 1
202 1 34 1 "RMS(OBS, PRED)" H 128 0.663 1
203 1 34 1 "RMS(OBS, PRED)" HA 141 0.422 1
204 1 34 1 "RMS(OBS, PRED)" N 128 3.118 1
205 1 35 1 "RMS(OBS, PRED)" C 127 1.162 1
206 1 35 1 "RMS(OBS, PRED)" CA 136 1.385 1
207 1 35 1 "RMS(OBS, PRED)" CB 125 1.406 1
208 1 35 1 "RMS(OBS, PRED)" H 128 0.673 1
209 1 35 1 "RMS(OBS, PRED)" HA 141 0.396 1
210 1 35 1 "RMS(OBS, PRED)" N 128 3.161 1
211 1 36 1 "RMS(OBS, PRED)" C 127 1.154 1
212 1 36 1 "RMS(OBS, PRED)" CA 136 1.440 1
213 1 36 1 "RMS(OBS, PRED)" CB 125 1.276 1
214 1 36 1 "RMS(OBS, PRED)" H 128 0.639 1
215 1 36 1 "RMS(OBS, PRED)" HA 141 0.391 1
216 1 36 1 "RMS(OBS, PRED)" N 128 3.441 1
217 1 37 1 "RMS(OBS, PRED)" C 127 1.145 1
218 1 37 1 "RMS(OBS, PRED)" CA 136 1.379 1
219 1 37 1 "RMS(OBS, PRED)" CB 125 1.374 1
220 1 37 1 "RMS(OBS, PRED)" H 128 0.666 1
221 1 37 1 "RMS(OBS, PRED)" HA 141 0.409 1
222 1 37 1 "RMS(OBS, PRED)" N 128 3.215 1
223 1 38 1 "RMS(OBS, PRED)" C 127 1.091 1
224 1 38 1 "RMS(OBS, PRED)" CA 136 1.489 1
225 1 38 1 "RMS(OBS, PRED)" CB 125 1.324 1
226 1 38 1 "RMS(OBS, PRED)" H 128 0.669 1
227 1 38 1 "RMS(OBS, PRED)" HA 141 0.402 1
228 1 38 1 "RMS(OBS, PRED)" N 128 3.306 1
229 1 39 1 "RMS(OBS, PRED)" C 127 1.114 1
230 1 39 1 "RMS(OBS, PRED)" CA 136 1.370 1
231 1 39 1 "RMS(OBS, PRED)" CB 125 1.373 1
232 1 39 1 "RMS(OBS, PRED)" H 128 0.650 1
233 1 39 1 "RMS(OBS, PRED)" HA 141 0.395 1
234 1 39 1 "RMS(OBS, PRED)" N 128 3.068 1
235 1 40 1 "RMS(OBS, PRED)" C 127 1.199 1
236 1 40 1 "RMS(OBS, PRED)" CA 136 1.352 1
237 1 40 1 "RMS(OBS, PRED)" CB 125 1.456 1
238 1 40 1 "RMS(OBS, PRED)" H 128 0.646 1
239 1 40 1 "RMS(OBS, PRED)" HA 141 0.373 1
240 1 40 1 "RMS(OBS, PRED)" N 128 3.037 1
241 1 41 1 "RMS(OBS, PRED)" C 127 1.169 1
242 1 41 1 "RMS(OBS, PRED)" CA 136 1.364 1
243 1 41 1 "RMS(OBS, PRED)" CB 125 1.301 1
244 1 41 1 "RMS(OBS, PRED)" H 128 0.675 1
245 1 41 1 "RMS(OBS, PRED)" HA 141 0.415 1
246 1 41 1 "RMS(OBS, PRED)" N 128 3.098 1
247 1 42 1 "RMS(OBS, PRED)" C 127 1.137 1
248 1 42 1 "RMS(OBS, PRED)" CA 136 1.500 1
249 1 42 1 "RMS(OBS, PRED)" CB 125 1.361 1
250 1 42 1 "RMS(OBS, PRED)" H 128 0.663 1
251 1 42 1 "RMS(OBS, PRED)" HA 141 0.401 1
252 1 42 1 "RMS(OBS, PRED)" N 128 3.312 1
253 1 43 1 "RMS(OBS, PRED)" C 127 1.164 1
254 1 43 1 "RMS(OBS, PRED)" CA 136 1.358 1
255 1 43 1 "RMS(OBS, PRED)" CB 125 1.309 1
256 1 43 1 "RMS(OBS, PRED)" H 128 0.644 1
257 1 43 1 "RMS(OBS, PRED)" HA 141 0.373 1
258 1 43 1 "RMS(OBS, PRED)" N 128 3.010 1
259 1 44 1 "RMS(OBS, PRED)" C 127 1.161 1
260 1 44 1 "RMS(OBS, PRED)" CA 136 1.433 1
261 1 44 1 "RMS(OBS, PRED)" CB 125 1.288 1
262 1 44 1 "RMS(OBS, PRED)" H 128 0.663 1
263 1 44 1 "RMS(OBS, PRED)" HA 141 0.390 1
264 1 44 1 "RMS(OBS, PRED)" N 128 2.958 1
265 1 45 1 "RMS(OBS, PRED)" C 127 1.157 1
266 1 45 1 "RMS(OBS, PRED)" CA 136 1.354 1
267 1 45 1 "RMS(OBS, PRED)" CB 125 1.170 1
268 1 45 1 "RMS(OBS, PRED)" H 128 0.628 1
269 1 45 1 "RMS(OBS, PRED)" HA 141 0.395 1
270 1 45 1 "RMS(OBS, PRED)" N 128 3.007 1
271 1 46 1 "RMS(OBS, PRED)" C 127 1.161 1
272 1 46 1 "RMS(OBS, PRED)" CA 136 1.464 1
273 1 46 1 "RMS(OBS, PRED)" CB 125 1.456 1
274 1 46 1 "RMS(OBS, PRED)" H 128 0.669 1
275 1 46 1 "RMS(OBS, PRED)" HA 141 0.367 1
276 1 46 1 "RMS(OBS, PRED)" N 128 3.282 1
277 1 47 1 "RMS(OBS, PRED)" C 127 1.173 1
278 1 47 1 "RMS(OBS, PRED)" CA 136 1.322 1
279 1 47 1 "RMS(OBS, PRED)" CB 125 1.285 1
280 1 47 1 "RMS(OBS, PRED)" H 128 0.650 1
281 1 47 1 "RMS(OBS, PRED)" HA 141 0.417 1
282 1 47 1 "RMS(OBS, PRED)" N 128 3.076 1
283 1 48 1 "RMS(OBS, PRED)" C 127 1.136 1
284 1 48 1 "RMS(OBS, PRED)" CA 136 1.478 1
285 1 48 1 "RMS(OBS, PRED)" CB 125 1.384 1
286 1 48 1 "RMS(OBS, PRED)" H 128 0.648 1
287 1 48 1 "RMS(OBS, PRED)" HA 141 0.413 1
288 1 48 1 "RMS(OBS, PRED)" N 128 3.212 1
289 1 49 1 "RMS(OBS, PRED)" C 127 1.134 1
290 1 49 1 "RMS(OBS, PRED)" CA 136 1.406 1
291 1 49 1 "RMS(OBS, PRED)" CB 125 1.411 1
292 1 49 1 "RMS(OBS, PRED)" H 128 0.682 1
293 1 49 1 "RMS(OBS, PRED)" HA 141 0.405 1
294 1 49 1 "RMS(OBS, PRED)" N 128 3.501 1
295 1 50 1 "RMS(OBS, PRED)" C 127 1.147 1
296 1 50 1 "RMS(OBS, PRED)" CA 136 1.364 1
297 1 50 1 "RMS(OBS, PRED)" CB 125 1.438 1
298 1 50 1 "RMS(OBS, PRED)" H 128 0.669 1
299 1 50 1 "RMS(OBS, PRED)" HA 141 0.394 1
300 1 50 1 "RMS(OBS, PRED)" N 128 3.068 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 6 . 1 1 A 2 2 VAL H H 2 8.992 8.566 0.426 2
1 7 . 1 1 A 2 2 VAL HA H 2 5.370 4.718 0.652 2
1 15 . 1 1 A 2 2 VAL C C 2 174.325 174.642 -0.317 2
1 16 . 1 1 A 2 2 VAL CA C 2 61.267 61.014 0.253 2
1 17 . 1 1 A 2 2 VAL CB C 2 33.890 34.301 -0.411 2
1 20 . 1 1 A 2 2 VAL N N 2 126.939 119.777 7.162 2
1 21 . 1 1 A 3 3 THR H H 3 8.912 8.907 0.005 2
1 22 . 1 1 A 3 3 THR HA H 3 4.505 5.176 -0.671 2
1 27 . 1 1 A 3 3 THR C C 3 172.710 173.020 -0.310 2
1 28 . 1 1 A 3 3 THR CA C 3 59.689 59.899 -0.210 2
1 29 . 1 1 A 3 3 THR CB C 3 72.398 71.758 0.640 2
1 31 . 1 1 A 3 3 THR N N 3 118.091 121.935 -3.844 2
1 32 . 1 1 A 4 4 GLU H H 4 8.631 8.941 -0.310 2
1 33 . 1 1 A 4 4 GLU HA H 4 5.788 5.080 0.708 2
1 38 . 1 1 A 4 4 GLU C C 4 175.758 174.437 1.321 2
1 39 . 1 1 A 4 4 GLU CA C 4 54.902 54.520 0.382 2
1 40 . 1 1 A 4 4 GLU CB C 4 35.097 32.978 2.119 2
1 42 . 1 1 A 4 4 GLU N N 4 120.966 124.496 -3.530 2
1 43 . 1 1 A 5 5 THR H H 5 9.188 8.711 0.477 2
1 44 . 1 1 A 5 5 THR HA H 5 4.739 4.905 -0.166 2
1 49 . 1 1 A 5 5 THR C C 5 172.757 172.575 0.182 2
1 50 . 1 1 A 5 5 THR CA C 5 60.382 60.231 0.151 2
1 51 . 1 1 A 5 5 THR CB C 5 71.558 71.099 0.459 2
1 53 . 1 1 A 5 5 THR N N 5 119.366 115.510 3.856 2
1 54 . 1 1 A 6 6 VAL H H 6 8.476 8.771 -0.295 2
1 55 . 1 1 A 6 6 VAL HA H 6 5.026 5.475 -0.449 2
1 63 . 1 1 A 6 6 VAL C C 6 176.674 174.289 2.385 2
1 64 . 1 1 A 6 6 VAL CA C 6 61.008 60.140 0.868 2
1 65 . 1 1 A 6 6 VAL CB C 6 33.861 34.791 -0.930 2
1 68 . 1 1 A 6 6 VAL N N 6 121.384 121.972 -0.588 2
1 69 . 1 1 A 7 7 ASP H H 7 8.848 8.865 -0.017 2
1 70 . 1 1 A 7 7 ASP HA H 7 4.797 4.936 -0.139 2
1 73 . 1 1 A 7 7 ASP CA C 7 52.834 53.994 -1.160 2
1 74 . 1 1 A 7 7 ASP CB C 7 42.219 42.659 -0.440 2
1 75 . 1 1 A 7 7 ASP N N 7 127.061 125.971 1.090 2
1 76 . 1 1 A 8 8 GLY C C 8 175.143 174.832 0.311 2
1 77 . 1 1 A 8 8 GLY CA C 8 46.553 46.904 -0.351 2
1 78 . 1 1 A 9 9 GLN H H 9 8.408 7.907 0.501 2
1 79 . 1 1 A 9 9 GLN HA H 9 4.541 4.316 0.225 2
1 86 . 1 1 A 9 9 GLN C C 9 176.463 176.533 -0.070 2
1 87 . 1 1 A 9 9 GLN CA C 9 55.167 55.354 -0.187 2
1 88 . 1 1 A 9 9 GLN CB C 9 29.376 28.452 0.924 2
1 90 . 1 1 A 9 9 GLN N N 9 118.300 117.668 0.632 2
1 92 . 1 1 A 10 10 GLY H H 10 8.162 8.385 -0.223 2
1 93 . 1 1 A 10 10 GLY HA2 H 10 4.174 3.953 0.221 2
1 94 . 1 1 A 10 10 GLY HA3 H 10 3.521 3.963 -0.442 2
1 95 . 1 1 A 10 10 GLY C C 10 174.092 174.101 -0.009 2
1 96 . 1 1 A 10 10 GLY CA C 10 45.558 46.026 -0.468 2
1 97 . 1 1 A 10 10 GLY N N 10 108.747 109.866 -1.119 2
1 98 . 1 1 A 11 11 GLN H H 11 8.507 7.626 0.881 2
1 99 . 1 1 A 11 11 GLN HA H 11 4.202 4.683 -0.481 2
1 106 . 1 1 A 11 11 GLN C C 11 173.992 174.472 -0.480 2
1 107 . 1 1 A 11 11 GLN CA C 11 55.098 54.509 0.589 2
1 108 . 1 1 A 11 11 GLN CB C 11 29.097 30.829 -1.732 2
1 110 . 1 1 A 11 11 GLN N N 11 122.979 117.658 5.321 2
1 112 . 1 1 A 12 12 ALA H H 12 8.259 8.717 -0.458 2
1 113 . 1 1 A 12 12 ALA HA H 12 5.156 5.627 -0.471 2
1 117 . 1 1 A 12 12 ALA C C 12 177.284 176.380 0.904 2
1 118 . 1 1 A 12 12 ALA CA C 12 51.087 50.452 0.635 2
1 119 . 1 1 A 12 12 ALA CB C 12 20.500 21.333 -0.833 2
1 120 . 1 1 A 12 12 ALA N N 12 127.100 124.500 2.600 2
1 121 . 1 1 A 13 13 TRP H H 13 9.245 9.076 0.169 2
1 122 . 1 1 A 13 13 TRP HA H 13 4.717 5.415 -0.698 2
1 131 . 1 1 A 13 13 TRP C C 13 175.108 174.653 0.455 2
1 132 . 1 1 A 13 13 TRP CA C 13 55.966 55.690 0.276 2
1 133 . 1 1 A 13 13 TRP CB C 13 31.912 32.660 -0.748 2
1 139 . 1 1 A 13 13 TRP N N 13 123.088 120.347 2.741 2
1 141 . 1 1 A 14 14 ARG H H 14 8.575 8.801 -0.226 2
1 142 . 1 1 A 14 14 ARG HA H 14 5.335 4.705 0.630 2
1 150 . 1 1 A 14 14 ARG C C 14 175.191 174.315 0.876 2
1 151 . 1 1 A 14 14 ARG CA C 14 53.106 54.997 -1.891 2
1 152 . 1 1 A 14 14 ARG CB C 14 32.749 32.685 0.064 2
1 154 . 1 1 A 14 14 ARG N N 14 121.163 120.337 0.826 2
1 156 . 1 1 A 15 15 HIS H H 15 8.595 8.575 0.020 2
1 157 . 1 1 A 15 15 HIS HA H 15 4.790 5.112 -0.322 2
1 161 . 1 1 A 15 15 HIS C C 15 173.770 174.245 -0.475 2
1 162 . 1 1 A 15 15 HIS CA C 15 55.289 54.356 0.933 2
1 163 . 1 1 A 15 15 HIS CB C 15 33.208 33.088 0.120 2
1 165 . 1 1 A 15 15 HIS N N 15 117.643 119.567 -1.924 2
1 166 . 1 1 A 16 16 HIS H H 16 8.993 8.966 0.027 2
1 167 . 1 1 A 16 16 HIS HA H 16 5.158 4.944 0.214 2
1 171 . 1 1 A 16 16 HIS C C 16 173.608 174.632 -1.024 2
1 172 . 1 1 A 16 16 HIS CA C 16 56.450 55.403 1.047 2
1 173 . 1 1 A 16 16 HIS CB C 16 34.171 31.161 3.010 2
1 175 . 1 1 A 16 16 HIS N N 16 123.520 120.752 2.768 2
1 176 . 1 1 A 17 17 ASN H H 17 7.829 9.035 -1.206 2
1 177 . 1 1 A 17 17 ASN HA H 17 4.713 5.215 -0.502 2
1 182 . 1 1 A 17 17 ASN C C 17 173.682 175.235 -1.553 2
1 183 . 1 1 A 17 17 ASN CA C 17 51.822 51.703 0.119 2
1 184 . 1 1 A 17 17 ASN CB C 17 43.176 41.679 1.497 2
1 185 . 1 1 A 17 17 ASN N N 17 122.213 121.621 0.592 2
1 187 . 1 1 A 18 18 GLY H H 18 8.423 8.440 -0.017 2
1 188 . 1 1 A 18 18 GLY HA2 H 18 3.931 3.800 0.131 2
1 189 . 1 1 A 18 18 GLY HA3 H 18 3.707 3.966 -0.259 2
1 190 . 1 1 A 18 18 GLY C C 18 173.985 173.088 0.897 2
1 191 . 1 1 A 18 18 GLY CA C 18 43.949 44.950 -1.001 2
1 192 . 1 1 A 18 18 GLY N N 18 106.991 109.394 -2.403 2
1 193 . 1 1 A 19 19 PHE H H 19 8.338 8.234 0.104 2
1 194 . 1 1 A 19 19 PHE HA H 19 4.068 4.919 -0.851 2
1 197 . 1 1 A 19 19 PHE C C 19 176.568 174.994 1.574 2
1 198 . 1 1 A 19 19 PHE CA C 19 59.338 57.823 1.515 2
1 199 . 1 1 A 19 19 PHE CB C 19 40.201 40.728 -0.527 2
1 200 . 1 1 A 19 19 PHE N N 19 116.857 118.843 -1.986 2
1 201 . 1 1 A 20 20 ASP H H 20 8.794 8.850 -0.056 2
1 202 . 1 1 A 20 20 ASP HA H 20 4.485 4.821 -0.336 2
1 205 . 1 1 A 20 20 ASP C C 20 177.379 177.040 0.339 2
1 206 . 1 1 A 20 20 ASP CA C 20 54.140 54.452 -0.312 2
1 207 . 1 1 A 20 20 ASP CB C 20 41.915 41.363 0.552 2
1 208 . 1 1 A 20 20 ASP N N 20 123.025 124.369 -1.344 2
1 209 . 1 1 A 21 21 PHE H H 21 8.862 9.096 -0.234 2
1 210 . 1 1 A 21 21 PHE HA H 21 4.087 4.107 -0.020 2
1 218 . 1 1 A 21 21 PHE C C 21 176.952 177.232 -0.280 2
1 219 . 1 1 A 21 21 PHE CA C 21 61.095 62.203 -1.108 2
1 220 . 1 1 A 21 21 PHE CB C 21 38.678 39.348 -0.670 2
1 226 . 1 1 A 21 21 PHE N N 21 127.163 126.302 0.861 2
1 227 . 1 1 A 22 22 ALA H H 22 8.561 8.345 0.216 2
1 228 . 1 1 A 22 22 ALA HA H 22 3.878 3.978 -0.100 2
1 232 . 1 1 A 22 22 ALA C C 22 180.710 180.044 0.666 2
1 233 . 1 1 A 22 22 ALA CA C 22 55.211 55.185 0.026 2
1 234 . 1 1 A 22 22 ALA CB C 22 18.321 18.340 -0.019 2
1 235 . 1 1 A 22 22 ALA N N 22 120.293 121.245 -0.952 2
1 236 . 1 1 A 23 23 VAL H H 23 7.241 7.848 -0.607 2
1 237 . 1 1 A 23 23 VAL HA H 23 3.684 3.538 0.146 2
1 245 . 1 1 A 23 23 VAL C C 23 177.101 178.051 -0.950 2
1 246 . 1 1 A 23 23 VAL CA C 23 65.237 66.765 -1.528 2
1 247 . 1 1 A 23 23 VAL CB C 23 31.780 31.574 0.206 2
1 250 . 1 1 A 23 23 VAL N N 23 118.775 117.665 1.110 2
1 251 . 1 1 A 24 24 ILE H H 24 6.761 7.975 -1.214 2
1 252 . 1 1 A 24 24 ILE HA H 24 3.196 3.486 -0.290 2
1 262 . 1 1 A 24 24 ILE C C 24 177.287 178.014 -0.727 2
1 263 . 1 1 A 24 24 ILE CA C 24 63.404 65.544 -2.140 2
1 264 . 1 1 A 24 24 ILE CB C 24 36.294 37.621 -1.327 2
1 268 . 1 1 A 24 24 ILE N N 24 119.036 119.854 -0.818 2
1 269 . 1 1 A 25 25 LYS H H 25 8.032 8.114 -0.082 2
1 270 . 1 1 A 25 25 LYS HA H 25 3.809 3.656 0.153 2
1 279 . 1 1 A 25 25 LYS C C 25 179.450 178.626 0.824 2
1 280 . 1 1 A 25 25 LYS CA C 25 59.621 59.393 0.228 2
1 281 . 1 1 A 25 25 LYS CB C 25 32.259 31.993 0.266 2
1 285 . 1 1 A 25 25 LYS N N 25 118.368 120.331 -1.963 2
1 286 . 1 1 A 26 26 GLU H H 26 7.845 8.006 -0.161 2
1 287 . 1 1 A 26 26 GLU HA H 26 4.021 4.149 -0.128 2
1 292 . 1 1 A 26 26 GLU C C 26 179.191 179.030 0.161 2
1 293 . 1 1 A 26 26 GLU CA C 26 59.530 59.024 0.506 2
1 294 . 1 1 A 26 26 GLU CB C 26 29.449 29.422 0.027 2
1 296 . 1 1 A 26 26 GLU N N 26 120.522 119.014 1.508 2
1 297 . 1 1 A 27 27 LEU H H 27 8.165 8.068 0.097 2
1 298 . 1 1 A 27 27 LEU HA H 27 4.163 4.133 0.030 2
1 308 . 1 1 A 27 27 LEU C C 27 177.256 178.343 -1.087 2
1 309 . 1 1 A 27 27 LEU CA C 27 58.049 57.617 0.432 2
1 310 . 1 1 A 27 27 LEU CB C 27 41.365 41.599 -0.234 2
1 314 . 1 1 A 27 27 LEU N N 27 120.879 121.349 -0.470 2
1 315 . 1 1 A 28 28 LYS H H 28 8.902 8.161 0.741 2
1 316 . 1 1 A 28 28 LYS HA H 28 4.199 4.356 -0.157 2
1 317 . 1 1 A 28 28 LYS C C 28 179.707 179.208 0.499 2
1 318 . 1 1 A 28 28 LYS CA C 28 60.097 59.209 0.888 2
1 319 . 1 1 A 28 28 LYS CB C 28 33.420 31.870 1.550 2
1 320 . 1 1 A 28 28 LYS N N 28 120.050 119.586 0.464 2
1 321 . 1 1 A 29 29 THR H H 29 8.294 8.072 0.222 2
1 322 . 1 1 A 29 29 THR HA H 29 3.892 3.933 -0.041 2
1 327 . 1 1 A 29 29 THR C C 29 175.711 176.460 -0.749 2
1 328 . 1 1 A 29 29 THR CA C 29 66.846 66.516 0.330 2
1 329 . 1 1 A 29 29 THR CB C 29 68.794 68.735 0.059 2
1 331 . 1 1 A 29 29 THR N N 29 115.933 116.624 -0.691 2
1 332 . 1 1 A 30 30 ALA H H 30 8.244 8.608 -0.364 2
1 333 . 1 1 A 30 30 ALA HA H 30 4.241 4.249 -0.008 2
1 337 . 1 1 A 30 30 ALA C C 30 179.128 179.613 -0.485 2
1 338 . 1 1 A 30 30 ALA CA C 30 55.714 55.572 0.142 2
1 339 . 1 1 A 30 30 ALA CB C 30 18.955 18.361 0.594 2
1 340 . 1 1 A 30 30 ALA N N 30 124.617 123.289 1.328 2
1 341 . 1 1 A 31 31 ALA H H 31 8.968 8.570 0.398 2
1 342 . 1 1 A 31 31 ALA HA H 31 3.890 4.076 -0.186 2
1 346 . 1 1 A 31 31 ALA C C 31 180.352 179.642 0.710 2
1 347 . 1 1 A 31 31 ALA CA C 31 55.454 55.371 0.083 2
1 348 . 1 1 A 31 31 ALA CB C 31 17.124 18.330 -1.206 2
1 349 . 1 1 A 31 31 ALA N N 31 119.327 120.467 -1.140 2
1 350 . 1 1 A 32 32 SER H H 32 7.995 7.859 0.136 2
1 351 . 1 1 A 32 32 SER HA H 32 4.238 4.257 -0.019 2
1 354 . 1 1 A 32 32 SER C C 32 175.612 176.335 -0.723 2
1 355 . 1 1 A 32 32 SER CA C 32 61.203 61.330 -0.127 2
1 356 . 1 1 A 32 32 SER CB C 32 63.406 63.208 0.198 2
1 357 . 1 1 A 32 32 SER N N 32 111.962 113.455 -1.493 2
1 358 . 1 1 A 33 33 GLN H H 33 8.333 7.847 0.486 2
1 359 . 1 1 A 33 33 GLN HA H 33 3.992 4.200 -0.208 2
1 366 . 1 1 A 33 33 GLN C C 33 177.486 177.284 0.202 2
1 367 . 1 1 A 33 33 GLN CA C 33 58.277 57.975 0.302 2
1 368 . 1 1 A 33 33 GLN CB C 33 29.140 29.577 -0.437 2
1 370 . 1 1 A 33 33 GLN N N 33 119.527 120.217 -0.690 2
1 372 . 1 1 A 34 34 TYR H H 34 8.587 8.249 0.338 2
1 373 . 1 1 A 34 34 TYR HA H 34 4.792 4.609 0.183 2
1 380 . 1 1 A 34 34 TYR C C 34 176.499 176.691 -0.192 2
1 381 . 1 1 A 34 34 TYR CA C 34 57.711 58.951 -1.240 2
1 382 . 1 1 A 34 34 TYR CB C 34 39.561 39.273 0.288 2
1 387 . 1 1 A 34 34 TYR N N 34 114.610 115.295 -0.685 2
1 388 . 1 1 A 35 35 GLY H H 35 7.346 8.334 -0.988 2
1 389 . 1 1 A 35 35 GLY HA2 H 35 4.785 4.079 0.706 2
1 390 . 1 1 A 35 35 GLY HA3 H 35 4.007 4.091 -0.084 2
1 391 . 1 1 A 35 35 GLY C C 35 175.796 173.496 2.300 2
1 392 . 1 1 A 35 35 GLY CA C 35 44.355 45.103 -0.748 2
1 393 . 1 1 A 35 35 GLY N N 35 108.501 107.011 1.490 2
1 394 . 1 1 A 36 36 ALA H H 36 9.363 8.214 1.149 2
1 395 . 1 1 A 36 36 ALA HA H 36 4.217 4.605 -0.388 2
1 399 . 1 1 A 36 36 ALA C C 36 178.039 177.731 0.308 2
1 400 . 1 1 A 36 36 ALA CA C 36 56.114 51.851 4.263 2
1 401 . 1 1 A 36 36 ALA CB C 36 19.179 19.454 -0.275 2
1 402 . 1 1 A 36 36 ALA N N 36 125.811 123.615 2.196 2
1 403 . 1 1 A 37 37 THR H H 37 8.070 8.657 -0.587 2
1 404 . 1 1 A 37 37 THR HA H 37 4.570 4.380 0.190 2
1 409 . 1 1 A 37 37 THR C C 37 173.685 174.051 -0.366 2
1 410 . 1 1 A 37 37 THR CA C 37 59.822 63.420 -3.598 2
1 411 . 1 1 A 37 37 THR CB C 37 68.267 69.423 -1.156 2
1 413 . 1 1 A 37 37 THR N N 37 129.410 115.582 13.828 2
1 414 . 1 1 A 38 38 ALA H H 38 6.853 7.651 -0.798 2
1 415 . 1 1 A 38 38 ALA HA H 38 4.601 4.591 0.010 2
1 419 . 1 1 A 38 38 ALA CA C 38 50.758 50.428 0.330 2
1 420 . 1 1 A 38 38 ALA CB C 38 18.325 19.665 -1.340 2
1 421 . 1 1 A 38 38 ALA N N 38 124.674 124.964 -0.290 2
1 422 . 1 1 A 40 40 TYR HA H 40 4.032 4.024 0.008 2
1 429 . 1 1 A 40 40 TYR C C 40 176.456 177.302 -0.846 2
1 430 . 1 1 A 40 40 TYR CA C 40 61.010 61.780 -0.770 2
1 431 . 1 1 A 40 40 TYR CB C 40 39.286 38.642 0.644 2
1 436 . 1 1 A 41 41 THR H H 41 6.874 8.139 -1.265 2
1 437 . 1 1 A 41 41 THR HA H 41 3.616 3.840 -0.224 2
1 442 . 1 1 A 41 41 THR C C 41 176.930 176.757 0.173 2
1 443 . 1 1 A 41 41 THR CA C 41 65.557 65.900 -0.343 2
1 444 . 1 1 A 41 41 THR CB C 41 68.228 69.009 -0.781 2
1 446 . 1 1 A 41 41 THR N N 41 115.143 113.911 1.232 2
1 447 . 1 1 A 42 42 LEU H H 42 8.623 7.457 1.166 2
1 448 . 1 1 A 42 42 LEU HA H 42 3.708 4.048 -0.340 2
1 458 . 1 1 A 42 42 LEU C C 42 178.206 179.031 -0.825 2
1 459 . 1 1 A 42 42 LEU CA C 42 57.417 57.718 -0.301 2
1 460 . 1 1 A 42 42 LEU CB C 42 41.342 41.231 0.111 2
1 464 . 1 1 A 42 42 LEU N N 42 120.418 118.554 1.864 2
1 465 . 1 1 A 43 43 ALA H H 43 7.735 7.824 -0.089 2
1 466 . 1 1 A 43 43 ALA HA H 43 4.020 3.985 0.035 2
1 470 . 1 1 A 43 43 ALA C C 43 180.826 180.454 0.372 2
1 471 . 1 1 A 43 43 ALA CA C 43 54.925 54.989 -0.064 2
1 472 . 1 1 A 43 43 ALA CB C 43 17.506 18.222 -0.716 2
1 473 . 1 1 A 43 43 ALA N N 43 120.203 121.842 -1.639 2
1 474 . 1 1 A 44 44 ILE H H 44 7.149 7.364 -0.215 2
1 475 . 1 1 A 44 44 ILE HA H 44 3.603 3.614 -0.011 2
1 485 . 1 1 A 44 44 ILE C C 44 178.594 178.174 0.420 2
1 486 . 1 1 A 44 44 ILE CA C 44 64.782 64.382 0.400 2
1 487 . 1 1 A 44 44 ILE CB C 44 37.472 37.364 0.108 2
1 491 . 1 1 A 44 44 ILE N N 44 118.881 119.436 -0.555 2
1 492 . 1 1 A 45 45 VAL H H 45 7.968 7.811 0.157 2
1 493 . 1 1 A 45 45 VAL HA H 45 2.925 3.367 -0.442 2
1 501 . 1 1 A 45 45 VAL C C 45 177.023 177.595 -0.572 2
1 502 . 1 1 A 45 45 VAL CA C 45 67.081 66.869 0.212 2
1 503 . 1 1 A 45 45 VAL CB C 45 30.854 31.169 -0.315 2
1 506 . 1 1 A 45 45 VAL N N 45 120.764 119.976 0.788 2
1 507 . 1 1 A 46 46 GLU H H 46 8.399 8.276 0.123 2
1 508 . 1 1 A 46 46 GLU HA H 46 3.848 3.912 -0.064 2
1 513 . 1 1 A 46 46 GLU C C 46 178.656 178.792 -0.136 2
1 514 . 1 1 A 46 46 GLU CA C 46 59.491 59.171 0.320 2
1 515 . 1 1 A 46 46 GLU CB C 46 28.991 28.832 0.159 2
1 517 . 1 1 A 46 46 GLU N N 46 116.599 119.761 -3.162 2
1 518 . 1 1 A 47 47 SER H H 47 7.273 7.764 -0.491 2
1 519 . 1 1 A 47 47 SER HA H 47 4.287 4.168 0.119 2
1 521 . 1 1 A 47 47 SER CA C 47 61.047 61.858 -0.811 2
1 522 . 1 1 A 47 47 SER CB C 47 63.016 62.911 0.105 2
1 523 . 1 1 A 47 47 SER N N 47 113.609 116.815 -3.206 2
1 524 . 1 1 A 48 48 VAL H H 48 8.006 8.057 -0.051 2
1 525 . 1 1 A 48 48 VAL HA H 48 3.556 3.643 -0.087 2
1 533 . 1 1 A 48 48 VAL C C 48 177.257 177.317 -0.060 2
1 534 . 1 1 A 48 48 VAL CA C 48 65.025 65.868 -0.843 2
1 535 . 1 1 A 48 48 VAL CB C 48 31.841 31.426 0.415 2
1 538 . 1 1 A 48 48 VAL N N 48 122.327 120.878 1.449 2
1 539 . 1 1 A 49 49 ALA H H 49 8.369 7.727 0.642 2
1 540 . 1 1 A 49 49 ALA HA H 49 4.115 4.241 -0.126 2
1 544 . 1 1 A 49 49 ALA C C 49 177.307 177.747 -0.440 2
1 545 . 1 1 A 49 49 ALA CA C 49 53.253 53.071 0.182 2
1 546 . 1 1 A 49 49 ALA CB C 49 20.131 18.434 1.697 2
1 547 . 1 1 A 49 49 ALA N N 49 118.050 121.631 -3.581 2
1 548 . 1 1 A 50 50 ASP H H 50 7.052 7.801 -0.749 2
1 549 . 1 1 A 50 50 ASP HA H 50 4.788 4.616 0.172 2
1 552 . 1 1 A 50 50 ASP C C 50 175.481 175.984 -0.503 2
1 553 . 1 1 A 50 50 ASP CA C 50 53.681 54.653 -0.972 2
1 554 . 1 1 A 50 50 ASP CB C 50 39.333 41.100 -1.767 2
1 555 . 1 1 A 50 50 ASP N N 50 116.997 117.346 -0.349 2
1 556 . 1 1 A 51 51 ASN H H 51 8.535 7.604 0.931 2
1 557 . 1 1 A 51 51 ASN HA H 51 4.628 4.878 -0.250 2
1 562 . 1 1 A 51 51 ASN C C 51 174.077 175.023 -0.946 2
1 563 . 1 1 A 51 51 ASN CA C 51 52.315 51.738 0.577 2
1 564 . 1 1 A 51 51 ASN CB C 51 41.928 40.592 1.336 2
1 565 . 1 1 A 51 51 ASN N N 51 118.626 116.694 1.932 2
1 567 . 1 1 A 52 52 TRP H H 52 8.555 8.444 0.111 2
1 574 . 1 1 A 52 52 TRP C C 52 173.269 176.309 -3.040 2
1 575 . 1 1 A 52 52 TRP CA C 52 55.031 57.256 -2.225 2
1 576 . 1 1 A 52 52 TRP CB C 52 26.801 29.742 -2.941 2
1 582 . 1 1 A 52 52 TRP N N 52 120.693 121.087 -0.394 2
1 584 . 1 1 A 53 53 LEU H H 53 7.847 8.693 -0.846 2
1 585 . 1 1 A 53 53 LEU HA H 53 4.859 4.931 -0.072 2
1 595 . 1 1 A 53 53 LEU C C 53 177.397 175.600 1.797 2
1 596 . 1 1 A 53 53 LEU CA C 53 53.619 53.915 -0.296 2
1 597 . 1 1 A 53 53 LEU CB C 53 41.812 45.129 -3.317 2
1 601 . 1 1 A 53 53 LEU N N 53 124.741 121.807 2.934 2
1 602 . 1 1 A 54 54 THR H H 54 8.850 8.635 0.215 2
1 603 . 1 1 A 54 54 THR HA H 54 4.598 4.754 -0.156 2
1 608 . 1 1 A 54 54 THR CA C 54 60.531 59.569 0.962 2
1 609 . 1 1 A 54 54 THR CB C 54 67.183 69.486 -2.303 2
1 611 . 1 1 A 54 54 THR N N 54 113.407 113.034 0.373 2
1 612 . 1 1 A 55 55 PRO HA H 55 4.511 4.300 0.211 2
1 619 . 1 1 A 55 55 PRO C C 55 179.383 178.438 0.945 2
1 620 . 1 1 A 55 55 PRO CA C 55 67.159 65.243 1.916 2
1 621 . 1 1 A 55 55 PRO CB C 55 32.095 31.763 0.332 2
1 622 . 1 1 A 56 56 THR H H 56 8.575 7.790 0.785 2
1 623 . 1 1 A 56 56 THR HA H 56 4.229 4.136 0.093 2
1 628 . 1 1 A 56 56 THR C C 56 176.668 176.315 0.353 2
1 629 . 1 1 A 56 56 THR CA C 56 66.943 65.541 1.402 2
1 630 . 1 1 A 56 56 THR CB C 56 68.129 68.480 -0.351 2
1 632 . 1 1 A 56 56 THR N N 56 114.855 111.934 2.921 2
1 633 . 1 1 A 57 57 ASP H H 57 8.730 8.201 0.529 2
1 634 . 1 1 A 57 57 ASP HA H 57 4.425 4.595 -0.170 2
1 637 . 1 1 A 57 57 ASP C C 57 178.351 179.077 -0.726 2
1 638 . 1 1 A 57 57 ASP CA C 57 57.963 57.347 0.616 2
1 639 . 1 1 A 57 57 ASP CB C 57 40.134 40.711 -0.577 2
1 640 . 1 1 A 57 57 ASP N N 57 126.239 120.816 5.423 2
1 641 . 1 1 A 58 58 TRP H H 58 8.244 8.443 -0.199 2
1 642 . 1 1 A 58 58 TRP HA H 58 4.030 4.508 -0.478 2
1 650 . 1 1 A 58 58 TRP C C 58 177.432 179.193 -1.761 2
1 651 . 1 1 A 58 58 TRP CA C 58 62.731 60.182 2.549 2
1 652 . 1 1 A 58 58 TRP CB C 58 29.122 29.332 -0.210 2
1 657 . 1 1 A 58 58 TRP N N 58 119.241 120.632 -1.391 2
1 659 . 1 1 A 59 59 ASN H H 59 8.098 8.753 -0.655 2
1 660 . 1 1 A 59 59 ASN HA H 59 4.424 4.465 -0.041 2
1 663 . 1 1 A 59 59 ASN C C 59 176.952 178.025 -1.073 2
1 664 . 1 1 A 59 59 ASN CA C 59 58.135 56.488 1.647 2
1 665 . 1 1 A 59 59 ASN CB C 59 40.168 38.652 1.516 2
1 666 . 1 1 A 59 59 ASN N N 59 115.747 117.838 -2.091 2
1 667 . 1 1 A 60 60 THR H H 60 8.712 7.912 0.800 2
1 668 . 1 1 A 60 60 THR HA H 60 3.717 4.015 -0.298 2
1 673 . 1 1 A 60 60 THR C C 60 176.044 176.712 -0.668 2
1 674 . 1 1 A 60 60 THR CA C 60 66.576 66.807 -0.231 2
1 675 . 1 1 A 60 60 THR CB C 60 69.251 67.965 1.286 2
1 677 . 1 1 A 60 60 THR N N 60 114.896 117.107 -2.211 2
1 678 . 1 1 A 61 61 LEU H H 61 8.485 8.399 0.086 2
1 679 . 1 1 A 61 61 LEU HA H 61 3.391 3.989 -0.598 2
1 689 . 1 1 A 61 61 LEU C C 61 177.433 178.669 -1.236 2
1 690 . 1 1 A 61 61 LEU CA C 61 58.354 58.540 -0.186 2
1 691 . 1 1 A 61 61 LEU CB C 61 41.761 42.214 -0.453 2
1 695 . 1 1 A 61 61 LEU N N 61 123.433 122.197 1.236 2
1 696 . 1 1 A 62 62 VAL H H 62 8.073 8.306 -0.233 2
1 697 . 1 1 A 62 62 VAL HA H 62 3.207 3.762 -0.555 2
1 705 . 1 1 A 62 62 VAL C C 62 177.585 177.609 -0.024 2
1 706 . 1 1 A 62 62 VAL CA C 62 67.345 65.293 2.052 2
1 707 . 1 1 A 62 62 VAL CB C 62 30.905 30.663 0.242 2
1 710 . 1 1 A 62 62 VAL N N 62 116.018 118.335 -2.317 2
1 711 . 1 1 A 63 63 ARG H H 63 7.765 7.935 -0.170 2
1 712 . 1 1 A 63 63 ARG HA H 63 3.602 3.974 -0.372 2
1 719 . 1 1 A 63 63 ARG C C 63 177.818 178.153 -0.335 2
1 720 . 1 1 A 63 63 ARG CA C 63 58.049 58.791 -0.742 2
1 721 . 1 1 A 63 63 ARG CB C 63 29.955 29.644 0.311 2
1 724 . 1 1 A 63 63 ARG N N 63 116.700 121.096 -4.396 2
1 725 . 1 1 A 64 64 ALA H H 64 7.574 7.614 -0.040 2
1 726 . 1 1 A 64 64 ALA HA H 64 4.158 4.341 -0.183 2
1 730 . 1 1 A 64 64 ALA C C 64 179.886 179.220 0.666 2
1 731 . 1 1 A 64 64 ALA CA C 64 54.007 53.879 0.128 2
1 732 . 1 1 A 64 64 ALA CB C 64 19.147 19.629 -0.482 2
1 733 . 1 1 A 64 64 ALA N N 64 117.555 121.459 -3.904 2
1 734 . 1 1 A 65 65 VAL H H 65 7.554 7.957 -0.403 2
1 735 . 1 1 A 65 65 VAL HA H 65 4.253 3.841 0.412 2
1 743 . 1 1 A 65 65 VAL C C 65 174.180 176.053 -1.873 2
1 744 . 1 1 A 65 65 VAL CA C 65 62.683 65.337 -2.654 2
1 745 . 1 1 A 65 65 VAL CB C 65 33.458 31.639 1.819 2
1 748 . 1 1 A 65 65 VAL N N 65 110.013 115.830 -5.817 2
1 749 . 1 1 A 66 66 LEU H H 66 7.792 7.317 0.475 2
1 750 . 1 1 A 66 66 LEU HA H 66 4.790 4.742 0.048 2
1 760 . 1 1 A 66 66 LEU C C 66 177.537 175.290 2.247 2
1 761 . 1 1 A 66 66 LEU CA C 66 52.823 52.955 -0.132 2
1 762 . 1 1 A 66 66 LEU CB C 66 44.071 45.156 -1.085 2
1 766 . 1 1 A 66 66 LEU N N 66 118.967 121.101 -2.134 2
1 767 . 1 1 A 67 67 SER H H 67 9.208 8.429 0.779 2
1 768 . 1 1 A 67 67 SER HA H 67 4.414 4.907 -0.493 2
1 771 . 1 1 A 67 67 SER CA C 67 57.943 57.252 0.691 2
1 772 . 1 1 A 67 67 SER CB C 67 64.743 66.135 -1.392 2
1 773 . 1 1 A 67 67 SER N N 67 116.378 116.042 0.336 2
1 774 . 1 1 A 69 69 GLY HA2 H 69 3.916 3.753 0.163 2
1 775 . 1 1 A 69 69 GLY HA3 H 69 3.867 3.784 0.083 2
1 776 . 1 1 A 69 69 GLY C C 69 176.783 175.466 1.317 2
1 777 . 1 1 A 69 69 GLY CA C 69 46.977 46.721 0.256 2
1 778 . 1 1 A 70 70 ASP H H 70 7.674 8.123 -0.449 2
1 779 . 1 1 A 70 70 ASP HA H 70 4.511 3.649 0.862 2
1 782 . 1 1 A 70 70 ASP C C 70 178.096 178.197 -0.101 2
1 783 . 1 1 A 70 70 ASP CA C 70 57.262 56.441 0.821 2
1 784 . 1 1 A 70 70 ASP CB C 70 40.594 39.702 0.892 2
1 785 . 1 1 A 70 70 ASP N N 70 123.930 121.919 2.011 2
1 786 . 1 1 A 71 71 HIS H H 71 8.729 7.920 0.809 2
1 787 . 1 1 A 71 71 HIS HA H 71 4.235 4.160 0.075 2
1 790 . 1 1 A 71 71 HIS C C 71 176.769 176.989 -0.220 2
1 791 . 1 1 A 71 71 HIS CA C 71 60.041 59.673 0.368 2
1 792 . 1 1 A 71 71 HIS CB C 71 30.682 30.014 0.668 2
1 793 . 1 1 A 71 71 HIS N N 71 121.003 118.929 2.074 2
1 794 . 1 1 A 72 72 LEU H H 72 7.620 7.852 -0.232 2
1 795 . 1 1 A 72 72 LEU HA H 72 3.769 3.895 -0.126 2
1 805 . 1 1 A 72 72 LEU C C 72 180.275 179.190 1.085 2
1 806 . 1 1 A 72 72 LEU CA C 72 58.192 58.002 0.190 2
1 807 . 1 1 A 72 72 LEU CB C 72 41.381 41.304 0.077 2
1 811 . 1 1 A 72 72 LEU N N 72 118.569 118.244 0.325 2
1 812 . 1 1 A 73 73 LEU H H 73 7.542 7.601 -0.059 2
1 813 . 1 1 A 73 73 LEU HA H 73 4.107 4.196 -0.089 2
1 823 . 1 1 A 73 73 LEU C C 73 179.436 179.156 0.280 2
1 824 . 1 1 A 73 73 LEU CA C 73 58.026 57.308 0.718 2
1 825 . 1 1 A 73 73 LEU CB C 73 41.638 42.076 -0.438 2
1 829 . 1 1 A 73 73 LEU N N 73 121.418 120.357 1.061 2
1 830 . 1 1 A 74 74 TRP H H 74 8.786 8.039 0.747 2
1 831 . 1 1 A 74 74 TRP HA H 74 3.589 5.341 -1.752 2
1 840 . 1 1 A 74 74 TRP C C 74 176.816 178.695 -1.879 2
1 841 . 1 1 A 74 74 TRP CA C 74 63.046 59.877 3.169 2
1 842 . 1 1 A 74 74 TRP CB C 74 28.065 29.030 -0.965 2
1 848 . 1 1 A 74 74 TRP N N 74 121.111 118.207 2.904 2
1 850 . 1 1 A 75 75 LYS H H 75 8.939 7.619 1.320 2
1 851 . 1 1 A 75 75 LYS HA H 75 3.055 4.126 -1.071 2
1 860 . 1 1 A 75 75 LYS C C 75 177.967 179.240 -1.273 2
1 861 . 1 1 A 75 75 LYS CA C 75 60.029 58.615 1.414 2
1 862 . 1 1 A 75 75 LYS CB C 75 32.533 32.806 -0.273 2
1 866 . 1 1 A 75 75 LYS N N 75 119.783 118.611 1.172 2
1 867 . 1 1 A 76 76 SER H H 76 7.832 7.943 -0.111 2
1 868 . 1 1 A 76 76 SER HA H 76 4.040 4.308 -0.268 2
1 871 . 1 1 A 76 76 SER C C 76 177.816 176.953 0.863 2
1 872 . 1 1 A 76 76 SER CA C 76 62.105 61.768 0.337 2
1 873 . 1 1 A 76 76 SER CB C 76 62.679 62.924 -0.245 2
1 874 . 1 1 A 76 76 SER N N 76 113.395 116.065 -2.670 2
1 875 . 1 1 A 77 77 GLU H H 77 7.590 7.657 -0.068 2
1 876 . 1 1 A 77 77 GLU HA H 77 4.042 4.258 -0.216 2
1 881 . 1 1 A 77 77 GLU C C 77 177.809 178.633 -0.824 2
1 882 . 1 1 A 77 77 GLU CA C 77 58.270 58.621 -0.351 2
1 883 . 1 1 A 77 77 GLU CB C 77 29.208 29.407 -0.199 2
1 885 . 1 1 A 77 77 GLU N N 77 121.574 122.183 -0.609 2
1 886 . 1 1 A 78 78 PHE H H 78 9.081 7.840 1.241 2
1 887 . 1 1 A 78 78 PHE HA H 78 3.778 4.220 -0.442 2
1 895 . 1 1 A 78 78 PHE C C 78 178.114 177.383 0.731 2
1 896 . 1 1 A 78 78 PHE CA C 78 60.629 61.318 -0.689 2
1 897 . 1 1 A 78 78 PHE CB C 78 38.295 38.729 -0.434 2
1 902 . 1 1 A 78 78 PHE N N 78 122.682 122.070 0.612 2
1 903 . 1 1 A 79 79 PHE H H 79 8.890 8.015 0.875 2
1 904 . 1 1 A 79 79 PHE HA H 79 3.800 4.029 -0.229 2
1 912 . 1 1 A 79 79 PHE C C 79 178.354 178.253 0.101 2
1 913 . 1 1 A 79 79 PHE CA C 79 60.704 61.981 -1.277 2
1 914 . 1 1 A 79 79 PHE CB C 79 37.184 38.490 -1.306 2
1 920 . 1 1 A 79 79 PHE N N 79 121.056 117.954 3.102 2
1 921 . 1 1 A 80 80 GLU H H 80 7.793 8.220 -0.427 2
1 922 . 1 1 A 80 80 GLU HA H 80 4.082 4.008 0.074 2
1 927 . 1 1 A 80 80 GLU C C 80 179.068 179.210 -0.142 2
1 928 . 1 1 A 80 80 GLU CA C 80 59.735 59.634 0.101 2
1 929 . 1 1 A 80 80 GLU CB C 80 28.722 29.262 -0.540 2
1 931 . 1 1 A 80 80 GLU N N 80 120.312 118.905 1.407 2
1 932 . 1 1 A 81 81 ASN H H 81 8.624 8.705 -0.081 2
1 933 . 1 1 A 81 81 ASN HA H 81 4.521 4.481 0.040 2
1 938 . 1 1 A 81 81 ASN C C 81 179.262 177.888 1.374 2
1 939 . 1 1 A 81 81 ASN CA C 81 55.504 56.260 -0.756 2
1 940 . 1 1 A 81 81 ASN CB C 81 37.517 37.795 -0.278 2
1 941 . 1 1 A 81 81 ASN N N 81 119.338 118.083 1.255 2
1 943 . 1 1 A 82 82 CYS H H 82 8.554 8.041 0.513 2
1 944 . 1 1 A 82 82 CYS HA H 82 3.792 4.003 -0.211 2
1 947 . 1 1 A 82 82 CYS C C 82 176.478 176.990 -0.512 2
1 948 . 1 1 A 82 82 CYS CA C 82 65.232 62.929 2.303 2
1 949 . 1 1 A 82 82 CYS CB C 82 26.762 26.912 -0.150 2
1 950 . 1 1 A 82 82 CYS N N 82 120.576 117.926 2.650 2
1 951 . 1 1 A 83 83 ARG H H 83 8.522 7.902 0.620 2
1 952 . 1 1 A 83 83 ARG HA H 83 3.932 4.165 -0.233 2
1 960 . 1 1 A 83 83 ARG C C 83 179.138 178.674 0.464 2
1 961 . 1 1 A 83 83 ARG CA C 83 60.443 59.019 1.424 2
1 962 . 1 1 A 83 83 ARG CB C 83 29.550 29.786 -0.236 2
1 965 . 1 1 A 83 83 ARG N N 83 123.035 120.012 3.023 2
1 967 . 1 1 A 84 84 ASP H H 84 7.791 8.220 -0.429 2
1 968 . 1 1 A 84 84 ASP HA H 84 4.353 4.406 -0.053 2
1 971 . 1 1 A 84 84 ASP C C 84 178.649 178.622 0.027 2
1 972 . 1 1 A 84 84 ASP CA C 84 57.767 57.567 0.200 2
1 973 . 1 1 A 84 84 ASP CB C 84 41.305 41.597 -0.292 2
1 974 . 1 1 A 84 84 ASP N N 84 120.332 119.579 0.753 2
1 975 . 1 1 A 85 85 THR H H 85 8.370 8.055 0.315 2
1 976 . 1 1 A 85 85 THR HA H 85 3.730 3.918 -0.188 2
1 981 . 1 1 A 85 85 THR C C 85 175.198 176.451 -1.253 2
1 982 . 1 1 A 85 85 THR CA C 85 66.830 65.841 0.989 2
1 983 . 1 1 A 85 85 THR CB C 85 68.533 68.466 0.067 2
1 985 . 1 1 A 85 85 THR N N 85 117.360 115.193 2.167 2
1 986 . 1 1 A 86 86 ALA H H 86 8.845 8.269 0.576 2
1 987 . 1 1 A 86 86 ALA HA H 86 3.991 4.127 -0.136 2
1 991 . 1 1 A 86 86 ALA C C 86 179.980 179.665 0.315 2
1 992 . 1 1 A 86 86 ALA CA C 86 55.769 55.533 0.236 2
1 993 . 1 1 A 86 86 ALA CB C 86 17.881 18.428 -0.547 2
1 994 . 1 1 A 86 86 ALA N N 86 123.613 123.418 0.195 2
1 995 . 1 1 A 87 87 LYS H H 87 7.686 8.243 -0.557 2
1 996 . 1 1 A 87 87 LYS HA H 87 4.099 4.022 0.077 2
1 1005 . 1 1 A 87 87 LYS C C 87 179.592 179.003 0.589 2
1 1006 . 1 1 A 87 87 LYS CA C 87 59.708 59.455 0.253 2
1 1007 . 1 1 A 87 87 LYS CB C 87 32.054 32.092 -0.038 2
1 1011 . 1 1 A 87 87 LYS N N 87 119.623 117.086 2.537 2
1 1012 . 1 1 A 88 88 ARG H H 88 7.683 7.699 -0.016 2
1 1013 . 1 1 A 88 88 ARG HA H 88 4.051 4.146 -0.095 2
1 1020 . 1 1 A 88 88 ARG C C 88 180.053 178.829 1.224 2
1 1021 . 1 1 A 88 88 ARG CA C 88 59.558 59.041 0.517 2
1 1022 . 1 1 A 88 88 ARG CB C 88 29.684 29.903 -0.219 2
1 1025 . 1 1 A 88 88 ARG N N 88 120.788 119.362 1.426 2
1 1026 . 1 1 A 89 89 ASN H H 89 8.973 8.187 0.786 2
1 1027 . 1 1 A 89 89 ASN HA H 89 4.354 4.615 -0.261 2
1 1032 . 1 1 A 89 89 ASN C C 89 178.382 178.348 0.034 2
1 1033 . 1 1 A 89 89 ASN CA C 89 55.334 55.803 -0.469 2
1 1034 . 1 1 A 89 89 ASN CB C 89 37.864 38.237 -0.373 2
1 1035 . 1 1 A 89 89 ASN N N 89 121.012 117.706 3.306 2
1 1037 . 1 1 A 90 90 GLN H H 90 8.152 8.138 0.014 2
1 1038 . 1 1 A 90 90 GLN HA H 90 4.020 4.122 -0.102 2
1 1045 . 1 1 A 90 90 GLN C C 90 179.075 178.742 0.333 2
1 1046 . 1 1 A 90 90 GLN CA C 90 59.318 58.829 0.489 2
1 1047 . 1 1 A 90 90 GLN CB C 90 28.049 28.349 -0.300 2
1 1049 . 1 1 A 90 90 GLN N N 90 122.122 120.187 1.935 2
1 1051 . 1 1 A 91 91 GLN H H 91 7.514 8.312 -0.798 2
1 1052 . 1 1 A 91 91 GLN HA H 91 4.053 4.097 -0.044 2
1 1059 . 1 1 A 91 91 GLN C C 91 177.081 177.603 -0.522 2
1 1060 . 1 1 A 91 91 GLN CA C 91 58.031 58.268 -0.237 2
1 1061 . 1 1 A 91 91 GLN CB C 91 28.365 27.720 0.645 2
1 1063 . 1 1 A 91 91 GLN N N 91 118.124 118.219 -0.095 2
1 1065 . 1 1 A 92 92 ALA H H 92 7.704 7.468 0.236 2
1 1066 . 1 1 A 92 92 ALA HA H 92 4.246 4.341 -0.095 2
1 1070 . 1 1 A 92 92 ALA C C 92 178.450 177.968 0.482 2
1 1071 . 1 1 A 92 92 ALA CA C 92 52.671 52.327 0.344 2
1 1072 . 1 1 A 92 92 ALA CB C 92 19.316 19.678 -0.362 2
1 1073 . 1 1 A 92 92 ALA N N 92 119.880 120.259 -0.379 2
1 1074 . 1 1 A 93 93 GLY H H 93 7.693 7.943 -0.250 2
1 1075 . 1 1 A 93 93 GLY HA2 H 93 3.941 3.923 0.018 2
1 1076 . 1 1 A 93 93 GLY HA3 H 93 3.744 3.930 -0.186 2
1 1077 . 1 1 A 93 93 GLY C C 93 174.344 174.930 -0.586 2
1 1078 . 1 1 A 93 93 GLY CA C 93 45.949 46.477 -0.528 2
1 1079 . 1 1 A 93 93 GLY N N 93 105.347 107.056 -1.709 2
1 1080 . 1 1 A 94 94 ASN H H 94 7.076 8.492 -1.416 2
1 1081 . 1 1 A 94 94 ASN HA H 94 4.115 4.691 -0.576 2
1 1085 . 1 1 A 94 94 ASN C C 94 175.410 175.676 -0.266 2
1 1086 . 1 1 A 94 94 ASN CA C 94 52.651 52.837 -0.186 2
1 1087 . 1 1 A 94 94 ASN CB C 94 38.330 39.525 -1.195 2
1 1088 . 1 1 A 94 94 ASN N N 94 115.747 117.471 -1.724 2
1 1090 . 1 1 A 95 95 GLY H H 95 8.236 8.374 -0.138 2
1 1091 . 1 1 A 95 95 GLY HA2 H 95 3.633 3.657 -0.024 2
1 1092 . 1 1 A 95 95 GLY HA3 H 95 3.633 3.814 -0.181 2
1 1093 . 1 1 A 95 95 GLY C C 95 174.450 173.610 0.840 2
1 1094 . 1 1 A 95 95 GLY CA C 95 45.522 45.923 -0.401 2
1 1095 . 1 1 A 95 95 GLY N N 95 109.166 107.976 1.190 2
1 1096 . 1 1 A 96 96 TRP H H 96 7.899 7.750 0.149 2
1 1097 . 1 1 A 96 96 TRP HA H 96 5.241 5.061 0.180 2
1 1106 . 1 1 A 96 96 TRP C C 96 175.661 175.489 0.172 2
1 1107 . 1 1 A 96 96 TRP CA C 96 55.090 56.550 -1.460 2
1 1108 . 1 1 A 96 96 TRP CB C 96 27.138 32.413 -5.275 2
1 1114 . 1 1 A 96 96 TRP N N 96 122.840 120.261 2.579 2
1 1116 . 1 1 A 97 97 ASP H H 97 7.344 8.972 -1.628 2
1 1117 . 1 1 A 97 97 ASP HA H 97 4.829 4.692 0.137 2
1 1120 . 1 1 A 97 97 ASP C C 97 175.019 176.524 -1.505 2
1 1121 . 1 1 A 97 97 ASP CA C 97 52.149 55.116 -2.967 2
1 1122 . 1 1 A 97 97 ASP CB C 97 42.697 40.947 1.750 2
1 1123 . 1 1 A 97 97 ASP N N 97 126.861 119.856 7.005 2
1 1124 . 1 1 A 98 98 PHE H H 98 8.566 8.840 -0.274 2
1 1125 . 1 1 A 98 98 PHE HA H 98 3.727 4.196 -0.469 2
1 1133 . 1 1 A 98 98 PHE C C 98 177.443 177.189 0.254 2
1 1134 . 1 1 A 98 98 PHE CA C 98 62.471 61.149 1.322 2
1 1135 . 1 1 A 98 98 PHE CB C 98 39.919 39.135 0.784 2
1 1141 . 1 1 A 98 98 PHE N N 98 117.781 121.393 -3.612 2
1 1142 . 1 1 A 99 99 ASP H H 99 8.259 8.329 -0.070 2
1 1143 . 1 1 A 99 99 ASP HA H 99 3.960 4.267 -0.307 2
1 1146 . 1 1 A 99 99 ASP C C 99 178.132 178.440 -0.307 2
1 1147 . 1 1 A 99 99 ASP CA C 99 57.658 56.588 1.070 2
1 1148 . 1 1 A 99 99 ASP CB C 99 38.572 40.657 -2.085 2
1 1149 . 1 1 A 99 99 ASP N N 99 121.709 119.712 1.998 2
1 1150 . 1 1 A 100 100 MET H H 100 8.008 8.106 -0.098 2
1 1151 . 1 1 A 100 100 MET HA H 100 3.644 4.300 -0.656 2
1 1156 . 1 1 A 100 100 MET C C 100 180.008 176.933 3.075 2
1 1157 . 1 1 A 100 100 MET CA C 100 58.598 58.271 0.327 2
1 1158 . 1 1 A 100 100 MET CB C 100 33.423 33.067 0.356 2
1 1160 . 1 1 A 100 100 MET N N 100 119.668 117.711 1.957 2
1 1161 . 1 1 A 101 101 LEU H H 101 7.961 8.094 -0.133 2
1 1162 . 1 1 A 101 101 LEU HA H 101 3.523 4.433 -0.910 2
1 1172 . 1 1 A 101 101 LEU C C 101 173.873 176.189 -2.316 2
1 1173 . 1 1 A 101 101 LEU CA C 101 58.743 54.241 4.502 2
1 1174 . 1 1 A 101 101 LEU CB C 101 42.632 42.177 0.455 2
1 1178 . 1 1 A 101 101 LEU N N 101 119.752 119.328 0.424 2
1 1179 . 1 1 A 102 102 THR H H 102 6.955 8.469 -1.514 2
1 1180 . 1 1 A 102 102 THR HA H 102 4.134 4.382 -0.248 2
1 1185 . 1 1 A 102 102 THR C C 102 176.513 174.535 1.978 2
1 1186 . 1 1 A 102 102 THR CA C 102 61.125 62.426 -1.301 2
1 1187 . 1 1 A 102 102 THR CB C 102 71.415 69.558 1.857 2
1 1189 . 1 1 A 102 102 THR N N 102 124.665 118.504 6.161 2
1 1190 . 1 1 A 103 103 GLY H H 103 7.816 8.470 -0.654 2
1 1191 . 1 1 A 103 103 GLY HA2 H 103 3.824 3.978 -0.154 2
1 1192 . 1 1 A 103 103 GLY HA3 H 103 3.824 4.064 -0.240 2
1 1193 . 1 1 A 103 103 GLY C C 103 174.126 174.251 -0.125 2
1 1194 . 1 1 A 103 103 GLY CA C 103 47.805 46.613 1.192 2
1 1195 . 1 1 A 103 103 GLY N N 103 114.191 111.376 2.815 2
1 1196 . 1 1 A 104 104 SER H H 104 8.860 8.103 0.757 2
1 1197 . 1 1 A 104 104 SER HA H 104 4.758 4.665 0.093 2
1 1200 . 1 1 A 104 104 SER C C 104 174.591 174.057 0.534 2
1 1201 . 1 1 A 104 104 SER CA C 104 56.755 58.481 -1.726 2
1 1202 . 1 1 A 104 104 SER CB C 104 65.050 64.176 0.874 2
1 1203 . 1 1 A 104 104 SER N N 104 114.771 115.127 -0.356 2
1 1204 . 1 1 A 105 105 GLY H H 105 8.788 8.194 0.594 2
1 1205 . 1 1 A 105 105 GLY HA2 H 105 3.733 3.947 -0.214 2
1 1206 . 1 1 A 105 105 GLY HA3 H 105 3.733 4.023 -0.290 2
1 1207 . 1 1 A 105 105 GLY CA C 105 47.247 45.875 1.372 2
1 1208 . 1 1 A 105 105 GLY N N 105 110.394 110.140 0.254 2
1 1209 . 1 1 A 106 106 ASN HA H 106 4.454 4.761 -0.307 2
1 1212 . 1 1 A 106 106 ASN C C 106 175.180 176.112 -0.932 2
1 1213 . 1 1 A 106 106 ASN CA C 106 54.492 54.654 -0.162 2
1 1214 . 1 1 A 106 106 ASN CB C 106 37.282 40.167 -2.885 2
1 1215 . 1 1 A 107 107 TYR H H 107 8.241 7.737 0.504 2
1 1216 . 1 1 A 107 107 TYR HA H 107 4.335 4.786 -0.451 2
1 1223 . 1 1 A 107 107 TYR C C 107 173.954 176.459 -2.505 2
1 1224 . 1 1 A 107 107 TYR CA C 107 57.727 57.624 0.103 2
1 1225 . 1 1 A 107 107 TYR CB C 107 37.063 39.547 -2.484 2
1 1230 . 1 1 A 107 107 TYR N N 107 120.708 114.762 5.946 2
1 1231 . 1 1 A 108 108 SER H H 108 7.117 7.851 -0.734 2
1 1232 . 1 1 A 108 108 SER HA H 108 4.221 4.290 -0.069 2
1 1235 . 1 1 A 108 108 SER C C 108 174.834 174.160 0.674 2
1 1236 . 1 1 A 108 108 SER CA C 108 59.859 60.203 -0.344 2
1 1237 . 1 1 A 108 108 SER CB C 108 63.846 63.161 0.685 2
1 1238 . 1 1 A 108 108 SER N N 108 113.362 115.848 -2.486 2
1 1239 . 1 1 A 109 109 SER H H 109 8.053 8.006 0.047 2
1 1240 . 1 1 A 109 109 SER HA H 109 4.560 4.420 0.140 2
1 1243 . 1 1 A 109 109 SER CA C 109 57.141 59.650 -2.509 2
1 1244 . 1 1 A 109 109 SER CB C 109 64.874 62.931 1.943 2
1 1245 . 1 1 A 109 109 SER N N 109 116.657 115.612 1.045 2
1 1246 . 1 1 A 110 110 THR HA H 110 3.541 3.957 -0.416 2
1 1251 . 1 1 A 110 110 THR C C 110 175.477 176.082 -0.605 2
1 1252 . 1 1 A 110 110 THR CA C 110 66.443 65.917 0.526 2
1 1253 . 1 1 A 110 110 THR CB C 110 68.091 68.623 -0.532 2
1 1255 . 1 1 A 111 111 ASP H H 111 8.224 8.234 -0.010 2
1 1256 . 1 1 A 111 111 ASP HA H 111 4.237 4.318 -0.081 2
1 1259 . 1 1 A 111 111 ASP C C 111 177.520 178.360 -0.840 2
1 1260 . 1 1 A 111 111 ASP CA C 111 57.559 57.276 0.283 2
1 1261 . 1 1 A 111 111 ASP CB C 111 40.292 40.903 -0.611 2
1 1262 . 1 1 A 111 111 ASP N N 111 119.490 120.895 -1.405 2
1 1263 . 1 1 A 112 112 ALA H H 112 7.431 8.088 -0.657 2
1 1264 . 1 1 A 112 112 ALA HA H 112 4.191 4.102 0.089 2
1 1268 . 1 1 A 112 112 ALA C C 112 180.646 179.748 0.898 2
1 1269 . 1 1 A 112 112 ALA CA C 112 54.534 54.903 -0.369 2
1 1270 . 1 1 A 112 112 ALA CB C 112 18.992 18.389 0.603 2
1 1271 . 1 1 A 112 112 ALA N N 112 119.710 121.778 -2.068 2
1 1272 . 1 1 A 113 113 GLN H H 113 7.576 7.755 -0.179 2
1 1273 . 1 1 A 113 113 GLN HA H 113 3.562 4.122 -0.560 2
1 1278 . 1 1 A 113 113 GLN C C 113 176.756 178.137 -1.381 2
1 1279 . 1 1 A 113 113 GLN CA C 113 57.736 58.426 -0.690 2
1 1280 . 1 1 A 113 113 GLN CB C 113 29.110 28.393 0.717 2
1 1281 . 1 1 A 113 113 GLN N N 113 117.518 117.569 -0.051 2
1 1283 . 1 1 A 114 114 MET H H 114 8.192 8.093 0.099 2
1 1284 . 1 1 A 114 114 MET HA H 114 4.231 4.138 0.093 2
1 1289 . 1 1 A 114 114 MET C C 114 175.648 177.712 -2.064 2
1 1290 . 1 1 A 114 114 MET CA C 114 57.446 57.902 -0.456 2
1 1291 . 1 1 A 114 114 MET CB C 114 33.570 32.384 1.186 2
1 1293 . 1 1 A 114 114 MET N N 114 111.509 119.380 -7.871 2
1 1294 . 1 1 A 115 115 GLN H H 115 6.940 7.480 -0.540 2
1 1295 . 1 1 A 115 115 GLN HA H 115 4.307 4.333 -0.026 2
1 1302 . 1 1 A 115 115 GLN C C 115 176.270 175.462 0.808 2
1 1303 . 1 1 A 115 115 GLN CA C 115 54.680 56.116 -1.436 2
1 1304 . 1 1 A 115 115 GLN CB C 115 28.233 28.915 -0.682 2
1 1306 . 1 1 A 115 115 GLN N N 115 114.300 116.483 -2.183 2
1 1308 . 1 1 A 116 116 TYR H H 116 6.677 7.712 -1.035 2
1 1309 . 1 1 A 116 116 TYR HA H 116 4.193 4.360 -0.167 2
1 1312 . 1 1 A 116 116 TYR C C 116 175.268 174.607 0.661 2
1 1313 . 1 1 A 116 116 TYR CA C 116 54.357 58.873 -4.516 2
1 1314 . 1 1 A 116 116 TYR CB C 116 35.498 37.457 -1.959 2
1 1315 . 1 1 A 116 116 TYR N N 116 117.919 118.928 -1.009 2
1 1316 . 1 1 A 117 117 ASP H H 117 8.081 8.377 -0.296 2
1 1317 . 1 1 A 117 117 ASP HA H 117 4.665 4.806 -0.141 2
1 1320 . 1 1 A 117 117 ASP CA C 117 52.422 51.781 0.641 2
1 1321 . 1 1 A 117 117 ASP CB C 117 42.416 41.610 0.806 2
1 1322 . 1 1 A 117 117 ASP N N 117 120.887 123.428 -2.541 2
1 1323 . 1 1 A 118 118 PRO C C 118 179.180 178.526 0.654 2
1 1324 . 1 1 A 118 118 PRO CA C 118 65.942 65.113 0.829 2
1 1325 . 1 1 A 118 118 PRO CB C 118 32.197 31.830 0.367 2
1 1326 . 1 1 A 119 119 GLY H H 119 9.742 8.379 1.363 2
1 1327 . 1 1 A 119 119 GLY C C 119 175.622 175.221 0.401 2
1 1328 . 1 1 A 119 119 GLY CA C 119 46.785 46.394 0.391 2
1 1329 . 1 1 A 119 119 GLY N N 119 106.412 106.303 0.109 2
1 1330 . 1 1 A 120 120 LEU H H 120 6.666 7.541 -0.875 2
1 1331 . 1 1 A 120 120 LEU HA H 120 3.365 3.580 -0.215 2
1 1341 . 1 1 A 120 120 LEU C C 120 179.262 178.441 0.821 2
1 1342 . 1 1 A 120 120 LEU CA C 120 56.605 57.140 -0.535 2
1 1343 . 1 1 A 120 120 LEU CB C 120 39.262 41.409 -2.147 2
1 1347 . 1 1 A 120 120 LEU N N 120 126.226 122.513 3.713 2
1 1348 . 1 1 A 121 121 PHE H H 121 7.356 8.614 -1.258 2
1 1349 . 1 1 A 121 121 PHE HA H 121 4.459 3.951 0.508 2
1 1352 . 1 1 A 121 121 PHE C C 121 179.716 177.532 2.184 2
1 1353 . 1 1 A 121 121 PHE CA C 121 62.838 62.067 0.771 2
1 1354 . 1 1 A 121 121 PHE CB C 121 37.603 39.203 -1.600 2
1 1355 . 1 1 A 121 121 PHE N N 121 117.437 119.369 -1.932 2
1 1356 . 1 1 A 122 122 ALA H H 122 7.926 8.032 -0.106 2
1 1357 . 1 1 A 122 122 ALA HA H 122 4.523 3.850 0.673 2
1 1361 . 1 1 A 122 122 ALA C C 122 180.435 179.679 0.756 2
1 1362 . 1 1 A 122 122 ALA CA C 122 55.527 55.204 0.323 2
1 1363 . 1 1 A 122 122 ALA CB C 122 17.814 18.065 -0.251 2
1 1364 . 1 1 A 122 122 ALA N N 122 121.068 121.216 -0.148 2
1 1365 . 1 1 A 123 123 GLN H H 123 7.507 7.813 -0.306 2
1 1366 . 1 1 A 123 123 GLN HA H 123 4.153 3.946 0.207 2
1 1371 . 1 1 A 123 123 GLN C C 123 180.561 178.556 2.005 2
1 1372 . 1 1 A 123 123 GLN CA C 123 59.948 58.862 1.086 2
1 1373 . 1 1 A 123 123 GLN CB C 123 29.135 28.289 0.846 2
1 1375 . 1 1 A 123 123 GLN N N 123 120.324 117.238 3.086 2
1 1376 . 1 1 A 124 124 ILE H H 124 8.318 7.995 0.323 2
1 1377 . 1 1 A 124 124 ILE HA H 124 3.635 3.782 -0.147 2
1 1387 . 1 1 A 124 124 ILE C C 124 176.481 177.979 -1.498 2
1 1388 . 1 1 A 124 124 ILE CA C 124 66.432 64.442 1.990 2
1 1389 . 1 1 A 124 124 ILE CB C 124 39.168 37.758 1.410 2
1 1393 . 1 1 A 124 124 ILE N N 124 123.747 118.821 4.926 2
1 1394 . 1 1 A 125 125 GLN H H 125 8.474 7.984 0.490 2
1 1395 . 1 1 A 125 125 GLN HA H 125 4.264 3.926 0.338 2
1 1402 . 1 1 A 125 125 GLN C C 125 178.947 177.901 1.046 2
1 1403 . 1 1 A 125 125 GLN CA C 125 59.651 58.445 1.206 2
1 1404 . 1 1 A 125 125 GLN CB C 125 28.880 28.324 0.556 2
1 1406 . 1 1 A 125 125 GLN N N 125 120.368 120.819 -0.451 2
1 1408 . 1 1 A 126 126 ALA H H 126 8.002 7.773 0.229 2
1 1409 . 1 1 A 126 126 ALA HA H 126 4.144 4.024 0.120 2
1 1413 . 1 1 A 126 126 ALA C C 126 179.316 179.793 -0.477 2
1 1414 . 1 1 A 126 126 ALA CA C 126 55.036 54.909 0.127 2
1 1415 . 1 1 A 126 126 ALA CB C 126 18.087 18.082 0.005 2
1 1416 . 1 1 A 126 126 ALA N N 126 121.661 121.497 0.164 2
1 1417 . 1 1 A 127 127 ALA H H 127 7.823 8.068 -0.245 2
1 1418 . 1 1 A 127 127 ALA HA H 127 4.162 4.036 0.126 2
1 1422 . 1 1 A 127 127 ALA C C 127 180.707 179.422 1.285 2
1 1423 . 1 1 A 127 127 ALA CA C 127 55.080 54.867 0.213 2
1 1424 . 1 1 A 127 127 ALA CB C 127 19.354 18.307 1.047 2
1 1425 . 1 1 A 127 127 ALA N N 127 119.853 119.828 0.025 2
1 1426 . 1 1 A 128 128 ALA H H 128 8.936 7.818 1.118 2
1 1427 . 1 1 A 128 128 ALA HA H 128 3.928 3.809 0.119 2
1 1431 . 1 1 A 128 128 ALA C C 128 181.031 179.321 1.710 2
1 1432 . 1 1 A 128 128 ALA CA C 128 55.502 54.690 0.812 2
1 1433 . 1 1 A 128 128 ALA CB C 128 16.609 17.797 -1.188 2
1 1434 . 1 1 A 128 128 ALA N N 128 121.355 120.329 1.026 2
1 1435 . 1 1 A 129 129 THR H H 129 8.543 7.626 0.917 2
1 1436 . 1 1 A 129 129 THR HA H 129 4.015 3.692 0.323 2
1 1441 . 1 1 A 129 129 THR C C 129 177.332 176.349 0.983 2
1 1442 . 1 1 A 129 129 THR CA C 129 65.893 65.157 0.736 2
1 1443 . 1 1 A 129 129 THR CB C 129 68.566 68.429 0.137 2
1 1445 . 1 1 A 129 129 THR N N 129 112.709 111.834 0.875 2
1 1446 . 1 1 A 130 130 LYS H H 130 8.126 7.503 0.623 2
1 1447 . 1 1 A 130 130 LYS HA H 130 4.000 4.011 -0.011 2
1 1456 . 1 1 A 130 130 LYS C C 130 179.082 178.552 0.530 2
1 1457 . 1 1 A 130 130 LYS CA C 130 60.299 58.740 1.559 2
1 1458 . 1 1 A 130 130 LYS CB C 130 32.767 32.069 0.698 2
1 1462 . 1 1 A 130 130 LYS N N 130 123.879 120.987 2.892 2
1 1463 . 1 1 A 131 131 ALA H H 131 7.184 7.765 -0.581 2
1 1464 . 1 1 A 131 131 ALA HA H 131 4.005 4.241 -0.236 2
1 1468 . 1 1 A 131 131 ALA C C 131 178.482 179.557 -1.075 2
1 1469 . 1 1 A 131 131 ALA CA C 131 55.027 55.170 -0.143 2
1 1470 . 1 1 A 131 131 ALA CB C 131 18.669 19.454 -0.785 2
1 1471 . 1 1 A 131 131 ALA N N 131 118.590 121.152 -2.562 2
1 1472 . 1 1 A 132 132 TRP H H 132 7.977 8.643 -0.666 2
1 1473 . 1 1 A 132 132 TRP HA H 132 4.001 4.216 -0.215 2
1 1480 . 1 1 A 132 132 TRP C C 132 177.332 175.783 1.549 2
1 1481 . 1 1 A 132 132 TRP CA C 132 60.431 57.435 2.996 2
1 1482 . 1 1 A 132 132 TRP CB C 132 27.786 27.653 0.133 2
1 1486 . 1 1 A 132 132 TRP N N 132 119.168 117.060 2.108 2
1 1488 . 1 1 A 133 133 ARG H H 133 8.006 8.075 -0.069 2
1 1489 . 1 1 A 133 133 ARG HA H 133 4.027 4.387 -0.360 2
1 1497 . 1 1 A 133 133 ARG C C 133 176.664 178.042 -1.378 2
1 1498 . 1 1 A 133 133 ARG CA C 133 59.355 57.228 2.127 2
1 1499 . 1 1 A 133 133 ARG CB C 133 30.451 32.273 -1.822 2
1 1502 . 1 1 A 133 133 ARG N N 133 113.062 120.689 -7.627 2
1 1504 . 1 1 A 134 134 LYS H H 134 7.322 7.775 -0.453 2
1 1505 . 1 1 A 134 134 LYS HA H 134 4.313 4.364 -0.051 2
1 1514 . 1 1 A 134 134 LYS C C 134 176.282 176.244 0.038 2
1 1515 . 1 1 A 134 134 LYS CA C 134 54.922 56.871 -1.949 2
1 1516 . 1 1 A 134 134 LYS CB C 134 32.633 31.765 0.868 2
1 1520 . 1 1 A 134 134 LYS N N 134 118.170 118.014 0.156 2
1 1521 . 1 1 A 135 135 LEU H H 135 7.440 7.763 -0.323 2
1 1522 . 1 1 A 135 135 LEU HA H 135 4.174 4.611 -0.437 2
1 1532 . 1 1 A 135 135 LEU CA C 135 54.408 52.542 1.866 2
1 1533 . 1 1 A 135 135 LEU CB C 135 40.407 41.803 -1.396 2
1 1537 . 1 1 A 135 135 LEU N N 135 123.358 120.803 2.555 2
1 1538 . 1 1 A 136 136 PRO HA H 136 4.437 4.562 -0.125 2
1 1545 . 1 1 A 136 136 PRO C C 136 177.106 176.353 0.753 2
1 1546 . 1 1 A 136 136 PRO CA C 136 62.889 63.662 -0.773 2
1 1547 . 1 1 A 136 136 PRO CB C 136 32.192 32.285 -0.093 2
1 1550 . 1 1 A 137 137 VAL H H 137 8.219 7.992 0.227 2
1 1551 . 1 1 A 137 137 VAL HA H 137 4.077 4.437 -0.360 2
1 1559 . 1 1 A 137 137 VAL C C 137 176.305 175.548 0.757 2
1 1560 . 1 1 A 137 137 VAL CA C 137 61.958 61.524 0.434 2
1 1561 . 1 1 A 137 137 VAL CB C 137 32.755 33.480 -0.725 2
1 1564 . 1 1 A 137 137 VAL N N 137 120.079 117.665 2.414 2
1 1565 . 1 1 A 138 138 LYS H H 138 8.444 8.592 -0.148 2
1 1566 . 1 1 A 138 138 LYS HA H 138 4.316 4.368 -0.052 2
1 1575 . 1 1 A 138 138 LYS C C 138 176.790 176.731 0.059 2
1 1576 . 1 1 A 138 138 LYS CA C 138 56.792 56.891 -0.098 2
1 1577 . 1 1 A 138 138 LYS CB C 138 33.205 33.367 -0.162 2
1 1581 . 1 1 A 138 138 LYS N N 138 126.449 124.621 1.828 2
1 1582 . 1 1 A 139 139 GLY H H 139 8.518 8.140 0.378 2
1 1583 . 1 1 A 139 139 GLY HA2 H 139 4.070 3.988 0.082 2
1 1584 . 1 1 A 139 139 GLY HA3 H 139 3.897 3.996 -0.099 2
1 1585 . 1 1 A 139 139 GLY C C 139 172.874 173.257 -0.383 2
1 1586 . 1 1 A 139 139 GLY CA C 139 45.157 45.790 -0.633 2
1 1587 . 1 1 A 139 139 GLY N N 139 112.617 109.285 3.332 2
stop_
save_