data_16353_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 16353
_Entry.PDB_ID 2KK6
_Entry.NMR_STAR_version 3.0.9.100
save_
save_delta_chem_shifts_single
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_single
_Entity_delta_chem_shifts.Conformer_type "single"
_Entity_delta_chem_shifts.Conformer_count 20
_Entity_delta_chem_shifts.Best_conformer 1
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Conformer_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 1 . 1 1 1 A 10 10 HIS HA H 10 4.616 4.569 0.047 1
1 4 . 1 1 1 A 10 10 HIS C C 10 174.981 175.285 -0.304 1
1 5 . 1 1 1 A 10 10 HIS CA C 10 56.555 57.705 -1.150 1
1 6 . 1 1 1 A 10 10 HIS CB C 10 30.231 30.183 0.048 1
1 7 . 1 1 1 A 11 11 MET H H 11 8.103 7.841 0.262 1
1 8 . 1 1 1 A 11 11 MET HA H 11 4.439 4.611 -0.172 1
1 13 . 1 1 1 A 11 11 MET C C 11 175.888 173.829 2.059 1
1 14 . 1 1 1 A 11 11 MET CA C 11 55.090 54.787 0.303 1
1 15 . 1 1 1 A 11 11 MET CB C 11 33.121 34.577 -1.456 1
1 17 . 1 1 1 A 11 11 MET N N 11 120.743 113.168 7.575 1
1 18 . 1 1 1 A 12 12 LYS H H 12 8.065 8.563 -0.498 1
1 19 . 1 1 1 A 12 12 LYS HA H 12 4.407 4.809 -0.402 1
1 28 . 1 1 1 A 12 12 LYS CA C 12 54.894 52.672 2.222 1
1 29 . 1 1 1 A 12 12 LYS CB C 12 31.863 33.663 -1.800 1
1 33 . 1 1 1 A 12 12 LYS N N 12 123.187 118.833 4.354 1
1 34 . 1 1 1 A 13 13 PRO HA H 13 4.347 4.516 -0.169 1
1 41 . 1 1 1 A 13 13 PRO C C 13 176.891 177.615 -0.724 1
1 42 . 1 1 1 A 13 13 PRO CA C 13 62.542 62.486 0.056 1
1 43 . 1 1 1 A 13 13 PRO CB C 13 32.663 32.534 0.129 1
1 46 . 1 1 1 A 14 14 LEU H H 14 8.339 8.796 -0.457 1
1 47 . 1 1 1 A 14 14 LEU HA H 14 3.373 3.851 -0.478 1
1 57 . 1 1 1 A 14 14 LEU C C 14 176.683 178.186 -1.503 1
1 58 . 1 1 1 A 14 14 LEU CA C 14 58.555 57.640 0.915 1
1 59 . 1 1 1 A 14 14 LEU CB C 14 41.828 41.204 0.624 1
1 63 . 1 1 1 A 14 14 LEU N N 14 123.191 124.004 -0.813 1
1 64 . 1 1 1 A 15 15 ALA H H 15 8.175 8.137 0.038 1
1 65 . 1 1 1 A 15 15 ALA HA H 15 3.983 4.090 -0.107 1
1 69 . 1 1 1 A 15 15 ALA C C 15 178.697 179.541 -0.844 1
1 70 . 1 1 1 A 15 15 ALA CA C 15 54.164 55.557 -1.393 1
1 71 . 1 1 1 A 15 15 ALA CB C 15 18.771 18.469 0.302 1
1 72 . 1 1 1 A 15 15 ALA N N 15 113.594 120.307 -6.713 1
1 73 . 1 1 1 A 16 16 GLU H H 16 7.458 7.522 -0.064 1
1 74 . 1 1 1 A 16 16 GLU HA H 16 4.266 4.318 -0.052 1
1 79 . 1 1 1 A 16 16 GLU C C 16 176.510 177.049 -0.539 1
1 80 . 1 1 1 A 16 16 GLU CA C 16 55.196 57.338 -2.142 1
1 81 . 1 1 1 A 16 16 GLU CB C 16 30.907 29.824 1.083 1
1 83 . 1 1 1 A 16 16 GLU N N 16 113.348 115.385 -2.037 1
1 84 . 1 1 1 A 17 17 GLN H H 17 7.501 6.945 0.556 1
1 85 . 1 1 1 A 17 17 GLN HA H 17 3.683 4.032 -0.349 1
1 92 . 1 1 1 A 17 17 GLN C C 17 178.053 176.772 1.281 1
1 93 . 1 1 1 A 17 17 GLN CA C 17 54.606 55.717 -1.111 1
1 94 . 1 1 1 A 17 17 GLN CB C 17 25.758 28.348 -2.590 1
1 96 . 1 1 1 A 17 17 GLN N N 17 119.411 119.255 0.156 1
1 98 . 1 1 1 A 18 18 ASP H H 18 8.949 8.767 0.182 1
1 99 . 1 1 1 A 18 18 ASP HA H 18 4.184 4.142 0.042 1
1 102 . 1 1 1 A 18 18 ASP C C 18 175.263 178.533 -3.270 1
1 103 . 1 1 1 A 18 18 ASP CA C 18 57.275 56.795 0.480 1
1 104 . 1 1 1 A 18 18 ASP CB C 18 40.620 39.736 0.884 1
1 105 . 1 1 1 A 18 18 ASP N N 18 124.676 124.450 0.226 1
1 106 . 1 1 1 A 19 19 TRP H H 19 6.068 7.718 -1.650 1
1 107 . 1 1 1 A 19 19 TRP HA H 19 5.045 4.724 0.321 1
1 116 . 1 1 1 A 19 19 TRP C C 19 175.902 176.414 -0.512 1
1 117 . 1 1 1 A 19 19 TRP CA C 19 53.542 58.545 -5.003 1
1 118 . 1 1 1 A 19 19 TRP CB C 19 29.179 28.329 0.850 1
1 124 . 1 1 1 A 19 19 TRP N N 19 107.757 117.748 -9.991 1
1 126 . 1 1 1 A 20 20 TYR H H 20 7.430 7.117 0.313 1
1 127 . 1 1 1 A 20 20 TYR HA H 20 5.601 5.216 0.385 1
1 132 . 1 1 1 A 20 20 TYR C C 20 175.498 175.860 -0.362 1
1 133 . 1 1 1 A 20 20 TYR CA C 20 56.967 56.598 0.369 1
1 134 . 1 1 1 A 20 20 TYR CB C 20 39.083 37.702 1.381 1
1 137 . 1 1 1 A 20 20 TYR N N 20 123.173 122.085 1.088 1
1 138 . 1 1 1 A 21 21 HIS H H 21 8.934 8.696 0.238 1
1 139 . 1 1 1 A 21 21 HIS HA H 21 4.295 4.504 -0.209 1
1 144 . 1 1 1 A 21 21 HIS C C 21 175.177 175.153 0.024 1
1 145 . 1 1 1 A 21 21 HIS CA C 21 56.572 56.124 0.448 1
1 146 . 1 1 1 A 21 21 HIS CB C 21 33.365 30.088 3.277 1
1 149 . 1 1 1 A 21 21 HIS N N 21 125.732 126.490 -0.758 1
1 150 . 1 1 1 A 22 22 GLY H H 22 5.280 7.023 -1.743 1
1 151 . 1 1 1 A 22 22 GLY HA2 H 22 3.905 3.337 0.568 1
1 152 . 1 1 1 A 22 22 GLY HA3 H 22 3.585 3.714 -0.129 1
1 153 . 1 1 1 A 22 22 GLY C C 22 174.411 174.671 -0.260 1
1 154 . 1 1 1 A 22 22 GLY CA C 22 46.402 44.361 2.041 1
1 155 . 1 1 1 A 22 22 GLY N N 22 104.568 106.493 -1.925 1
1 156 . 1 1 1 A 23 23 ALA H H 23 8.768 8.446 0.322 1
1 157 . 1 1 1 A 23 23 ALA HA H 23 5.171 4.649 0.522 1
1 161 . 1 1 1 A 23 23 ALA C C 23 177.180 177.582 -0.402 1
1 162 . 1 1 1 A 23 23 ALA CA C 23 51.153 51.536 -0.383 1
1 163 . 1 1 1 A 23 23 ALA CB C 23 16.999 18.837 -1.838 1
1 164 . 1 1 1 A 23 23 ALA N N 23 130.297 128.445 1.852 1
1 165 . 1 1 1 A 24 24 ILE H H 24 7.267 7.180 0.087 1
1 166 . 1 1 1 A 24 24 ILE HA H 24 4.460 4.285 0.175 1
1 176 . 1 1 1 A 24 24 ILE CA C 24 58.529 59.990 -1.461 1
1 177 . 1 1 1 A 24 24 ILE CB C 24 38.763 37.611 1.152 1
1 181 . 1 1 1 A 24 24 ILE N N 24 118.903 114.997 3.906 1
1 182 . 1 1 1 A 25 25 PRO HA H 25 4.224 4.393 -0.169 1
1 189 . 1 1 1 A 25 25 PRO C C 25 176.918 177.503 -0.585 1
1 190 . 1 1 1 A 25 25 PRO CA C 25 62.907 62.479 0.428 1
1 191 . 1 1 1 A 25 25 PRO CB C 25 32.671 32.332 0.339 1
1 194 . 1 1 1 A 26 26 ARG H H 26 8.781 9.112 -0.331 1
1 195 . 1 1 1 A 26 26 ARG HA H 26 3.472 3.888 -0.416 1
1 202 . 1 1 1 A 26 26 ARG C C 26 178.112 177.977 0.135 1
1 203 . 1 1 1 A 26 26 ARG CA C 26 60.863 59.475 1.388 1
1 204 . 1 1 1 A 26 26 ARG CB C 26 30.314 29.759 0.555 1
1 207 . 1 1 1 A 26 26 ARG N N 26 124.635 121.331 3.304 1
1 208 . 1 1 1 A 27 27 ILE H H 27 8.540 8.084 0.456 1
1 209 . 1 1 1 A 27 27 ILE HA H 27 3.787 3.666 0.121 1
1 219 . 1 1 1 A 27 27 ILE C C 27 177.390 177.381 0.009 1
1 220 . 1 1 1 A 27 27 ILE CA C 27 64.329 64.822 -0.493 1
1 221 . 1 1 1 A 27 27 ILE CB C 27 37.413 37.954 -0.541 1
1 225 . 1 1 1 A 27 27 ILE N N 27 115.859 119.930 -4.071 1
1 226 . 1 1 1 A 28 28 GLU H H 28 6.953 8.560 -1.607 1
1 227 . 1 1 1 A 28 28 GLU HA H 28 4.067 4.028 0.039 1
1 232 . 1 1 1 A 28 28 GLU C C 28 179.006 179.423 -0.417 1
1 233 . 1 1 1 A 28 28 GLU CA C 28 58.985 59.676 -0.691 1
1 234 . 1 1 1 A 28 28 GLU CB C 28 29.316 29.123 0.193 1
1 236 . 1 1 1 A 28 28 GLU N N 28 120.554 119.161 1.393 1
1 237 . 1 1 1 A 29 29 ALA H H 29 7.999 7.544 0.455 1
1 238 . 1 1 1 A 29 29 ALA HA H 29 3.822 4.033 -0.211 1
1 242 . 1 1 1 A 29 29 ALA C C 29 178.809 179.989 -1.180 1
1 243 . 1 1 1 A 29 29 ALA CA C 29 54.698 54.892 -0.194 1
1 244 . 1 1 1 A 29 29 ALA CB C 29 18.059 18.399 -0.340 1
1 245 . 1 1 1 A 29 29 ALA N N 29 120.122 122.455 -2.333 1
1 246 . 1 1 1 A 30 30 GLN H H 30 8.168 7.943 0.225 1
1 247 . 1 1 1 A 30 30 GLN HA H 30 3.811 4.213 -0.402 1
1 254 . 1 1 1 A 30 30 GLN C C 30 177.578 177.886 -0.308 1
1 255 . 1 1 1 A 30 30 GLN CA C 30 59.731 58.555 1.176 1
1 256 . 1 1 1 A 30 30 GLN CB C 30 28.161 28.825 -0.664 1
1 258 . 1 1 1 A 30 30 GLN N N 30 112.109 115.784 -3.675 1
1 260 . 1 1 1 A 31 31 GLU H H 31 7.248 8.287 -1.039 1
1 261 . 1 1 1 A 31 31 GLU HA H 31 4.063 4.090 -0.027 1
1 266 . 1 1 1 A 31 31 GLU C C 31 177.423 179.085 -1.662 1
1 267 . 1 1 1 A 31 31 GLU CA C 31 57.650 59.231 -1.581 1
1 268 . 1 1 1 A 31 31 GLU CB C 31 29.757 29.384 0.373 1
1 270 . 1 1 1 A 31 31 GLU N N 31 115.340 119.572 -4.232 1
1 271 . 1 1 1 A 32 32 LEU H H 32 7.169 7.673 -0.504 1
1 272 . 1 1 1 A 32 32 LEU HA H 32 4.087 4.323 -0.236 1
1 282 . 1 1 1 A 32 32 LEU C C 32 175.850 177.072 -1.222 1
1 283 . 1 1 1 A 32 32 LEU CA C 32 55.580 56.092 -0.512 1
1 284 . 1 1 1 A 32 32 LEU CB C 32 42.910 41.981 0.929 1
1 288 . 1 1 1 A 32 32 LEU N N 32 116.367 114.163 2.204 1
1 289 . 1 1 1 A 33 33 LEU H H 33 7.062 7.773 -0.711 1
1 290 . 1 1 1 A 33 33 LEU HA H 33 4.431 4.347 0.084 1
1 300 . 1 1 1 A 33 33 LEU C C 33 174.837 176.831 -1.994 1
1 301 . 1 1 1 A 33 33 LEU CA C 33 53.521 54.433 -0.912 1
1 302 . 1 1 1 A 33 33 LEU CB C 33 43.301 42.762 0.539 1
1 306 . 1 1 1 A 33 33 LEU N N 33 118.568 122.071 -3.503 1
1 307 . 1 1 1 A 34 34 LYS H H 34 8.749 8.591 0.158 1
1 308 . 1 1 1 A 34 34 LYS HA H 34 4.162 4.268 -0.106 1
1 317 . 1 1 1 A 34 34 LYS C C 34 174.378 175.688 -1.310 1
1 318 . 1 1 1 A 34 34 LYS CA C 34 56.575 56.511 0.064 1
1 319 . 1 1 1 A 34 34 LYS CB C 34 36.918 34.376 2.542 1
1 323 . 1 1 1 A 34 34 LYS N N 34 121.659 118.318 3.341 1
1 324 . 1 1 1 A 35 35 LYS H H 35 8.137 7.594 0.543 1
1 325 . 1 1 1 A 35 35 LYS HA H 35 4.011 4.817 -0.806 1
1 334 . 1 1 1 A 35 35 LYS C C 35 174.343 175.810 -1.467 1
1 335 . 1 1 1 A 35 35 LYS CA C 35 53.960 54.441 -0.481 1
1 336 . 1 1 1 A 35 35 LYS CB C 35 35.587 34.544 1.043 1
1 340 . 1 1 1 A 35 35 LYS N N 35 119.354 116.472 2.882 1
1 341 . 1 1 1 A 36 36 GLN H H 36 8.394 8.628 -0.234 1
1 342 . 1 1 1 A 36 36 GLN HA H 36 4.187 4.964 -0.777 1
1 349 . 1 1 1 A 36 36 GLN C C 36 177.012 176.535 0.477 1
1 350 . 1 1 1 A 36 36 GLN CA C 36 57.750 56.717 1.033 1
1 351 . 1 1 1 A 36 36 GLN CB C 36 28.433 28.916 -0.483 1
1 353 . 1 1 1 A 36 36 GLN N N 36 120.248 121.640 -1.392 1
1 355 . 1 1 1 A 37 37 GLY H H 37 9.597 9.002 0.595 1
1 356 . 1 1 1 A 37 37 GLY HA2 H 37 4.486 4.125 0.361 1
1 357 . 1 1 1 A 37 37 GLY HA3 H 37 3.926 4.130 -0.204 1
1 358 . 1 1 1 A 37 37 GLY C C 37 176.285 174.604 1.681 1
1 359 . 1 1 1 A 37 37 GLY CA C 37 46.146 45.486 0.660 1
1 360 . 1 1 1 A 37 37 GLY N N 37 116.637 114.314 2.323 1
1 361 . 1 1 1 A 38 38 ASP H H 38 8.925 8.172 0.753 1
1 362 . 1 1 1 A 38 38 ASP HA H 38 5.697 4.611 1.086 1
1 365 . 1 1 1 A 38 38 ASP C C 38 176.181 175.656 0.525 1
1 366 . 1 1 1 A 38 38 ASP CA C 38 55.066 55.420 -0.354 1
1 367 . 1 1 1 A 38 38 ASP CB C 38 42.933 41.226 1.707 1
1 368 . 1 1 1 A 38 38 ASP N N 38 127.293 121.948 5.345 1
1 369 . 1 1 1 A 39 39 PHE H H 39 8.647 8.662 -0.015 1
1 370 . 1 1 1 A 39 39 PHE HA H 39 6.025 6.026 -0.001 1
1 378 . 1 1 1 A 39 39 PHE C C 39 170.948 172.993 -2.045 1
1 379 . 1 1 1 A 39 39 PHE CA C 39 56.376 55.832 0.544 1
1 380 . 1 1 1 A 39 39 PHE CB C 39 44.583 43.287 1.296 1
1 386 . 1 1 1 A 39 39 PHE N N 39 117.102 120.173 -3.071 1
1 387 . 1 1 1 A 40 40 LEU H H 40 9.186 8.767 0.419 1
1 388 . 1 1 1 A 40 40 LEU HA H 40 4.983 5.211 -0.228 1
1 398 . 1 1 1 A 40 40 LEU C C 40 174.787 174.672 0.115 1
1 399 . 1 1 1 A 40 40 LEU CA C 40 54.610 53.630 0.980 1
1 400 . 1 1 1 A 40 40 LEU CB C 40 44.330 46.130 -1.800 1
1 404 . 1 1 1 A 40 40 LEU N N 40 114.388 118.762 -4.374 1
1 405 . 1 1 1 A 41 41 VAL H H 41 9.390 9.457 -0.067 1
1 406 . 1 1 1 A 41 41 VAL HA H 41 5.742 4.979 0.763 1
1 414 . 1 1 1 A 41 41 VAL C C 41 172.760 175.366 -2.606 1
1 415 . 1 1 1 A 41 41 VAL CA C 41 60.814 61.812 -0.998 1
1 416 . 1 1 1 A 41 41 VAL CB C 41 34.908 33.208 1.700 1
1 419 . 1 1 1 A 41 41 VAL N N 41 119.873 122.918 -3.045 1
1 420 . 1 1 1 A 42 42 ARG H H 42 9.598 9.287 0.311 1
1 421 . 1 1 1 A 42 42 ARG HA H 42 5.247 5.369 -0.122 1
1 429 . 1 1 1 A 42 42 ARG C C 42 173.379 174.222 -0.843 1
1 430 . 1 1 1 A 42 42 ARG CA C 42 53.202 53.714 -0.512 1
1 431 . 1 1 1 A 42 42 ARG CB C 42 33.507 34.037 -0.530 1
1 434 . 1 1 1 A 42 42 ARG N N 42 124.179 124.654 -0.475 1
1 436 . 1 1 1 A 43 43 GLU H H 43 8.234 8.985 -0.751 1
1 437 . 1 1 1 A 43 43 GLU HA H 43 4.890 4.679 0.211 1
1 442 . 1 1 1 A 43 43 GLU C C 43 176.929 176.324 0.605 1
1 443 . 1 1 1 A 43 43 GLU CA C 43 54.846 54.801 0.045 1
1 444 . 1 1 1 A 43 43 GLU CB C 43 31.599 31.755 -0.156 1
1 446 . 1 1 1 A 43 43 GLU N N 43 124.103 121.899 2.204 1
1 447 . 1 1 1 A 44 44 SER H H 44 9.033 9.116 -0.083 1
1 448 . 1 1 1 A 44 44 SER HA H 44 3.957 4.484 -0.527 1
1 451 . 1 1 1 A 44 44 SER C C 44 175.005 174.038 0.967 1
1 452 . 1 1 1 A 44 44 SER CA C 44 59.393 58.504 0.889 1
1 453 . 1 1 1 A 44 44 SER CB C 44 63.619 63.242 0.377 1
1 454 . 1 1 1 A 44 44 SER N N 44 124.316 120.861 3.455 1
1 455 . 1 1 1 A 45 45 HIS H H 45 8.461 8.577 -0.116 1
1 456 . 1 1 1 A 45 45 HIS HA H 45 4.132 4.254 -0.122 1
1 460 . 1 1 1 A 45 45 HIS C C 45 176.480 176.007 0.473 1
1 461 . 1 1 1 A 45 45 HIS CA C 45 58.887 57.076 1.811 1
1 462 . 1 1 1 A 45 45 HIS CB C 45 30.180 29.599 0.581 1
1 464 . 1 1 1 A 45 45 HIS N N 45 127.694 125.953 1.741 1
1 465 . 1 1 1 A 46 46 GLY H H 46 8.513 8.296 0.217 1
1 466 . 1 1 1 A 46 46 GLY HA2 H 46 3.827 3.795 0.032 1
1 467 . 1 1 1 A 46 46 GLY HA3 H 46 3.827 3.856 -0.029 1
1 468 . 1 1 1 A 46 46 GLY C C 46 173.630 173.540 0.090 1
1 469 . 1 1 1 A 46 46 GLY CA C 46 45.188 45.206 -0.018 1
1 470 . 1 1 1 A 46 46 GLY N N 46 110.761 114.361 -3.600 1
1 471 . 1 1 1 A 47 47 LYS H H 47 7.216 8.022 -0.806 1
1 472 . 1 1 1 A 47 47 LYS HA H 47 4.540 4.619 -0.079 1
1 481 . 1 1 1 A 47 47 LYS CA C 47 53.475 52.975 0.500 1
1 482 . 1 1 1 A 47 47 LYS CB C 47 33.325 33.720 -0.395 1
1 486 . 1 1 1 A 47 47 LYS N N 47 121.356 122.334 -0.978 1
1 487 . 1 1 1 A 48 48 PRO HA H 48 4.181 4.237 -0.056 1
1 494 . 1 1 1 A 48 48 PRO C C 48 178.920 177.494 1.426 1
1 495 . 1 1 1 A 48 48 PRO CA C 48 63.239 63.811 -0.572 1
1 496 . 1 1 1 A 48 48 PRO CB C 48 31.523 31.349 0.174 1
1 499 . 1 1 1 A 49 49 GLY H H 49 9.752 8.674 1.078 1
1 500 . 1 1 1 A 49 49 GLY HA2 H 49 4.053 4.009 0.044 1
1 501 . 1 1 1 A 49 49 GLY HA3 H 49 3.374 4.117 -0.743 1
1 502 . 1 1 1 A 49 49 GLY C C 49 172.093 174.166 -2.073 1
1 503 . 1 1 1 A 49 49 GLY CA C 49 45.041 45.263 -0.222 1
1 504 . 1 1 1 A 49 49 GLY N N 49 112.415 112.813 -0.398 1
1 505 . 1 1 1 A 50 50 GLU H H 50 7.623 7.653 -0.030 1
1 506 . 1 1 1 A 50 50 GLU HA H 50 4.537 4.761 -0.224 1
1 511 . 1 1 1 A 50 50 GLU C C 50 173.297 174.695 -1.398 1
1 512 . 1 1 1 A 50 50 GLU CA C 50 55.174 55.401 -0.227 1
1 513 . 1 1 1 A 50 50 GLU CB C 50 31.651 30.384 1.267 1
1 515 . 1 1 1 A 50 50 GLU N N 50 121.600 121.652 -0.052 1
1 516 . 1 1 1 A 51 51 TYR H H 51 9.452 9.299 0.153 1
1 517 . 1 1 1 A 51 51 TYR HA H 51 5.382 5.447 -0.065 1
1 524 . 1 1 1 A 51 51 TYR C C 51 174.387 175.123 -0.736 1
1 525 . 1 1 1 A 51 51 TYR CA C 51 57.592 57.762 -0.170 1
1 526 . 1 1 1 A 51 51 TYR CB C 51 41.820 39.995 1.825 1
1 531 . 1 1 1 A 51 51 TYR N N 51 125.790 127.049 -1.259 1
1 532 . 1 1 1 A 52 52 VAL H H 52 9.471 9.538 -0.067 1
1 533 . 1 1 1 A 52 52 VAL HA H 52 4.840 4.969 -0.129 1
1 541 . 1 1 1 A 52 52 VAL C C 52 174.947 174.940 0.007 1
1 542 . 1 1 1 A 52 52 VAL CA C 52 60.991 61.419 -0.428 1
1 543 . 1 1 1 A 52 52 VAL CB C 52 36.829 33.647 3.182 1
1 546 . 1 1 1 A 52 52 VAL N N 52 120.617 123.733 -3.116 1
1 547 . 1 1 1 A 53 53 LEU H H 53 9.457 9.406 0.051 1
1 548 . 1 1 1 A 53 53 LEU HA H 53 5.294 5.222 0.072 1
1 558 . 1 1 1 A 53 53 LEU C C 53 175.024 174.598 0.426 1
1 559 . 1 1 1 A 53 53 LEU CA C 53 53.904 54.355 -0.451 1
1 560 . 1 1 1 A 53 53 LEU CB C 53 44.756 44.094 0.662 1
1 564 . 1 1 1 A 53 53 LEU N N 53 127.725 131.265 -3.540 1
1 565 . 1 1 1 A 54 54 SER H H 54 9.461 9.506 -0.045 1
1 566 . 1 1 1 A 54 54 SER HA H 54 5.691 4.978 0.713 1
1 569 . 1 1 1 A 54 54 SER C C 54 172.227 172.856 -0.629 1
1 570 . 1 1 1 A 54 54 SER CA C 54 58.551 58.161 0.390 1
1 571 . 1 1 1 A 54 54 SER CB C 54 65.738 64.073 1.665 1
1 572 . 1 1 1 A 54 54 SER N N 54 127.178 124.875 2.303 1
1 573 . 1 1 1 A 55 55 VAL H H 55 9.049 8.974 0.075 1
1 574 . 1 1 1 A 55 55 VAL HA H 55 5.691 5.565 0.126 1
1 582 . 1 1 1 A 55 55 VAL C C 55 173.959 173.071 0.888 1
1 583 . 1 1 1 A 55 55 VAL CA C 55 58.398 59.564 -1.166 1
1 584 . 1 1 1 A 55 55 VAL CB C 55 36.262 34.790 1.472 1
1 587 . 1 1 1 A 55 55 VAL N N 55 120.619 126.162 -5.543 1
1 588 . 1 1 1 A 56 56 TYR H H 56 8.629 9.146 -0.517 1
1 589 . 1 1 1 A 56 56 TYR HA H 56 4.951 4.934 0.017 1
1 596 . 1 1 1 A 56 56 TYR C C 56 175.224 174.909 0.315 1
1 597 . 1 1 1 A 56 56 TYR CA C 56 56.684 57.066 -0.382 1
1 598 . 1 1 1 A 56 56 TYR CB C 56 39.646 38.911 0.735 1
1 603 . 1 1 1 A 56 56 TYR N N 56 127.444 131.147 -3.703 1
1 604 . 1 1 1 A 57 57 SER H H 57 8.869 8.741 0.128 1
1 605 . 1 1 1 A 57 57 SER HA H 57 4.739 4.859 -0.120 1
1 608 . 1 1 1 A 57 57 SER C C 57 174.492 172.680 1.812 1
1 609 . 1 1 1 A 57 57 SER CA C 57 57.591 57.285 0.306 1
1 610 . 1 1 1 A 57 57 SER CB C 57 64.281 66.386 -2.105 1
1 611 . 1 1 1 A 57 57 SER N N 57 122.165 123.073 -0.908 1
1 612 . 1 1 1 A 58 58 ASP H H 58 10.446 9.326 1.120 1
1 613 . 1 1 1 A 58 58 ASP HA H 58 4.382 4.329 0.053 1
1 616 . 1 1 1 A 58 58 ASP C C 58 176.398 176.155 0.243 1
1 617 . 1 1 1 A 58 58 ASP CA C 58 55.215 55.302 -0.087 1
1 618 . 1 1 1 A 58 58 ASP CB C 58 39.513 39.283 0.230 1
1 619 . 1 1 1 A 58 58 ASP N N 58 132.098 128.146 3.952 1
1 620 . 1 1 1 A 59 59 GLY H H 59 7.861 8.430 -0.569 1
1 621 . 1 1 1 A 59 59 GLY HA2 H 59 3.817 3.796 0.021 1
1 622 . 1 1 1 A 59 59 GLY HA3 H 59 4.086 3.854 0.232 1
1 623 . 1 1 1 A 59 59 GLY C C 59 173.111 173.443 -0.332 1
1 624 . 1 1 1 A 59 59 GLY CA C 59 45.486 45.300 0.186 1
1 625 . 1 1 1 A 59 59 GLY N N 59 102.674 104.617 -1.943 1
1 626 . 1 1 1 A 60 60 GLN H H 60 7.137 7.562 -0.425 1
1 627 . 1 1 1 A 60 60 GLN HA H 60 4.455 4.460 -0.005 1
1 634 . 1 1 1 A 60 60 GLN C C 60 173.549 174.940 -1.391 1
1 635 . 1 1 1 A 60 60 GLN CA C 60 53.388 53.743 -0.355 1
1 636 . 1 1 1 A 60 60 GLN CB C 60 32.373 30.589 1.784 1
1 638 . 1 1 1 A 60 60 GLN N N 60 116.206 119.353 -3.147 1
1 640 . 1 1 1 A 61 61 ARG H H 61 8.589 8.281 0.308 1
1 641 . 1 1 1 A 61 61 ARG HA H 61 4.740 4.313 0.427 1
1 649 . 1 1 1 A 61 61 ARG C C 61 174.458 174.659 -0.201 1
1 650 . 1 1 1 A 61 61 ARG CA C 61 57.116 55.561 1.555 1
1 651 . 1 1 1 A 61 61 ARG CB C 61 29.615 30.535 -0.920 1
1 654 . 1 1 1 A 61 61 ARG N N 61 120.467 121.700 -1.233 1
1 656 . 1 1 1 A 62 62 ARG H H 62 8.867 8.845 0.022 1
1 657 . 1 1 1 A 62 62 ARG HA H 62 4.297 4.413 -0.116 1
1 665 . 1 1 1 A 62 62 ARG C C 62 173.485 174.617 -1.132 1
1 666 . 1 1 1 A 62 62 ARG CA C 62 53.355 55.238 -1.883 1
1 667 . 1 1 1 A 62 62 ARG CB C 62 33.028 30.665 2.363 1
1 670 . 1 1 1 A 62 62 ARG N N 62 122.641 124.511 -1.870 1
1 672 . 1 1 1 A 63 63 HIS H H 63 7.997 8.606 -0.609 1
1 673 . 1 1 1 A 63 63 HIS HA H 63 5.427 5.454 -0.027 1
1 678 . 1 1 1 A 63 63 HIS C C 63 174.946 174.043 0.903 1
1 679 . 1 1 1 A 63 63 HIS CA C 63 54.689 54.261 0.428 1
1 680 . 1 1 1 A 63 63 HIS CB C 63 33.008 31.394 1.614 1
1 683 . 1 1 1 A 63 63 HIS N N 63 119.064 122.509 -3.445 1
1 684 . 1 1 1 A 64 64 PHE H H 64 9.880 9.482 0.398 1
1 685 . 1 1 1 A 64 64 PHE HA H 64 4.824 5.202 -0.378 1
1 693 . 1 1 1 A 64 64 PHE C C 64 174.882 175.453 -0.571 1
1 694 . 1 1 1 A 64 64 PHE CA C 64 56.489 56.574 -0.085 1
1 695 . 1 1 1 A 64 64 PHE CB C 64 41.405 42.522 -1.117 1
1 701 . 1 1 1 A 64 64 PHE N N 64 123.961 122.001 1.960 1
1 702 . 1 1 1 A 65 65 ILE H H 65 8.982 9.354 -0.372 1
1 703 . 1 1 1 A 65 65 ILE HA H 65 4.273 5.008 -0.735 1
1 713 . 1 1 1 A 65 65 ILE C C 65 176.556 175.539 1.017 1
1 714 . 1 1 1 A 65 65 ILE CA C 65 62.649 59.904 2.745 1
1 715 . 1 1 1 A 65 65 ILE CB C 65 38.296 41.102 -2.806 1
1 719 . 1 1 1 A 65 65 ILE N N 65 126.601 120.708 5.893 1
1 720 . 1 1 1 A 66 66 ILE H H 66 8.947 9.263 -0.316 1
1 721 . 1 1 1 A 66 66 ILE HA H 66 3.780 4.279 -0.499 1
1 731 . 1 1 1 A 66 66 ILE C C 66 175.721 175.712 0.009 1
1 732 . 1 1 1 A 66 66 ILE CA C 66 62.960 60.782 2.178 1
1 733 . 1 1 1 A 66 66 ILE CB C 66 37.209 37.903 -0.694 1
1 737 . 1 1 1 A 66 66 ILE N N 66 130.139 128.985 1.154 1
1 738 . 1 1 1 A 67 67 GLN H H 67 8.410 8.848 -0.438 1
1 739 . 1 1 1 A 67 67 GLN HA H 67 4.422 4.816 -0.394 1
1 746 . 1 1 1 A 67 67 GLN C C 67 174.347 174.117 0.230 1
1 747 . 1 1 1 A 67 67 GLN CA C 67 55.867 55.206 0.661 1
1 748 . 1 1 1 A 67 67 GLN CB C 67 29.950 30.136 -0.186 1
1 750 . 1 1 1 A 67 67 GLN N N 67 128.872 127.164 1.708 1
1 752 . 1 1 1 A 68 68 TYR H H 68 8.619 8.808 -0.189 1
1 753 . 1 1 1 A 68 68 TYR HA H 68 5.300 5.154 0.146 1
1 760 . 1 1 1 A 68 68 TYR C C 68 174.695 174.192 0.503 1
1 761 . 1 1 1 A 68 68 TYR CA C 68 55.579 55.977 -0.398 1
1 762 . 1 1 1 A 68 68 TYR CB C 68 39.479 39.540 -0.061 1
1 767 . 1 1 1 A 68 68 TYR N N 68 124.772 125.123 -0.351 1
1 768 . 1 1 1 A 69 69 VAL H H 69 8.539 8.608 -0.069 1
1 769 . 1 1 1 A 69 69 VAL HA H 69 4.046 4.399 -0.353 1
1 777 . 1 1 1 A 69 69 VAL C C 69 175.010 174.925 0.085 1
1 778 . 1 1 1 A 69 69 VAL CA C 69 60.611 60.524 0.087 1
1 779 . 1 1 1 A 69 69 VAL CB C 69 35.358 34.385 0.973 1
1 782 . 1 1 1 A 69 69 VAL N N 69 126.652 127.096 -0.444 1
1 783 . 1 1 1 A 70 70 ASP H H 70 9.089 9.293 -0.204 1
1 784 . 1 1 1 A 70 70 ASP HA H 70 4.025 4.195 -0.170 1
1 787 . 1 1 1 A 70 70 ASP C C 70 174.813 175.246 -0.433 1
1 788 . 1 1 1 A 70 70 ASP CA C 70 55.623 55.488 0.135 1
1 789 . 1 1 1 A 70 70 ASP CB C 70 39.081 39.380 -0.299 1
1 790 . 1 1 1 A 70 70 ASP N N 70 128.327 126.981 1.346 1
1 791 . 1 1 1 A 71 71 ASN H H 71 8.128 8.112 0.016 1
1 792 . 1 1 1 A 71 71 ASN HA H 71 3.597 3.553 0.044 1
1 797 . 1 1 1 A 71 71 ASN C C 71 173.250 173.462 -0.212 1
1 798 . 1 1 1 A 71 71 ASN CA C 71 54.728 54.146 0.582 1
1 799 . 1 1 1 A 71 71 ASN CB C 71 37.601 36.841 0.760 1
1 800 . 1 1 1 A 71 71 ASN N N 71 107.230 108.330 -1.100 1
1 802 . 1 1 1 A 72 72 MET H H 72 7.256 7.172 0.084 1
1 803 . 1 1 1 A 72 72 MET HA H 72 4.740 4.939 -0.199 1
1 808 . 1 1 1 A 72 72 MET C C 72 173.780 173.934 -0.154 1
1 809 . 1 1 1 A 72 72 MET CA C 72 53.703 54.292 -0.589 1
1 810 . 1 1 1 A 72 72 MET CB C 72 36.570 37.158 -0.588 1
1 812 . 1 1 1 A 72 72 MET N N 72 117.117 116.407 0.710 1
1 813 . 1 1 1 A 73 73 TYR H H 73 9.430 9.246 0.184 1
1 814 . 1 1 1 A 73 73 TYR HA H 73 5.718 5.145 0.573 1
1 821 . 1 1 1 A 73 73 TYR C C 73 176.140 175.672 0.468 1
1 822 . 1 1 1 A 73 73 TYR CA C 73 57.290 58.237 -0.947 1
1 823 . 1 1 1 A 73 73 TYR CB C 73 40.013 39.777 0.236 1
1 828 . 1 1 1 A 73 73 TYR N N 73 119.856 122.483 -2.627 1
1 829 . 1 1 1 A 74 74 ARG H H 74 9.038 8.823 0.215 1
1 830 . 1 1 1 A 74 74 ARG HA H 74 4.867 4.981 -0.114 1
1 838 . 1 1 1 A 74 74 ARG C C 74 173.954 174.753 -0.799 1
1 839 . 1 1 1 A 74 74 ARG CA C 74 54.887 54.740 0.147 1
1 840 . 1 1 1 A 74 74 ARG CB C 74 34.484 34.010 0.474 1
1 843 . 1 1 1 A 74 74 ARG N N 74 117.344 119.695 -2.351 1
1 845 . 1 1 1 A 75 75 PHE H H 75 9.005 8.598 0.407 1
1 846 . 1 1 1 A 75 75 PHE HA H 75 5.046 4.653 0.393 1
1 854 . 1 1 1 A 75 75 PHE C C 75 176.186 176.300 -0.114 1
1 855 . 1 1 1 A 75 75 PHE CA C 75 59.658 59.172 0.486 1
1 856 . 1 1 1 A 75 75 PHE CB C 75 39.356 40.185 -0.829 1
1 862 . 1 1 1 A 75 75 PHE N N 75 117.865 119.701 -1.836 1
1 863 . 1 1 1 A 76 76 GLU H H 76 8.213 8.343 -0.130 1
1 864 . 1 1 1 A 76 76 GLU HA H 76 4.586 4.596 -0.010 1
1 869 . 1 1 1 A 76 76 GLU C C 76 175.238 176.508 -1.270 1
1 870 . 1 1 1 A 76 76 GLU CA C 76 55.994 54.968 1.026 1
1 871 . 1 1 1 A 76 76 GLU CB C 76 31.805 30.601 1.204 1
1 873 . 1 1 1 A 76 76 GLU N N 76 116.834 117.271 -0.437 1
1 874 . 1 1 1 A 77 77 GLY H H 77 8.692 8.975 -0.283 1
1 875 . 1 1 1 A 77 77 GLY HA2 H 77 4.166 3.880 0.286 1
1 876 . 1 1 1 A 77 77 GLY HA3 H 77 4.015 3.887 0.128 1
1 877 . 1 1 1 A 77 77 GLY C C 77 173.784 174.107 -0.323 1
1 878 . 1 1 1 A 77 77 GLY CA C 77 45.505 47.278 -1.773 1
1 879 . 1 1 1 A 77 77 GLY N N 77 111.937 115.919 -3.982 1
1 880 . 1 1 1 A 78 78 THR H H 78 8.332 7.884 0.448 1
1 881 . 1 1 1 A 78 78 THR HA H 78 3.900 4.216 -0.316 1
1 886 . 1 1 1 A 78 78 THR C C 78 173.591 174.776 -1.185 1
1 887 . 1 1 1 A 78 78 THR CA C 78 63.653 63.447 0.206 1
1 888 . 1 1 1 A 78 78 THR CB C 78 69.649 69.239 0.410 1
1 890 . 1 1 1 A 78 78 THR N N 78 120.765 116.855 3.910 1
1 891 . 1 1 1 A 79 79 GLY H H 79 8.038 8.560 -0.522 1
1 892 . 1 1 1 A 79 79 GLY HA2 H 79 4.748 4.426 0.322 1
1 893 . 1 1 1 A 79 79 GLY HA3 H 79 3.546 4.560 -1.014 1
1 894 . 1 1 1 A 79 79 GLY C C 79 172.580 172.307 0.273 1
1 895 . 1 1 1 A 79 79 GLY CA C 79 44.661 44.418 0.243 1
1 896 . 1 1 1 A 79 79 GLY N N 79 109.887 113.701 -3.814 1
1 897 . 1 1 1 A 80 80 PHE H H 80 9.064 8.910 0.154 1
1 898 . 1 1 1 A 80 80 PHE HA H 80 4.886 5.007 -0.121 1
1 906 . 1 1 1 A 80 80 PHE C C 80 176.507 176.020 0.487 1
1 907 . 1 1 1 A 80 80 PHE CA C 80 57.257 56.749 0.508 1
1 908 . 1 1 1 A 80 80 PHE CB C 80 44.655 42.466 2.189 1
1 914 . 1 1 1 A 80 80 PHE N N 80 116.862 119.308 -2.446 1
1 915 . 1 1 1 A 81 81 SER H H 81 9.413 9.025 0.388 1
1 916 . 1 1 1 A 81 81 SER HA H 81 4.622 4.390 0.232 1
1 919 . 1 1 1 A 81 81 SER C C 81 173.735 173.985 -0.250 1
1 920 . 1 1 1 A 81 81 SER CA C 81 61.410 61.037 0.373 1
1 921 . 1 1 1 A 81 81 SER CB C 81 64.165 63.311 0.854 1
1 922 . 1 1 1 A 81 81 SER N N 81 116.467 117.284 -0.817 1
1 923 . 1 1 1 A 82 82 ASN H H 82 7.688 8.183 -0.495 1
1 924 . 1 1 1 A 82 82 ASN HA H 82 4.952 5.295 -0.343 1
1 929 . 1 1 1 A 82 82 ASN C C 82 173.303 175.549 -2.246 1
1 930 . 1 1 1 A 82 82 ASN CA C 82 52.086 52.294 -0.208 1
1 931 . 1 1 1 A 82 82 ASN CB C 82 41.258 40.784 0.474 1
1 932 . 1 1 1 A 82 82 ASN N N 82 113.355 115.963 -2.608 1
1 934 . 1 1 1 A 83 83 ILE H H 83 8.858 8.753 0.105 1
1 935 . 1 1 1 A 83 83 ILE HA H 83 3.571 3.726 -0.155 1
1 945 . 1 1 1 A 83 83 ILE CA C 83 66.416 65.362 1.054 1
1 946 . 1 1 1 A 83 83 ILE CB C 83 35.074 34.611 0.463 1
1 950 . 1 1 1 A 83 83 ILE N N 83 118.908 122.751 -3.843 1
1 951 . 1 1 1 A 84 84 PRO HA H 84 4.411 4.725 -0.314 1
1 958 . 1 1 1 A 84 84 PRO C C 84 177.616 179.314 -1.698 1
1 959 . 1 1 1 A 84 84 PRO CA C 84 67.525 66.371 1.154 1
1 960 . 1 1 1 A 84 84 PRO CB C 84 31.029 30.798 0.231 1
1 963 . 1 1 1 A 85 85 GLN H H 85 8.405 8.390 0.015 1
1 964 . 1 1 1 A 85 85 GLN HA H 85 3.874 4.098 -0.224 1
1 971 . 1 1 1 A 85 85 GLN C C 85 178.213 178.367 -0.154 1
1 972 . 1 1 1 A 85 85 GLN CA C 85 59.495 58.584 0.911 1
1 973 . 1 1 1 A 85 85 GLN CB C 85 29.270 28.190 1.080 1
1 975 . 1 1 1 A 85 85 GLN N N 85 115.597 117.555 -1.958 1
1 977 . 1 1 1 A 86 86 LEU H H 86 7.136 8.222 -1.086 1
1 978 . 1 1 1 A 86 86 LEU HA H 86 3.589 3.311 0.278 1
1 988 . 1 1 1 A 86 86 LEU C C 86 177.728 178.197 -0.469 1
1 989 . 1 1 1 A 86 86 LEU CA C 86 58.136 58.205 -0.069 1
1 990 . 1 1 1 A 86 86 LEU CB C 86 42.290 41.689 0.601 1
1 994 . 1 1 1 A 86 86 LEU N N 86 121.840 122.028 -0.188 1
1 995 . 1 1 1 A 87 87 ILE H H 87 8.323 8.141 0.182 1
1 996 . 1 1 1 A 87 87 ILE HA H 87 3.415 3.314 0.101 1
1 1006 . 1 1 1 A 87 87 ILE C C 87 178.064 177.911 0.153 1
1 1007 . 1 1 1 A 87 87 ILE CA C 87 61.458 65.150 -3.692 1
1 1008 . 1 1 1 A 87 87 ILE CB C 87 34.561 37.463 -2.902 1
1 1012 . 1 1 1 A 87 87 ILE N N 87 118.117 119.480 -1.363 1
1 1013 . 1 1 1 A 88 88 ASP H H 88 8.805 8.074 0.731 1
1 1014 . 1 1 1 A 88 88 ASP HA H 88 4.548 4.315 0.233 1
1 1017 . 1 1 1 A 88 88 ASP C C 88 179.265 178.312 0.953 1
1 1018 . 1 1 1 A 88 88 ASP CA C 88 58.099 57.404 0.695 1
1 1019 . 1 1 1 A 88 88 ASP CB C 88 42.166 41.948 0.218 1
1 1020 . 1 1 1 A 88 88 ASP N N 88 119.143 120.327 -1.184 1
1 1021 . 1 1 1 A 89 89 HIS H H 89 8.113 7.886 0.227 1
1 1022 . 1 1 1 A 89 89 HIS HA H 89 4.225 4.403 -0.178 1
1 1026 . 1 1 1 A 89 89 HIS C C 89 179.261 176.997 2.264 1
1 1027 . 1 1 1 A 89 89 HIS CA C 89 60.647 59.083 1.564 1
1 1028 . 1 1 1 A 89 89 HIS CB C 89 30.801 29.793 1.008 1
1 1030 . 1 1 1 A 89 89 HIS N N 89 119.595 119.235 0.360 1
1 1031 . 1 1 1 A 90 90 HIS H H 90 7.685 7.982 -0.297 1
1 1032 . 1 1 1 A 90 90 HIS HA H 90 3.628 4.003 -0.375 1
1 1036 . 1 1 1 A 90 90 HIS C C 90 178.454 176.543 1.911 1
1 1037 . 1 1 1 A 90 90 HIS CA C 90 61.797 59.391 2.406 1
1 1038 . 1 1 1 A 90 90 HIS CB C 90 28.165 29.288 -1.123 1
1 1040 . 1 1 1 A 90 90 HIS N N 90 120.061 118.402 1.659 1
1 1041 . 1 1 1 A 91 91 TYR H H 91 9.394 8.359 1.035 1
1 1042 . 1 1 1 A 91 91 TYR HA H 91 4.238 3.962 0.276 1
1 1049 . 1 1 1 A 91 91 TYR C C 91 176.443 177.774 -1.331 1
1 1050 . 1 1 1 A 91 91 TYR CA C 91 60.669 61.540 -0.871 1
1 1051 . 1 1 1 A 91 91 TYR CB C 91 39.169 38.899 0.270 1
1 1056 . 1 1 1 A 91 91 TYR N N 91 123.532 120.016 3.516 1
1 1057 . 1 1 1 A 92 92 THR H H 92 8.774 8.248 0.526 1
1 1058 . 1 1 1 A 92 92 THR HA H 92 3.866 3.858 0.008 1
1 1063 . 1 1 1 A 92 92 THR C C 92 177.050 175.595 1.455 1
1 1064 . 1 1 1 A 92 92 THR CA C 92 65.240 64.971 0.269 1
1 1065 . 1 1 1 A 92 92 THR CB C 92 69.298 68.688 0.610 1
1 1067 . 1 1 1 A 92 92 THR N N 92 112.000 112.360 -0.360 1
1 1068 . 1 1 1 A 93 93 THR H H 93 7.617 7.261 0.356 1
1 1069 . 1 1 1 A 93 93 THR HA H 93 4.133 4.163 -0.030 1
1 1074 . 1 1 1 A 93 93 THR C C 93 176.234 174.582 1.652 1
1 1075 . 1 1 1 A 93 93 THR CA C 93 63.527 61.747 1.780 1
1 1076 . 1 1 1 A 93 93 THR CB C 93 71.234 69.550 1.684 1
1 1078 . 1 1 1 A 93 93 THR N N 93 109.883 111.826 -1.943 1
1 1079 . 1 1 1 A 94 94 LYS H H 94 7.210 7.585 -0.375 1
1 1080 . 1 1 1 A 94 94 LYS HA H 94 3.830 3.666 0.164 1
1 1089 . 1 1 1 A 94 94 LYS C C 94 174.331 175.891 -1.560 1
1 1090 . 1 1 1 A 94 94 LYS CA C 94 56.776 57.224 -0.448 1
1 1091 . 1 1 1 A 94 94 LYS CB C 94 28.095 30.310 -2.215 1
1 1095 . 1 1 1 A 94 94 LYS N N 94 112.818 120.411 -7.593 1
1 1096 . 1 1 1 A 95 95 GLN H H 95 7.439 7.172 0.267 1
1 1097 . 1 1 1 A 95 95 GLN HA H 95 4.216 4.243 -0.027 1
1 1104 . 1 1 1 A 95 95 GLN C C 95 179.087 175.476 3.611 1
1 1105 . 1 1 1 A 95 95 GLN CA C 95 56.378 55.401 0.977 1
1 1106 . 1 1 1 A 95 95 GLN CB C 95 28.542 29.780 -1.238 1
1 1108 . 1 1 1 A 95 95 GLN N N 95 117.860 118.691 -0.831 1
1 1110 . 1 1 1 A 96 96 VAL H H 96 8.520 8.521 -0.001 1
1 1111 . 1 1 1 A 96 96 VAL HA H 96 4.297 4.422 -0.125 1
1 1119 . 1 1 1 A 96 96 VAL C C 96 177.329 176.854 0.475 1
1 1120 . 1 1 1 A 96 96 VAL CA C 96 61.196 62.119 -0.923 1
1 1121 . 1 1 1 A 96 96 VAL CB C 96 32.735 32.742 -0.007 1
1 1124 . 1 1 1 A 96 96 VAL N N 96 124.208 122.156 2.052 1
1 1125 . 1 1 1 A 97 97 ILE H H 97 8.491 8.732 -0.241 1
1 1126 . 1 1 1 A 97 97 ILE HA H 97 2.995 3.562 -0.567 1
1 1136 . 1 1 1 A 97 97 ILE CA C 97 62.066 64.142 -2.076 1
1 1137 . 1 1 1 A 97 97 ILE CB C 97 36.117 37.836 -1.719 1
1 1141 . 1 1 1 A 97 97 ILE N N 97 119.561 125.694 -6.133 1
1 1142 . 1 1 1 A 98 98 THR HA H 98 4.460 4.594 -0.134 1
1 1147 . 1 1 1 A 98 98 THR C C 98 174.335 174.962 -0.627 1
1 1148 . 1 1 1 A 98 98 THR CA C 98 58.244 59.693 -1.449 1
1 1149 . 1 1 1 A 98 98 THR CB C 98 73.056 71.693 1.363 1
1 1151 . 1 1 1 A 99 99 LYS H H 99 9.761 8.765 0.996 1
1 1152 . 1 1 1 A 99 99 LYS HA H 99 3.911 4.064 -0.153 1
1 1161 . 1 1 1 A 99 99 LYS C C 99 179.594 178.530 1.064 1
1 1162 . 1 1 1 A 99 99 LYS CA C 99 59.661 58.596 1.065 1
1 1163 . 1 1 1 A 99 99 LYS CB C 99 31.978 32.076 -0.098 1
1 1167 . 1 1 1 A 99 99 LYS N N 99 125.750 122.600 3.150 1
1 1168 . 1 1 1 A 100 100 LYS H H 100 8.910 7.603 1.307 1
1 1169 . 1 1 1 A 100 100 LYS HA H 100 4.024 4.058 -0.034 1
1 1178 . 1 1 1 A 100 100 LYS C C 100 178.060 177.610 0.450 1
1 1179 . 1 1 1 A 100 100 LYS CA C 100 58.642 59.134 -0.492 1
1 1180 . 1 1 1 A 100 100 LYS CB C 100 32.750 32.333 0.417 1
1 1184 . 1 1 1 A 100 100 LYS N N 100 117.112 119.400 -2.288 1
1 1185 . 1 1 1 A 101 101 SER H H 101 7.721 7.541 0.180 1
1 1186 . 1 1 1 A 101 101 SER HA H 101 4.282 4.569 -0.287 1
1 1189 . 1 1 1 A 101 101 SER C C 101 176.403 174.941 1.462 1
1 1190 . 1 1 1 A 101 101 SER CA C 101 60.442 59.008 1.434 1
1 1191 . 1 1 1 A 101 101 SER CB C 101 63.775 64.567 -0.792 1
1 1192 . 1 1 1 A 101 101 SER N N 101 112.069 111.302 0.767 1
1 1193 . 1 1 1 A 102 102 GLY H H 102 8.038 8.473 -0.435 1
1 1194 . 1 1 1 A 102 102 GLY HA2 H 102 4.024 3.943 0.081 1
1 1195 . 1 1 1 A 102 102 GLY HA3 H 102 3.713 3.964 -0.251 1
1 1196 . 1 1 1 A 102 102 GLY C C 102 173.991 174.445 -0.454 1
1 1197 . 1 1 1 A 102 102 GLY CA C 102 46.458 46.763 -0.305 1
1 1198 . 1 1 1 A 102 102 GLY N N 102 111.144 108.954 2.190 1
1 1199 . 1 1 1 A 103 103 VAL H H 103 7.155 7.653 -0.498 1
1 1200 . 1 1 1 A 103 103 VAL HA H 103 3.652 4.365 -0.713 1
1 1208 . 1 1 1 A 103 103 VAL C C 103 173.805 175.009 -1.204 1
1 1209 . 1 1 1 A 103 103 VAL CA C 103 64.310 61.605 2.705 1
1 1210 . 1 1 1 A 103 103 VAL CB C 103 32.254 33.405 -1.151 1
1 1213 . 1 1 1 A 103 103 VAL N N 103 119.836 119.604 0.232 1
1 1214 . 1 1 1 A 104 104 VAL H H 104 7.653 9.001 -1.348 1
1 1215 . 1 1 1 A 104 104 VAL HA H 104 4.048 4.626 -0.578 1
1 1223 . 1 1 1 A 104 104 VAL C C 104 175.708 174.082 1.626 1
1 1224 . 1 1 1 A 104 104 VAL CA C 104 60.275 60.612 -0.337 1
1 1225 . 1 1 1 A 104 104 VAL CB C 104 35.112 34.550 0.562 1
1 1228 . 1 1 1 A 104 104 VAL N N 104 125.859 127.407 -1.548 1
1 1229 . 1 1 1 A 105 105 LEU H H 105 8.616 8.379 0.237 1
1 1230 . 1 1 1 A 105 105 LEU HA H 105 3.905 4.873 -0.968 1
1 1240 . 1 1 1 A 105 105 LEU C C 105 175.380 175.873 -0.493 1
1 1241 . 1 1 1 A 105 105 LEU CA C 105 54.471 53.436 1.035 1
1 1242 . 1 1 1 A 105 105 LEU CB C 105 39.821 42.118 -2.297 1
1 1246 . 1 1 1 A 105 105 LEU N N 105 123.839 125.880 -2.041 1
1 1247 . 1 1 1 A 106 106 LEU H H 106 8.894 8.698 0.196 1
1 1248 . 1 1 1 A 106 106 LEU HA H 106 4.839 5.234 -0.395 1
1 1258 . 1 1 1 A 106 106 LEU C C 106 176.930 176.394 0.536 1
1 1259 . 1 1 1 A 106 106 LEU CA C 106 56.288 53.235 3.053 1
1 1260 . 1 1 1 A 106 106 LEU CB C 106 45.237 45.561 -0.324 1
1 1264 . 1 1 1 A 106 106 LEU N N 106 120.590 121.092 -0.502 1
1 1265 . 1 1 1 A 107 107 ASN H H 107 8.124 9.020 -0.896 1
1 1266 . 1 1 1 A 107 107 ASN HA H 107 5.650 4.582 1.068 1
1 1271 . 1 1 1 A 107 107 ASN CA C 107 50.293 53.854 -3.561 1
1 1272 . 1 1 1 A 107 107 ASN CB C 107 41.223 36.171 5.052 1
1 1273 . 1 1 1 A 107 107 ASN N N 107 116.866 117.810 -0.944 1
1 1275 . 1 1 1 A 108 108 PRO HA H 108 2.926 3.800 -0.874 1
1 1282 . 1 1 1 A 108 108 PRO C C 108 176.671 175.741 0.930 1
1 1283 . 1 1 1 A 108 108 PRO CA C 108 60.804 62.265 -1.461 1
1 1284 . 1 1 1 A 108 108 PRO CB C 108 31.774 31.993 -0.219 1
1 1287 . 1 1 1 A 109 109 ILE H H 109 8.648 7.679 0.969 1
1 1288 . 1 1 1 A 109 109 ILE HA H 109 4.519 4.521 -0.002 1
1 1298 . 1 1 1 A 109 109 ILE CA C 109 55.070 58.258 -3.188 1
1 1299 . 1 1 1 A 109 109 ILE CB C 109 36.068 38.414 -2.346 1
1 1303 . 1 1 1 A 109 109 ILE N N 109 128.817 122.983 5.834 1
1 1304 . 1 1 1 A 110 110 PRO HA H 110 4.587 4.556 0.031 1
1 1311 . 1 1 1 A 110 110 PRO C C 110 177.013 176.150 0.863 1
1 1312 . 1 1 1 A 110 110 PRO CA C 110 61.850 62.283 -0.433 1
1 1313 . 1 1 1 A 110 110 PRO CB C 110 32.507 32.564 -0.057 1
1 1316 . 1 1 1 A 111 111 LYS H H 111 8.038 8.185 -0.147 1
1 1317 . 1 1 1 A 111 111 LYS HA H 111 3.553 4.601 -1.048 1
1 1326 . 1 1 1 A 111 111 LYS C C 111 176.123 174.443 1.680 1
1 1327 . 1 1 1 A 111 111 LYS CA C 111 56.220 53.852 2.368 1
1 1328 . 1 1 1 A 111 111 LYS CB C 111 32.373 35.422 -3.049 1
1 1332 . 1 1 1 A 111 111 LYS N N 111 120.147 116.746 3.401 1
1 1333 . 1 1 1 A 112 112 ASP H H 112 8.463 8.472 -0.009 1
1 1334 . 1 1 1 A 112 112 ASP HA H 112 4.523 4.903 -0.380 1
1 1337 . 1 1 1 A 112 112 ASP C C 112 175.986 176.629 -0.643 1
1 1338 . 1 1 1 A 112 112 ASP CA C 112 54.256 53.675 0.581 1
1 1339 . 1 1 1 A 112 112 ASP CB C 112 41.563 42.295 -0.732 1
1 1340 . 1 1 1 A 112 112 ASP N N 112 121.863 122.953 -1.090 1
1 1341 . 1 1 1 A 113 113 LYS H H 113 8.059 8.486 -0.427 1
1 1342 . 1 1 1 A 113 113 LYS HA H 113 4.136 4.375 -0.239 1
1 1351 . 1 1 1 A 113 113 LYS C C 113 176.010 176.093 -0.083 1
1 1352 . 1 1 1 A 113 113 LYS CA C 113 56.253 56.035 0.218 1
1 1353 . 1 1 1 A 113 113 LYS CB C 113 32.754 31.543 1.211 1
1 1357 . 1 1 1 A 113 113 LYS N N 113 121.725 122.023 -0.298 1
1 1358 . 1 1 1 A 114 114 LYS H H 114 8.225 7.923 0.302 1
1 1359 . 1 1 1 A 114 114 LYS HA H 114 4.169 4.356 -0.187 1
1 1368 . 1 1 1 A 114 114 LYS C C 114 176.198 176.822 -0.624 1
1 1369 . 1 1 1 A 114 114 LYS CA C 114 56.413 55.922 0.491 1
1 1370 . 1 1 1 A 114 114 LYS CB C 114 32.725 31.766 0.959 1
1 1374 . 1 1 1 A 114 114 LYS N N 114 121.857 122.495 -0.638 1
1 1375 . 1 1 1 A 115 115 TRP H H 115 8.078 8.013 0.065 1
1 1376 . 1 1 1 A 115 115 TRP HA H 115 4.709 4.497 0.212 1
1 1385 . 1 1 1 A 115 115 TRP C C 115 175.119 177.889 -2.770 1
1 1386 . 1 1 1 A 115 115 TRP CA C 115 56.856 59.655 -2.799 1
1 1387 . 1 1 1 A 115 115 TRP CB C 115 29.474 28.368 1.106 1
1 1393 . 1 1 1 A 115 115 TRP N N 115 122.068 125.663 -3.595 1
1 1 . 2 1 1 A 10 10 HIS HA H 10 4.616 4.838 -0.222 1
1 4 . 2 1 1 A 10 10 HIS C C 10 174.981 174.006 0.975 1
1 5 . 2 1 1 A 10 10 HIS CA C 10 56.555 54.751 1.804 1
1 6 . 2 1 1 A 10 10 HIS CB C 10 30.231 32.056 -1.825 1
1 7 . 2 1 1 A 11 11 MET H H 11 8.103 8.744 -0.641 1
1 8 . 2 1 1 A 11 11 MET HA H 11 4.439 4.838 -0.399 1
1 13 . 2 1 1 A 11 11 MET C C 11 175.888 176.314 -0.426 1
1 14 . 2 1 1 A 11 11 MET CA C 11 55.090 54.246 0.844 1
1 15 . 2 1 1 A 11 11 MET CB C 11 33.121 34.854 -1.733 1
1 17 . 2 1 1 A 11 11 MET N N 11 120.743 120.227 0.516 1
1 18 . 2 1 1 A 12 12 LYS H H 12 8.065 8.550 -0.485 1
1 19 . 2 1 1 A 12 12 LYS HA H 12 4.407 4.579 -0.172 1
1 28 . 2 1 1 A 12 12 LYS CA C 12 54.894 54.736 0.158 1
1 29 . 2 1 1 A 12 12 LYS CB C 12 31.863 31.663 0.200 1
1 33 . 2 1 1 A 12 12 LYS N N 12 123.187 125.586 -2.399 1
1 34 . 2 1 1 A 13 13 PRO HA H 13 4.347 4.510 -0.163 1
1 41 . 2 1 1 A 13 13 PRO C C 13 176.891 177.401 -0.510 1
1 42 . 2 1 1 A 13 13 PRO CA C 13 62.542 62.237 0.305 1
1 43 . 2 1 1 A 13 13 PRO CB C 13 32.663 32.735 -0.072 1
1 46 . 2 1 1 A 14 14 LEU H H 14 8.339 8.771 -0.432 1
1 47 . 2 1 1 A 14 14 LEU HA H 14 3.373 3.842 -0.469 1
1 57 . 2 1 1 A 14 14 LEU C C 14 176.683 178.259 -1.576 1
1 58 . 2 1 1 A 14 14 LEU CA C 14 58.555 57.660 0.895 1
1 59 . 2 1 1 A 14 14 LEU CB C 14 41.828 41.169 0.659 1
1 63 . 2 1 1 A 14 14 LEU N N 14 123.191 123.618 -0.427 1
1 64 . 2 1 1 A 15 15 ALA H H 15 8.175 8.366 -0.191 1
1 65 . 2 1 1 A 15 15 ALA HA H 15 3.983 4.021 -0.038 1
1 69 . 2 1 1 A 15 15 ALA C C 15 178.697 179.776 -1.079 1
1 70 . 2 1 1 A 15 15 ALA CA C 15 54.164 55.294 -1.130 1
1 71 . 2 1 1 A 15 15 ALA CB C 15 18.771 18.373 0.398 1
1 72 . 2 1 1 A 15 15 ALA N N 15 113.594 120.266 -6.672 1
1 73 . 2 1 1 A 16 16 GLU H H 16 7.458 7.525 -0.067 1
1 74 . 2 1 1 A 16 16 GLU HA H 16 4.266 4.240 0.026 1
1 79 . 2 1 1 A 16 16 GLU C C 16 176.510 177.349 -0.839 1
1 80 . 2 1 1 A 16 16 GLU CA C 16 55.196 58.228 -3.032 1
1 81 . 2 1 1 A 16 16 GLU CB C 16 30.907 29.964 0.943 1
1 83 . 2 1 1 A 16 16 GLU N N 16 113.348 116.123 -2.775 1
1 84 . 2 1 1 A 17 17 GLN H H 17 7.501 6.916 0.585 1
1 85 . 2 1 1 A 17 17 GLN HA H 17 3.683 4.068 -0.385 1
1 92 . 2 1 1 A 17 17 GLN C C 17 178.053 176.655 1.398 1
1 93 . 2 1 1 A 17 17 GLN CA C 17 54.606 55.746 -1.140 1
1 94 . 2 1 1 A 17 17 GLN CB C 17 25.758 28.409 -2.651 1
1 96 . 2 1 1 A 17 17 GLN N N 17 119.411 118.969 0.442 1
1 98 . 2 1 1 A 18 18 ASP H H 18 8.949 8.745 0.204 1
1 99 . 2 1 1 A 18 18 ASP HA H 18 4.184 4.124 0.060 1
1 102 . 2 1 1 A 18 18 ASP C C 18 175.263 178.016 -2.753 1
1 103 . 2 1 1 A 18 18 ASP CA C 18 57.275 56.718 0.557 1
1 104 . 2 1 1 A 18 18 ASP CB C 18 40.620 39.751 0.869 1
1 105 . 2 1 1 A 18 18 ASP N N 18 124.676 123.862 0.814 1
1 106 . 2 1 1 A 19 19 TRP H H 19 6.068 7.526 -1.458 1
1 107 . 2 1 1 A 19 19 TRP HA H 19 5.045 4.982 0.063 1
1 116 . 2 1 1 A 19 19 TRP C C 19 175.902 176.371 -0.469 1
1 117 . 2 1 1 A 19 19 TRP CA C 19 53.542 58.236 -4.694 1
1 118 . 2 1 1 A 19 19 TRP CB C 19 29.179 28.333 0.846 1
1 124 . 2 1 1 A 19 19 TRP N N 19 107.757 117.283 -9.526 1
1 126 . 2 1 1 A 20 20 TYR H H 20 7.430 7.176 0.254 1
1 127 . 2 1 1 A 20 20 TYR HA H 20 5.601 5.070 0.531 1
1 132 . 2 1 1 A 20 20 TYR C C 20 175.498 175.876 -0.378 1
1 133 . 2 1 1 A 20 20 TYR CA C 20 56.967 56.843 0.124 1
1 134 . 2 1 1 A 20 20 TYR CB C 20 39.083 38.543 0.540 1
1 137 . 2 1 1 A 20 20 TYR N N 20 123.173 121.922 1.251 1
1 138 . 2 1 1 A 21 21 HIS H H 21 8.934 8.233 0.701 1
1 139 . 2 1 1 A 21 21 HIS HA H 21 4.295 4.466 -0.171 1
1 144 . 2 1 1 A 21 21 HIS C C 21 175.177 174.687 0.490 1
1 145 . 2 1 1 A 21 21 HIS CA C 21 56.572 55.842 0.730 1
1 146 . 2 1 1 A 21 21 HIS CB C 21 33.365 30.106 3.259 1
1 149 . 2 1 1 A 21 21 HIS N N 21 125.732 127.163 -1.431 1
1 150 . 2 1 1 A 22 22 GLY H H 22 5.280 6.923 -1.643 1
1 151 . 2 1 1 A 22 22 GLY HA2 H 22 3.905 3.430 0.475 1
1 152 . 2 1 1 A 22 22 GLY HA3 H 22 3.585 3.653 -0.068 1
1 153 . 2 1 1 A 22 22 GLY C C 22 174.411 174.078 0.333 1
1 154 . 2 1 1 A 22 22 GLY CA C 22 46.402 46.383 0.019 1
1 155 . 2 1 1 A 22 22 GLY N N 22 104.568 108.440 -3.872 1
1 156 . 2 1 1 A 23 23 ALA H H 23 8.768 7.947 0.821 1
1 157 . 2 1 1 A 23 23 ALA HA H 23 5.171 3.880 1.291 1
1 161 . 2 1 1 A 23 23 ALA C C 23 177.180 176.342 0.838 1
1 162 . 2 1 1 A 23 23 ALA CA C 23 51.153 52.634 -1.481 1
1 163 . 2 1 1 A 23 23 ALA CB C 23 16.999 17.236 -0.237 1
1 164 . 2 1 1 A 23 23 ALA N N 23 130.297 115.495 14.802 1
1 165 . 2 1 1 A 24 24 ILE H H 24 7.267 7.896 -0.629 1
1 166 . 2 1 1 A 24 24 ILE HA H 24 4.460 4.799 -0.339 1
1 176 . 2 1 1 A 24 24 ILE CA C 24 58.529 58.098 0.431 1
1 177 . 2 1 1 A 24 24 ILE CB C 24 38.763 39.059 -0.296 1
1 181 . 2 1 1 A 24 24 ILE N N 24 118.903 113.239 5.664 1
1 182 . 2 1 1 A 25 25 PRO HA H 25 4.224 4.611 -0.387 1
1 189 . 2 1 1 A 25 25 PRO C C 25 176.918 177.493 -0.575 1
1 190 . 2 1 1 A 25 25 PRO CA C 25 62.907 62.478 0.429 1
1 191 . 2 1 1 A 25 25 PRO CB C 25 32.671 32.664 0.007 1
1 194 . 2 1 1 A 26 26 ARG H H 26 8.781 9.090 -0.309 1
1 195 . 2 1 1 A 26 26 ARG HA H 26 3.472 3.909 -0.437 1
1 202 . 2 1 1 A 26 26 ARG C C 26 178.112 177.922 0.190 1
1 203 . 2 1 1 A 26 26 ARG CA C 26 60.863 59.472 1.391 1
1 204 . 2 1 1 A 26 26 ARG CB C 26 30.314 29.758 0.556 1
1 207 . 2 1 1 A 26 26 ARG N N 26 124.635 121.561 3.074 1
1 208 . 2 1 1 A 27 27 ILE H H 27 8.540 8.139 0.401 1
1 209 . 2 1 1 A 27 27 ILE HA H 27 3.787 3.665 0.122 1
1 219 . 2 1 1 A 27 27 ILE C C 27 177.390 177.575 -0.185 1
1 220 . 2 1 1 A 27 27 ILE CA C 27 64.329 64.775 -0.446 1
1 221 . 2 1 1 A 27 27 ILE CB C 27 37.413 37.962 -0.549 1
1 225 . 2 1 1 A 27 27 ILE N N 27 115.859 120.213 -4.354 1
1 226 . 2 1 1 A 28 28 GLU H H 28 6.953 8.272 -1.319 1
1 227 . 2 1 1 A 28 28 GLU HA H 28 4.067 4.017 0.050 1
1 232 . 2 1 1 A 28 28 GLU C C 28 179.006 179.380 -0.374 1
1 233 . 2 1 1 A 28 28 GLU CA C 28 58.985 59.499 -0.514 1
1 234 . 2 1 1 A 28 28 GLU CB C 28 29.316 29.230 0.086 1
1 236 . 2 1 1 A 28 28 GLU N N 28 120.554 119.213 1.341 1
1 237 . 2 1 1 A 29 29 ALA H H 29 7.999 8.086 -0.087 1
1 238 . 2 1 1 A 29 29 ALA HA H 29 3.822 4.005 -0.183 1
1 242 . 2 1 1 A 29 29 ALA C C 29 178.809 179.887 -1.078 1
1 243 . 2 1 1 A 29 29 ALA CA C 29 54.698 54.788 -0.090 1
1 244 . 2 1 1 A 29 29 ALA CB C 29 18.059 18.432 -0.373 1
1 245 . 2 1 1 A 29 29 ALA N N 29 120.122 122.835 -2.713 1
1 246 . 2 1 1 A 30 30 GLN H H 30 8.168 8.065 0.103 1
1 247 . 2 1 1 A 30 30 GLN HA H 30 3.811 4.216 -0.405 1
1 254 . 2 1 1 A 30 30 GLN C C 30 177.578 178.213 -0.635 1
1 255 . 2 1 1 A 30 30 GLN CA C 30 59.731 58.618 1.113 1
1 256 . 2 1 1 A 30 30 GLN CB C 30 28.161 28.943 -0.782 1
1 258 . 2 1 1 A 30 30 GLN N N 30 112.109 115.862 -3.753 1
1 260 . 2 1 1 A 31 31 GLU H H 31 7.248 8.203 -0.955 1
1 261 . 2 1 1 A 31 31 GLU HA H 31 4.063 4.088 -0.025 1
1 266 . 2 1 1 A 31 31 GLU C C 31 177.423 179.558 -2.135 1
1 267 . 2 1 1 A 31 31 GLU CA C 31 57.650 59.056 -1.406 1
1 268 . 2 1 1 A 31 31 GLU CB C 31 29.757 29.369 0.388 1
1 270 . 2 1 1 A 31 31 GLU N N 31 115.340 119.770 -4.430 1
1 271 . 2 1 1 A 32 32 LEU H H 32 7.169 7.771 -0.602 1
1 272 . 2 1 1 A 32 32 LEU HA H 32 4.087 4.055 0.032 1
1 282 . 2 1 1 A 32 32 LEU C C 32 175.850 177.174 -1.324 1
1 283 . 2 1 1 A 32 32 LEU CA C 32 55.580 57.450 -1.870 1
1 284 . 2 1 1 A 32 32 LEU CB C 32 42.910 41.195 1.715 1
1 288 . 2 1 1 A 32 32 LEU N N 32 116.367 116.960 -0.593 1
1 289 . 2 1 1 A 33 33 LEU H H 33 7.062 7.685 -0.623 1
1 290 . 2 1 1 A 33 33 LEU HA H 33 4.431 4.337 0.094 1
1 300 . 2 1 1 A 33 33 LEU C C 33 174.837 177.200 -2.363 1
1 301 . 2 1 1 A 33 33 LEU CA C 33 53.521 54.873 -1.352 1
1 302 . 2 1 1 A 33 33 LEU CB C 33 43.301 40.946 2.355 1
1 306 . 2 1 1 A 33 33 LEU N N 33 118.568 122.284 -3.716 1
1 307 . 2 1 1 A 34 34 LYS H H 34 8.749 8.643 0.106 1
1 308 . 2 1 1 A 34 34 LYS HA H 34 4.162 4.492 -0.330 1
1 317 . 2 1 1 A 34 34 LYS C C 34 174.378 175.067 -0.689 1
1 318 . 2 1 1 A 34 34 LYS CA C 34 56.575 55.669 0.906 1
1 319 . 2 1 1 A 34 34 LYS CB C 34 36.918 33.849 3.069 1
1 323 . 2 1 1 A 34 34 LYS N N 34 121.659 118.201 3.458 1
1 324 . 2 1 1 A 35 35 LYS H H 35 8.137 7.218 0.919 1
1 325 . 2 1 1 A 35 35 LYS HA H 35 4.011 4.437 -0.426 1
1 334 . 2 1 1 A 35 35 LYS C C 35 174.343 174.383 -0.040 1
1 335 . 2 1 1 A 35 35 LYS CA C 35 53.960 54.340 -0.380 1
1 336 . 2 1 1 A 35 35 LYS CB C 35 35.587 35.493 0.094 1
1 340 . 2 1 1 A 35 35 LYS N N 35 119.354 116.104 3.250 1
1 341 . 2 1 1 A 36 36 GLN H H 36 8.394 8.543 -0.149 1
1 342 . 2 1 1 A 36 36 GLN HA H 36 4.187 4.250 -0.063 1
1 349 . 2 1 1 A 36 36 GLN C C 36 177.012 176.667 0.345 1
1 350 . 2 1 1 A 36 36 GLN CA C 36 57.750 57.759 -0.009 1
1 351 . 2 1 1 A 36 36 GLN CB C 36 28.433 28.416 0.017 1
1 353 . 2 1 1 A 36 36 GLN N N 36 120.248 122.381 -2.133 1
1 355 . 2 1 1 A 37 37 GLY H H 37 9.597 8.884 0.713 1
1 356 . 2 1 1 A 37 37 GLY HA2 H 37 4.486 4.122 0.364 1
1 357 . 2 1 1 A 37 37 GLY HA3 H 37 3.926 4.134 -0.208 1
1 358 . 2 1 1 A 37 37 GLY C C 37 176.285 174.185 2.100 1
1 359 . 2 1 1 A 37 37 GLY CA C 37 46.146 45.155 0.991 1
1 360 . 2 1 1 A 37 37 GLY N N 37 116.637 114.899 1.738 1
1 361 . 2 1 1 A 38 38 ASP H H 38 8.925 7.933 0.992 1
1 362 . 2 1 1 A 38 38 ASP HA H 38 5.697 4.663 1.034 1
1 365 . 2 1 1 A 38 38 ASP C C 38 176.181 175.786 0.395 1
1 366 . 2 1 1 A 38 38 ASP CA C 38 55.066 55.543 -0.477 1
1 367 . 2 1 1 A 38 38 ASP CB C 38 42.933 41.296 1.637 1
1 368 . 2 1 1 A 38 38 ASP N N 38 127.293 122.148 5.145 1
1 369 . 2 1 1 A 39 39 PHE H H 39 8.647 8.445 0.202 1
1 370 . 2 1 1 A 39 39 PHE HA H 39 6.025 5.856 0.169 1
1 378 . 2 1 1 A 39 39 PHE C C 39 170.948 172.881 -1.933 1
1 379 . 2 1 1 A 39 39 PHE CA C 39 56.376 56.127 0.249 1
1 380 . 2 1 1 A 39 39 PHE CB C 39 44.583 42.887 1.696 1
1 386 . 2 1 1 A 39 39 PHE N N 39 117.102 119.239 -2.137 1
1 387 . 2 1 1 A 40 40 LEU H H 40 9.186 9.042 0.144 1
1 388 . 2 1 1 A 40 40 LEU HA H 40 4.983 5.067 -0.084 1
1 398 . 2 1 1 A 40 40 LEU C C 40 174.787 174.682 0.105 1
1 399 . 2 1 1 A 40 40 LEU CA C 40 54.610 54.211 0.399 1
1 400 . 2 1 1 A 40 40 LEU CB C 40 44.330 45.473 -1.143 1
1 404 . 2 1 1 A 40 40 LEU N N 40 114.388 116.525 -2.137 1
1 405 . 2 1 1 A 41 41 VAL H H 41 9.390 8.965 0.425 1
1 406 . 2 1 1 A 41 41 VAL HA H 41 5.742 5.205 0.537 1
1 414 . 2 1 1 A 41 41 VAL C C 41 172.760 175.380 -2.620 1
1 415 . 2 1 1 A 41 41 VAL CA C 41 60.814 61.374 -0.560 1
1 416 . 2 1 1 A 41 41 VAL CB C 41 34.908 34.145 0.763 1
1 419 . 2 1 1 A 41 41 VAL N N 41 119.873 120.256 -0.383 1
1 420 . 2 1 1 A 42 42 ARG H H 42 9.598 9.428 0.170 1
1 421 . 2 1 1 A 42 42 ARG HA H 42 5.247 5.046 0.201 1
1 429 . 2 1 1 A 42 42 ARG C C 42 173.379 174.700 -1.321 1
1 430 . 2 1 1 A 42 42 ARG CA C 42 53.202 54.666 -1.464 1
1 431 . 2 1 1 A 42 42 ARG CB C 42 33.507 33.352 0.155 1
1 434 . 2 1 1 A 42 42 ARG N N 42 124.179 124.945 -0.766 1
1 436 . 2 1 1 A 43 43 GLU H H 43 8.234 8.471 -0.237 1
1 437 . 2 1 1 A 43 43 GLU HA H 43 4.890 4.275 0.615 1
1 442 . 2 1 1 A 43 43 GLU C C 43 176.929 176.237 0.692 1
1 443 . 2 1 1 A 43 43 GLU CA C 43 54.846 56.247 -1.401 1
1 444 . 2 1 1 A 43 43 GLU CB C 43 31.599 30.273 1.326 1
1 446 . 2 1 1 A 43 43 GLU N N 43 124.103 124.762 -0.659 1
1 447 . 2 1 1 A 44 44 SER H H 44 9.033 8.496 0.537 1
1 448 . 2 1 1 A 44 44 SER HA H 44 3.957 4.502 -0.545 1
1 451 . 2 1 1 A 44 44 SER C C 44 175.005 174.850 0.155 1
1 452 . 2 1 1 A 44 44 SER CA C 44 59.393 57.780 1.613 1
1 453 . 2 1 1 A 44 44 SER CB C 44 63.619 63.945 -0.326 1
1 454 . 2 1 1 A 44 44 SER N N 44 124.316 120.535 3.781 1
1 455 . 2 1 1 A 45 45 HIS H H 45 8.461 9.002 -0.541 1
1 456 . 2 1 1 A 45 45 HIS HA H 45 4.132 4.445 -0.313 1
1 460 . 2 1 1 A 45 45 HIS C C 45 176.480 178.264 -1.784 1
1 461 . 2 1 1 A 45 45 HIS CA C 45 58.887 59.046 -0.159 1
1 462 . 2 1 1 A 45 45 HIS CB C 45 30.180 30.078 0.102 1
1 464 . 2 1 1 A 45 45 HIS N N 45 127.694 126.787 0.907 1
1 465 . 2 1 1 A 46 46 GLY H H 46 8.513 8.214 0.299 1
1 466 . 2 1 1 A 46 46 GLY HA2 H 46 3.827 3.908 -0.081 1
1 467 . 2 1 1 A 46 46 GLY HA3 H 46 3.827 3.915 -0.088 1
1 468 . 2 1 1 A 46 46 GLY C C 46 173.630 174.486 -0.856 1
1 469 . 2 1 1 A 46 46 GLY CA C 46 45.188 46.849 -1.661 1
1 470 . 2 1 1 A 46 46 GLY N N 46 110.761 107.373 3.388 1
1 471 . 2 1 1 A 47 47 LYS H H 47 7.216 7.652 -0.436 1
1 472 . 2 1 1 A 47 47 LYS HA H 47 4.540 4.736 -0.196 1
1 481 . 2 1 1 A 47 47 LYS CA C 47 53.475 53.210 0.265 1
1 482 . 2 1 1 A 47 47 LYS CB C 47 33.325 33.803 -0.478 1
1 486 . 2 1 1 A 47 47 LYS N N 47 121.356 120.231 1.125 1
1 487 . 2 1 1 A 48 48 PRO HA H 48 4.181 4.217 -0.036 1
1 494 . 2 1 1 A 48 48 PRO C C 48 178.920 177.540 1.380 1
1 495 . 2 1 1 A 48 48 PRO CA C 48 63.239 63.737 -0.498 1
1 496 . 2 1 1 A 48 48 PRO CB C 48 31.523 31.359 0.164 1
1 499 . 2 1 1 A 49 49 GLY H H 49 9.752 8.729 1.023 1
1 500 . 2 1 1 A 49 49 GLY HA2 H 49 4.053 3.902 0.151 1
1 501 . 2 1 1 A 49 49 GLY HA3 H 49 3.374 3.912 -0.538 1
1 502 . 2 1 1 A 49 49 GLY C C 49 172.093 173.920 -1.827 1
1 503 . 2 1 1 A 49 49 GLY CA C 49 45.041 45.060 -0.019 1
1 504 . 2 1 1 A 49 49 GLY N N 49 112.415 112.863 -0.448 1
1 505 . 2 1 1 A 50 50 GLU H H 50 7.623 7.574 0.049 1
1 506 . 2 1 1 A 50 50 GLU HA H 50 4.537 4.836 -0.299 1
1 511 . 2 1 1 A 50 50 GLU C C 50 173.297 174.990 -1.693 1
1 512 . 2 1 1 A 50 50 GLU CA C 50 55.174 55.249 -0.075 1
1 513 . 2 1 1 A 50 50 GLU CB C 50 31.651 31.333 0.318 1
1 515 . 2 1 1 A 50 50 GLU N N 50 121.600 121.373 0.227 1
1 516 . 2 1 1 A 51 51 TYR H H 51 9.452 9.277 0.175 1
1 517 . 2 1 1 A 51 51 TYR HA H 51 5.382 5.133 0.249 1
1 524 . 2 1 1 A 51 51 TYR C C 51 174.387 174.772 -0.385 1
1 525 . 2 1 1 A 51 51 TYR CA C 51 57.592 56.440 1.152 1
1 526 . 2 1 1 A 51 51 TYR CB C 51 41.820 41.347 0.473 1
1 531 . 2 1 1 A 51 51 TYR N N 51 125.790 126.907 -1.117 1
1 532 . 2 1 1 A 52 52 VAL H H 52 9.471 9.654 -0.183 1
1 533 . 2 1 1 A 52 52 VAL HA H 52 4.840 4.789 0.051 1
1 541 . 2 1 1 A 52 52 VAL C C 52 174.947 174.995 -0.048 1
1 542 . 2 1 1 A 52 52 VAL CA C 52 60.991 61.238 -0.247 1
1 543 . 2 1 1 A 52 52 VAL CB C 52 36.829 34.491 2.338 1
1 546 . 2 1 1 A 52 52 VAL N N 52 120.617 122.433 -1.816 1
1 547 . 2 1 1 A 53 53 LEU H H 53 9.457 9.394 0.063 1
1 548 . 2 1 1 A 53 53 LEU HA H 53 5.294 5.185 0.109 1
1 558 . 2 1 1 A 53 53 LEU C C 53 175.024 175.729 -0.705 1
1 559 . 2 1 1 A 53 53 LEU CA C 53 53.904 54.413 -0.509 1
1 560 . 2 1 1 A 53 53 LEU CB C 53 44.756 44.218 0.538 1
1 564 . 2 1 1 A 53 53 LEU N N 53 127.725 131.302 -3.577 1
1 565 . 2 1 1 A 54 54 SER H H 54 9.461 9.518 -0.057 1
1 566 . 2 1 1 A 54 54 SER HA H 54 5.691 5.377 0.314 1
1 569 . 2 1 1 A 54 54 SER C C 54 172.227 173.273 -1.046 1
1 570 . 2 1 1 A 54 54 SER CA C 54 58.551 56.858 1.693 1
1 571 . 2 1 1 A 54 54 SER CB C 54 65.738 64.598 1.140 1
1 572 . 2 1 1 A 54 54 SER N N 54 127.178 122.916 4.262 1
1 573 . 2 1 1 A 55 55 VAL H H 55 9.049 9.125 -0.076 1
1 574 . 2 1 1 A 55 55 VAL HA H 55 5.691 5.294 0.397 1
1 582 . 2 1 1 A 55 55 VAL C C 55 173.959 172.903 1.056 1
1 583 . 2 1 1 A 55 55 VAL CA C 55 58.398 59.742 -1.344 1
1 584 . 2 1 1 A 55 55 VAL CB C 55 36.262 35.905 0.357 1
1 587 . 2 1 1 A 55 55 VAL N N 55 120.619 127.395 -6.776 1
1 588 . 2 1 1 A 56 56 TYR H H 56 8.629 9.476 -0.847 1
1 589 . 2 1 1 A 56 56 TYR HA H 56 4.951 4.824 0.127 1
1 596 . 2 1 1 A 56 56 TYR C C 56 175.224 174.222 1.002 1
1 597 . 2 1 1 A 56 56 TYR CA C 56 56.684 56.813 -0.129 1
1 598 . 2 1 1 A 56 56 TYR CB C 56 39.646 39.301 0.345 1
1 603 . 2 1 1 A 56 56 TYR N N 56 127.444 130.106 -2.662 1
1 604 . 2 1 1 A 57 57 SER H H 57 8.869 8.938 -0.069 1
1 605 . 2 1 1 A 57 57 SER HA H 57 4.739 5.200 -0.461 1
1 608 . 2 1 1 A 57 57 SER C C 57 174.492 173.846 0.646 1
1 609 . 2 1 1 A 57 57 SER CA C 57 57.591 56.870 0.721 1
1 610 . 2 1 1 A 57 57 SER CB C 57 64.281 65.605 -1.324 1
1 611 . 2 1 1 A 57 57 SER N N 57 122.165 123.476 -1.311 1
1 612 . 2 1 1 A 58 58 ASP H H 58 10.446 9.378 1.068 1
1 613 . 2 1 1 A 58 58 ASP HA H 58 4.382 4.271 0.111 1
1 616 . 2 1 1 A 58 58 ASP C C 58 176.398 175.013 1.385 1
1 617 . 2 1 1 A 58 58 ASP CA C 58 55.215 55.003 0.212 1
1 618 . 2 1 1 A 58 58 ASP CB C 58 39.513 40.040 -0.527 1
1 619 . 2 1 1 A 58 58 ASP N N 58 132.098 129.358 2.740 1
1 620 . 2 1 1 A 59 59 GLY H H 59 7.861 8.376 -0.515 1
1 621 . 2 1 1 A 59 59 GLY HA2 H 59 3.817 3.787 0.030 1
1 622 . 2 1 1 A 59 59 GLY HA3 H 59 4.086 3.834 0.252 1
1 623 . 2 1 1 A 59 59 GLY C C 59 173.111 173.501 -0.390 1
1 624 . 2 1 1 A 59 59 GLY CA C 59 45.486 45.277 0.209 1
1 625 . 2 1 1 A 59 59 GLY N N 59 102.674 105.070 -2.396 1
1 626 . 2 1 1 A 60 60 GLN H H 60 7.137 7.512 -0.375 1
1 627 . 2 1 1 A 60 60 GLN HA H 60 4.455 4.622 -0.167 1
1 634 . 2 1 1 A 60 60 GLN C C 60 173.549 174.746 -1.197 1
1 635 . 2 1 1 A 60 60 GLN CA C 60 53.388 53.822 -0.434 1
1 636 . 2 1 1 A 60 60 GLN CB C 60 32.373 31.190 1.183 1
1 638 . 2 1 1 A 60 60 GLN N N 60 116.206 119.279 -3.073 1
1 640 . 2 1 1 A 61 61 ARG H H 61 8.589 8.478 0.111 1
1 641 . 2 1 1 A 61 61 ARG HA H 61 4.740 4.444 0.296 1
1 649 . 2 1 1 A 61 61 ARG C C 61 174.458 174.504 -0.046 1
1 650 . 2 1 1 A 61 61 ARG CA C 61 57.116 55.513 1.603 1
1 651 . 2 1 1 A 61 61 ARG CB C 61 29.615 30.672 -1.057 1
1 654 . 2 1 1 A 61 61 ARG N N 61 120.467 122.109 -1.642 1
1 656 . 2 1 1 A 62 62 ARG H H 62 8.867 8.933 -0.066 1
1 657 . 2 1 1 A 62 62 ARG HA H 62 4.297 4.477 -0.180 1
1 665 . 2 1 1 A 62 62 ARG C C 62 173.485 174.969 -1.484 1
1 666 . 2 1 1 A 62 62 ARG CA C 62 53.355 55.246 -1.891 1
1 667 . 2 1 1 A 62 62 ARG CB C 62 33.028 32.461 0.567 1
1 670 . 2 1 1 A 62 62 ARG N N 62 122.641 124.283 -1.642 1
1 672 . 2 1 1 A 63 63 HIS H H 63 7.997 8.297 -0.300 1
1 673 . 2 1 1 A 63 63 HIS HA H 63 5.427 5.283 0.144 1
1 678 . 2 1 1 A 63 63 HIS C C 63 174.946 174.162 0.784 1
1 679 . 2 1 1 A 63 63 HIS CA C 63 54.689 53.827 0.862 1
1 680 . 2 1 1 A 63 63 HIS CB C 63 33.008 32.897 0.111 1
1 683 . 2 1 1 A 63 63 HIS N N 63 119.064 118.449 0.615 1
1 684 . 2 1 1 A 64 64 PHE H H 64 9.880 9.464 0.416 1
1 685 . 2 1 1 A 64 64 PHE HA H 64 4.824 5.030 -0.206 1
1 693 . 2 1 1 A 64 64 PHE C C 64 174.882 175.311 -0.429 1
1 694 . 2 1 1 A 64 64 PHE CA C 64 56.489 56.454 0.035 1
1 695 . 2 1 1 A 64 64 PHE CB C 64 41.405 41.090 0.315 1
1 701 . 2 1 1 A 64 64 PHE N N 64 123.961 121.764 2.197 1
1 702 . 2 1 1 A 65 65 ILE H H 65 8.982 9.080 -0.098 1
1 703 . 2 1 1 A 65 65 ILE HA H 65 4.273 4.516 -0.243 1
1 713 . 2 1 1 A 65 65 ILE C C 65 176.556 176.158 0.398 1
1 714 . 2 1 1 A 65 65 ILE CA C 65 62.649 61.709 0.940 1
1 715 . 2 1 1 A 65 65 ILE CB C 65 38.296 37.978 0.318 1
1 719 . 2 1 1 A 65 65 ILE N N 65 126.601 124.768 1.833 1
1 720 . 2 1 1 A 66 66 ILE H H 66 8.947 8.958 -0.011 1
1 721 . 2 1 1 A 66 66 ILE HA H 66 3.780 4.102 -0.322 1
1 731 . 2 1 1 A 66 66 ILE C C 66 175.721 175.597 0.124 1
1 732 . 2 1 1 A 66 66 ILE CA C 66 62.960 60.800 2.160 1
1 733 . 2 1 1 A 66 66 ILE CB C 66 37.209 38.188 -0.979 1
1 737 . 2 1 1 A 66 66 ILE N N 66 130.139 128.307 1.832 1
1 738 . 2 1 1 A 67 67 GLN H H 67 8.410 8.828 -0.418 1
1 739 . 2 1 1 A 67 67 GLN HA H 67 4.422 4.861 -0.439 1
1 746 . 2 1 1 A 67 67 GLN C C 67 174.347 173.882 0.465 1
1 747 . 2 1 1 A 67 67 GLN CA C 67 55.867 54.927 0.940 1
1 748 . 2 1 1 A 67 67 GLN CB C 67 29.950 30.222 -0.272 1
1 750 . 2 1 1 A 67 67 GLN N N 67 128.872 127.096 1.776 1
1 752 . 2 1 1 A 68 68 TYR H H 68 8.619 8.954 -0.335 1
1 753 . 2 1 1 A 68 68 TYR HA H 68 5.300 4.754 0.546 1
1 760 . 2 1 1 A 68 68 TYR C C 68 174.695 174.235 0.460 1
1 761 . 2 1 1 A 68 68 TYR CA C 68 55.579 56.457 -0.878 1
1 762 . 2 1 1 A 68 68 TYR CB C 68 39.479 38.944 0.535 1
1 767 . 2 1 1 A 68 68 TYR N N 68 124.772 125.660 -0.888 1
1 768 . 2 1 1 A 69 69 VAL H H 69 8.539 8.668 -0.129 1
1 769 . 2 1 1 A 69 69 VAL HA H 69 4.046 4.320 -0.274 1
1 777 . 2 1 1 A 69 69 VAL C C 69 175.010 175.329 -0.319 1
1 778 . 2 1 1 A 69 69 VAL CA C 69 60.611 60.785 -0.174 1
1 779 . 2 1 1 A 69 69 VAL CB C 69 35.358 34.288 1.070 1
1 782 . 2 1 1 A 69 69 VAL N N 69 126.652 127.319 -0.667 1
1 783 . 2 1 1 A 70 70 ASP H H 70 9.089 9.278 -0.189 1
1 784 . 2 1 1 A 70 70 ASP HA H 70 4.025 4.185 -0.160 1
1 787 . 2 1 1 A 70 70 ASP C C 70 174.813 174.926 -0.113 1
1 788 . 2 1 1 A 70 70 ASP CA C 70 55.623 55.580 0.043 1
1 789 . 2 1 1 A 70 70 ASP CB C 70 39.081 39.062 0.019 1
1 790 . 2 1 1 A 70 70 ASP N N 70 128.327 129.047 -0.720 1
1 791 . 2 1 1 A 71 71 ASN H H 71 8.128 7.956 0.172 1
1 792 . 2 1 1 A 71 71 ASN HA H 71 3.597 3.743 -0.146 1
1 797 . 2 1 1 A 71 71 ASN C C 71 173.250 173.663 -0.413 1
1 798 . 2 1 1 A 71 71 ASN CA C 71 54.728 54.355 0.373 1
1 799 . 2 1 1 A 71 71 ASN CB C 71 37.601 37.284 0.317 1
1 800 . 2 1 1 A 71 71 ASN N N 71 107.230 107.841 -0.611 1
1 802 . 2 1 1 A 72 72 MET H H 72 7.256 7.362 -0.106 1
1 803 . 2 1 1 A 72 72 MET HA H 72 4.740 4.799 -0.059 1
1 808 . 2 1 1 A 72 72 MET C C 72 173.780 174.335 -0.555 1
1 809 . 2 1 1 A 72 72 MET CA C 72 53.703 54.100 -0.397 1
1 810 . 2 1 1 A 72 72 MET CB C 72 36.570 36.332 0.238 1
1 812 . 2 1 1 A 72 72 MET N N 72 117.117 117.039 0.078 1
1 813 . 2 1 1 A 73 73 TYR H H 73 9.430 9.185 0.245 1
1 814 . 2 1 1 A 73 73 TYR HA H 73 5.718 5.177 0.541 1
1 821 . 2 1 1 A 73 73 TYR C C 73 176.140 175.744 0.396 1
1 822 . 2 1 1 A 73 73 TYR CA C 73 57.290 57.654 -0.364 1
1 823 . 2 1 1 A 73 73 TYR CB C 73 40.013 39.794 0.219 1
1 828 . 2 1 1 A 73 73 TYR N N 73 119.856 122.654 -2.798 1
1 829 . 2 1 1 A 74 74 ARG H H 74 9.038 9.002 0.036 1
1 830 . 2 1 1 A 74 74 ARG HA H 74 4.867 5.076 -0.209 1
1 838 . 2 1 1 A 74 74 ARG C C 74 173.954 174.720 -0.766 1
1 839 . 2 1 1 A 74 74 ARG CA C 74 54.887 54.319 0.568 1
1 840 . 2 1 1 A 74 74 ARG CB C 74 34.484 34.359 0.125 1
1 843 . 2 1 1 A 74 74 ARG N N 74 117.344 120.690 -3.346 1
1 845 . 2 1 1 A 75 75 PHE H H 75 9.005 8.818 0.187 1
1 846 . 2 1 1 A 75 75 PHE HA H 75 5.046 4.718 0.328 1
1 854 . 2 1 1 A 75 75 PHE C C 75 176.186 176.529 -0.343 1
1 855 . 2 1 1 A 75 75 PHE CA C 75 59.658 59.517 0.141 1
1 856 . 2 1 1 A 75 75 PHE CB C 75 39.356 40.132 -0.776 1
1 862 . 2 1 1 A 75 75 PHE N N 75 117.865 118.821 -0.956 1
1 863 . 2 1 1 A 76 76 GLU H H 76 8.213 8.378 -0.165 1
1 864 . 2 1 1 A 76 76 GLU HA H 76 4.586 4.534 0.052 1
1 869 . 2 1 1 A 76 76 GLU C C 76 175.238 178.218 -2.980 1
1 870 . 2 1 1 A 76 76 GLU CA C 76 55.994 57.906 -1.912 1
1 871 . 2 1 1 A 76 76 GLU CB C 76 31.805 31.148 0.657 1
1 873 . 2 1 1 A 76 76 GLU N N 76 116.834 117.110 -0.276 1
1 874 . 2 1 1 A 77 77 GLY H H 77 8.692 7.881 0.811 1
1 875 . 2 1 1 A 77 77 GLY HA2 H 77 4.166 3.894 0.272 1
1 876 . 2 1 1 A 77 77 GLY HA3 H 77 4.015 3.901 0.114 1
1 877 . 2 1 1 A 77 77 GLY C C 77 173.784 175.272 -1.488 1
1 878 . 2 1 1 A 77 77 GLY CA C 77 45.505 46.423 -0.918 1
1 879 . 2 1 1 A 77 77 GLY N N 77 111.937 108.405 3.532 1
1 880 . 2 1 1 A 78 78 THR H H 78 8.332 7.981 0.351 1
1 881 . 2 1 1 A 78 78 THR HA H 78 3.900 4.198 -0.298 1
1 886 . 2 1 1 A 78 78 THR C C 78 173.591 174.269 -0.678 1
1 887 . 2 1 1 A 78 78 THR CA C 78 63.653 63.098 0.555 1
1 888 . 2 1 1 A 78 78 THR CB C 78 69.649 69.030 0.619 1
1 890 . 2 1 1 A 78 78 THR N N 78 120.765 113.936 6.829 1
1 891 . 2 1 1 A 79 79 GLY H H 79 8.038 8.522 -0.484 1
1 892 . 2 1 1 A 79 79 GLY HA2 H 79 4.748 4.271 0.477 1
1 893 . 2 1 1 A 79 79 GLY HA3 H 79 3.546 4.404 -0.858 1
1 894 . 2 1 1 A 79 79 GLY C C 79 172.580 171.858 0.722 1
1 895 . 2 1 1 A 79 79 GLY CA C 79 44.661 43.932 0.729 1
1 896 . 2 1 1 A 79 79 GLY N N 79 109.887 114.432 -4.545 1
1 897 . 2 1 1 A 80 80 PHE H H 80 9.064 8.865 0.199 1
1 898 . 2 1 1 A 80 80 PHE HA H 80 4.886 4.916 -0.030 1
1 906 . 2 1 1 A 80 80 PHE C C 80 176.507 176.297 0.210 1
1 907 . 2 1 1 A 80 80 PHE CA C 80 57.257 56.423 0.834 1
1 908 . 2 1 1 A 80 80 PHE CB C 80 44.655 42.479 2.176 1
1 914 . 2 1 1 A 80 80 PHE N N 80 116.862 120.300 -3.438 1
1 915 . 2 1 1 A 81 81 SER H H 81 9.413 8.759 0.654 1
1 916 . 2 1 1 A 81 81 SER HA H 81 4.622 4.430 0.192 1
1 919 . 2 1 1 A 81 81 SER C C 81 173.735 174.836 -1.101 1
1 920 . 2 1 1 A 81 81 SER CA C 81 61.410 61.593 -0.183 1
1 921 . 2 1 1 A 81 81 SER CB C 81 64.165 63.365 0.800 1
1 922 . 2 1 1 A 81 81 SER N N 81 116.467 116.953 -0.486 1
1 923 . 2 1 1 A 82 82 ASN H H 82 7.688 8.150 -0.462 1
1 924 . 2 1 1 A 82 82 ASN HA H 82 4.952 5.263 -0.311 1
1 929 . 2 1 1 A 82 82 ASN C C 82 173.303 175.512 -2.209 1
1 930 . 2 1 1 A 82 82 ASN CA C 82 52.086 52.317 -0.231 1
1 931 . 2 1 1 A 82 82 ASN CB C 82 41.258 40.894 0.364 1
1 932 . 2 1 1 A 82 82 ASN N N 82 113.355 116.477 -3.122 1
1 934 . 2 1 1 A 83 83 ILE H H 83 8.858 8.877 -0.019 1
1 935 . 2 1 1 A 83 83 ILE HA H 83 3.571 3.767 -0.196 1
1 945 . 2 1 1 A 83 83 ILE CA C 83 66.416 65.164 1.252 1
1 946 . 2 1 1 A 83 83 ILE CB C 83 35.074 34.696 0.378 1
1 950 . 2 1 1 A 83 83 ILE N N 83 118.908 122.789 -3.881 1
1 951 . 2 1 1 A 84 84 PRO HA H 84 4.411 4.610 -0.199 1
1 958 . 2 1 1 A 84 84 PRO C C 84 177.616 179.489 -1.873 1
1 959 . 2 1 1 A 84 84 PRO CA C 84 67.525 66.455 1.070 1
1 960 . 2 1 1 A 84 84 PRO CB C 84 31.029 30.927 0.102 1
1 963 . 2 1 1 A 85 85 GLN H H 85 8.405 8.330 0.075 1
1 964 . 2 1 1 A 85 85 GLN HA H 85 3.874 4.045 -0.171 1
1 971 . 2 1 1 A 85 85 GLN C C 85 178.213 178.096 0.117 1
1 972 . 2 1 1 A 85 85 GLN CA C 85 59.495 58.771 0.724 1
1 973 . 2 1 1 A 85 85 GLN CB C 85 29.270 28.471 0.799 1
1 975 . 2 1 1 A 85 85 GLN N N 85 115.597 117.470 -1.873 1
1 977 . 2 1 1 A 86 86 LEU H H 86 7.136 7.904 -0.768 1
1 978 . 2 1 1 A 86 86 LEU HA H 86 3.589 3.162 0.427 1
1 988 . 2 1 1 A 86 86 LEU C C 86 177.728 178.379 -0.651 1
1 989 . 2 1 1 A 86 86 LEU CA C 86 58.136 58.144 -0.008 1
1 990 . 2 1 1 A 86 86 LEU CB C 86 42.290 41.711 0.579 1
1 994 . 2 1 1 A 86 86 LEU N N 86 121.840 121.930 -0.090 1
1 995 . 2 1 1 A 87 87 ILE H H 87 8.323 7.949 0.374 1
1 996 . 2 1 1 A 87 87 ILE HA H 87 3.415 3.366 0.049 1
1 1006 . 2 1 1 A 87 87 ILE C C 87 178.064 177.650 0.414 1
1 1007 . 2 1 1 A 87 87 ILE CA C 87 61.458 65.455 -3.997 1
1 1008 . 2 1 1 A 87 87 ILE CB C 87 34.561 37.740 -3.179 1
1 1012 . 2 1 1 A 87 87 ILE N N 87 118.117 119.522 -1.405 1
1 1013 . 2 1 1 A 88 88 ASP H H 88 8.805 8.411 0.394 1
1 1014 . 2 1 1 A 88 88 ASP HA H 88 4.548 4.253 0.295 1
1 1017 . 2 1 1 A 88 88 ASP C C 88 179.265 178.124 1.141 1
1 1018 . 2 1 1 A 88 88 ASP CA C 88 58.099 57.363 0.736 1
1 1019 . 2 1 1 A 88 88 ASP CB C 88 42.166 41.855 0.311 1
1 1020 . 2 1 1 A 88 88 ASP N N 88 119.143 120.412 -1.269 1
1 1021 . 2 1 1 A 89 89 HIS H H 89 8.113 8.056 0.057 1
1 1022 . 2 1 1 A 89 89 HIS HA H 89 4.225 4.311 -0.086 1
1 1026 . 2 1 1 A 89 89 HIS C C 89 179.261 176.918 2.343 1
1 1027 . 2 1 1 A 89 89 HIS CA C 89 60.647 59.264 1.383 1
1 1028 . 2 1 1 A 89 89 HIS CB C 89 30.801 30.031 0.770 1
1 1030 . 2 1 1 A 89 89 HIS N N 89 119.595 119.263 0.332 1
1 1031 . 2 1 1 A 90 90 HIS H H 90 7.685 7.824 -0.139 1
1 1032 . 2 1 1 A 90 90 HIS HA H 90 3.628 4.190 -0.562 1
1 1036 . 2 1 1 A 90 90 HIS C C 90 178.454 177.430 1.024 1
1 1037 . 2 1 1 A 90 90 HIS CA C 90 61.797 60.143 1.654 1
1 1038 . 2 1 1 A 90 90 HIS CB C 90 28.165 29.901 -1.736 1
1 1040 . 2 1 1 A 90 90 HIS N N 90 120.061 117.733 2.328 1
1 1041 . 2 1 1 A 91 91 TYR H H 91 9.394 8.281 1.113 1
1 1042 . 2 1 1 A 91 91 TYR HA H 91 4.238 3.920 0.318 1
1 1049 . 2 1 1 A 91 91 TYR C C 91 176.443 177.245 -0.802 1
1 1050 . 2 1 1 A 91 91 TYR CA C 91 60.669 61.685 -1.016 1
1 1051 . 2 1 1 A 91 91 TYR CB C 91 39.169 38.555 0.614 1
1 1056 . 2 1 1 A 91 91 TYR N N 91 123.532 120.079 3.453 1
1 1057 . 2 1 1 A 92 92 THR H H 92 8.774 8.700 0.074 1
1 1058 . 2 1 1 A 92 92 THR HA H 92 3.866 4.120 -0.254 1
1 1063 . 2 1 1 A 92 92 THR C C 92 177.050 176.455 0.595 1
1 1064 . 2 1 1 A 92 92 THR CA C 92 65.240 65.297 -0.057 1
1 1065 . 2 1 1 A 92 92 THR CB C 92 69.298 67.991 1.307 1
1 1067 . 2 1 1 A 92 92 THR N N 92 112.000 112.756 -0.756 1
1 1068 . 2 1 1 A 93 93 THR H H 93 7.617 7.647 -0.030 1
1 1069 . 2 1 1 A 93 93 THR HA H 93 4.133 4.082 0.051 1
1 1074 . 2 1 1 A 93 93 THR C C 93 176.234 175.170 1.064 1
1 1075 . 2 1 1 A 93 93 THR CA C 93 63.527 63.435 0.092 1
1 1076 . 2 1 1 A 93 93 THR CB C 93 71.234 69.895 1.339 1
1 1078 . 2 1 1 A 93 93 THR N N 93 109.883 113.240 -3.357 1
1 1079 . 2 1 1 A 94 94 LYS H H 94 7.210 7.716 -0.506 1
1 1080 . 2 1 1 A 94 94 LYS HA H 94 3.830 3.736 0.094 1
1 1089 . 2 1 1 A 94 94 LYS C C 94 174.331 175.034 -0.703 1
1 1090 . 2 1 1 A 94 94 LYS CA C 94 56.776 57.373 -0.597 1
1 1091 . 2 1 1 A 94 94 LYS CB C 94 28.095 31.128 -3.033 1
1 1095 . 2 1 1 A 94 94 LYS N N 94 112.818 121.321 -8.503 1
1 1096 . 2 1 1 A 95 95 GLN H H 95 7.439 7.525 -0.086 1
1 1097 . 2 1 1 A 95 95 GLN HA H 95 4.216 4.578 -0.362 1
1 1104 . 2 1 1 A 95 95 GLN C C 95 179.087 175.429 3.658 1
1 1105 . 2 1 1 A 95 95 GLN CA C 95 56.378 54.574 1.804 1
1 1106 . 2 1 1 A 95 95 GLN CB C 95 28.542 30.570 -2.028 1
1 1108 . 2 1 1 A 95 95 GLN N N 95 117.860 118.971 -1.111 1
1 1110 . 2 1 1 A 96 96 VAL H H 96 8.520 8.477 0.043 1
1 1111 . 2 1 1 A 96 96 VAL HA H 96 4.297 4.601 -0.304 1
1 1119 . 2 1 1 A 96 96 VAL C C 96 177.329 176.784 0.545 1
1 1120 . 2 1 1 A 96 96 VAL CA C 96 61.196 61.448 -0.252 1
1 1121 . 2 1 1 A 96 96 VAL CB C 96 32.735 33.602 -0.867 1
1 1124 . 2 1 1 A 96 96 VAL N N 96 124.208 118.663 5.545 1
1 1125 . 2 1 1 A 97 97 ILE H H 97 8.491 8.339 0.152 1
1 1126 . 2 1 1 A 97 97 ILE HA H 97 2.995 3.390 -0.395 1
1 1136 . 2 1 1 A 97 97 ILE CA C 97 62.066 63.220 -1.154 1
1 1137 . 2 1 1 A 97 97 ILE CB C 97 36.117 37.746 -1.629 1
1 1141 . 2 1 1 A 97 97 ILE N N 97 119.561 124.039 -4.478 1
1 1142 . 2 1 1 A 98 98 THR HA H 98 4.460 4.593 -0.133 1
1 1147 . 2 1 1 A 98 98 THR C C 98 174.335 174.607 -0.272 1
1 1148 . 2 1 1 A 98 98 THR CA C 98 58.244 59.440 -1.196 1
1 1149 . 2 1 1 A 98 98 THR CB C 98 73.056 71.946 1.110 1
1 1151 . 2 1 1 A 99 99 LYS H H 99 9.761 8.753 1.008 1
1 1152 . 2 1 1 A 99 99 LYS HA H 99 3.911 3.981 -0.070 1
1 1161 . 2 1 1 A 99 99 LYS C C 99 179.594 178.765 0.829 1
1 1162 . 2 1 1 A 99 99 LYS CA C 99 59.661 58.821 0.840 1
1 1163 . 2 1 1 A 99 99 LYS CB C 99 31.978 32.000 -0.022 1
1 1167 . 2 1 1 A 99 99 LYS N N 99 125.750 122.119 3.631 1
1 1168 . 2 1 1 A 100 100 LYS H H 100 8.910 7.467 1.443 1
1 1169 . 2 1 1 A 100 100 LYS HA H 100 4.024 4.097 -0.073 1
1 1178 . 2 1 1 A 100 100 LYS C C 100 178.060 177.840 0.220 1
1 1179 . 2 1 1 A 100 100 LYS CA C 100 58.642 58.545 0.097 1
1 1180 . 2 1 1 A 100 100 LYS CB C 100 32.750 32.092 0.658 1
1 1184 . 2 1 1 A 100 100 LYS N N 100 117.112 120.710 -3.598 1
1 1185 . 2 1 1 A 101 101 SER H H 101 7.721 7.712 0.009 1
1 1186 . 2 1 1 A 101 101 SER HA H 101 4.282 4.647 -0.365 1
1 1189 . 2 1 1 A 101 101 SER C C 101 176.403 175.898 0.505 1
1 1190 . 2 1 1 A 101 101 SER CA C 101 60.442 58.743 1.699 1
1 1191 . 2 1 1 A 101 101 SER CB C 101 63.775 64.687 -0.912 1
1 1192 . 2 1 1 A 101 101 SER N N 101 112.069 110.842 1.227 1
1 1193 . 2 1 1 A 102 102 GLY H H 102 8.038 8.285 -0.247 1
1 1194 . 2 1 1 A 102 102 GLY HA2 H 102 4.024 3.868 0.156 1
1 1195 . 2 1 1 A 102 102 GLY HA3 H 102 3.713 3.895 -0.182 1
1 1196 . 2 1 1 A 102 102 GLY C C 102 173.991 174.591 -0.600 1
1 1197 . 2 1 1 A 102 102 GLY CA C 102 46.458 45.266 1.192 1
1 1198 . 2 1 1 A 102 102 GLY N N 102 111.144 110.468 0.676 1
1 1199 . 2 1 1 A 103 103 VAL H H 103 7.155 7.441 -0.286 1
1 1200 . 2 1 1 A 103 103 VAL HA H 103 3.652 3.961 -0.309 1
1 1208 . 2 1 1 A 103 103 VAL C C 103 173.805 175.239 -1.434 1
1 1209 . 2 1 1 A 103 103 VAL CA C 103 64.310 62.782 1.528 1
1 1210 . 2 1 1 A 103 103 VAL CB C 103 32.254 31.778 0.476 1
1 1213 . 2 1 1 A 103 103 VAL N N 103 119.836 122.428 -2.592 1
1 1214 . 2 1 1 A 104 104 VAL H H 104 7.653 9.070 -1.417 1
1 1215 . 2 1 1 A 104 104 VAL HA H 104 4.048 4.447 -0.399 1
1 1223 . 2 1 1 A 104 104 VAL C C 104 175.708 174.408 1.300 1
1 1224 . 2 1 1 A 104 104 VAL CA C 104 60.275 60.753 -0.478 1
1 1225 . 2 1 1 A 104 104 VAL CB C 104 35.112 34.291 0.821 1
1 1228 . 2 1 1 A 104 104 VAL N N 104 125.859 128.548 -2.689 1
1 1229 . 2 1 1 A 105 105 LEU H H 105 8.616 8.327 0.289 1
1 1230 . 2 1 1 A 105 105 LEU HA H 105 3.905 4.691 -0.786 1
1 1240 . 2 1 1 A 105 105 LEU C C 105 175.380 175.681 -0.301 1
1 1241 . 2 1 1 A 105 105 LEU CA C 105 54.471 53.473 0.998 1
1 1242 . 2 1 1 A 105 105 LEU CB C 105 39.821 41.830 -2.009 1
1 1246 . 2 1 1 A 105 105 LEU N N 105 123.839 126.333 -2.494 1
1 1247 . 2 1 1 A 106 106 LEU H H 106 8.894 8.514 0.380 1
1 1248 . 2 1 1 A 106 106 LEU HA H 106 4.839 4.831 0.008 1
1 1258 . 2 1 1 A 106 106 LEU C C 106 176.930 176.362 0.568 1
1 1259 . 2 1 1 A 106 106 LEU CA C 106 56.288 53.200 3.088 1
1 1260 . 2 1 1 A 106 106 LEU CB C 106 45.237 45.498 -0.261 1
1 1264 . 2 1 1 A 106 106 LEU N N 106 120.590 120.956 -0.366 1
1 1265 . 2 1 1 A 107 107 ASN H H 107 8.124 8.943 -0.819 1
1 1266 . 2 1 1 A 107 107 ASN HA H 107 5.650 4.643 1.007 1
1 1271 . 2 1 1 A 107 107 ASN CA C 107 50.293 53.960 -3.667 1
1 1272 . 2 1 1 A 107 107 ASN CB C 107 41.223 36.189 5.034 1
1 1273 . 2 1 1 A 107 107 ASN N N 107 116.866 117.643 -0.777 1
1 1275 . 2 1 1 A 108 108 PRO HA H 108 2.926 3.787 -0.861 1
1 1282 . 2 1 1 A 108 108 PRO C C 108 176.671 175.553 1.118 1
1 1283 . 2 1 1 A 108 108 PRO CA C 108 60.804 62.457 -1.653 1
1 1284 . 2 1 1 A 108 108 PRO CB C 108 31.774 31.877 -0.103 1
1 1287 . 2 1 1 A 109 109 ILE H H 109 8.648 7.879 0.769 1
1 1288 . 2 1 1 A 109 109 ILE HA H 109 4.519 4.506 0.013 1
1 1298 . 2 1 1 A 109 109 ILE CA C 109 55.070 58.567 -3.497 1
1 1299 . 2 1 1 A 109 109 ILE CB C 109 36.068 38.173 -2.105 1
1 1303 . 2 1 1 A 109 109 ILE N N 109 128.817 123.138 5.679 1
1 1304 . 2 1 1 A 110 110 PRO HA H 110 4.587 4.691 -0.104 1
1 1311 . 2 1 1 A 110 110 PRO C C 110 177.013 175.753 1.260 1
1 1312 . 2 1 1 A 110 110 PRO CA C 110 61.850 62.220 -0.370 1
1 1313 . 2 1 1 A 110 110 PRO CB C 110 32.507 33.083 -0.576 1
1 1316 . 2 1 1 A 111 111 LYS H H 111 8.038 8.597 -0.559 1
1 1317 . 2 1 1 A 111 111 LYS HA H 111 3.553 4.984 -1.431 1
1 1326 . 2 1 1 A 111 111 LYS C C 111 176.123 174.909 1.214 1
1 1327 . 2 1 1 A 111 111 LYS CA C 111 56.220 54.457 1.763 1
1 1328 . 2 1 1 A 111 111 LYS CB C 111 32.373 35.339 -2.966 1
1 1332 . 2 1 1 A 111 111 LYS N N 111 120.147 116.566 3.581 1
1 1333 . 2 1 1 A 112 112 ASP H H 112 8.463 8.580 -0.117 1
1 1334 . 2 1 1 A 112 112 ASP HA H 112 4.523 4.518 0.005 1
1 1337 . 2 1 1 A 112 112 ASP C C 112 175.986 175.902 0.084 1
1 1338 . 2 1 1 A 112 112 ASP CA C 112 54.256 54.639 -0.383 1
1 1339 . 2 1 1 A 112 112 ASP CB C 112 41.563 41.140 0.423 1
1 1340 . 2 1 1 A 112 112 ASP N N 112 121.863 120.313 1.550 1
1 1341 . 2 1 1 A 113 113 LYS H H 113 8.059 8.662 -0.603 1
1 1342 . 2 1 1 A 113 113 LYS HA H 113 4.136 4.372 -0.236 1
1 1351 . 2 1 1 A 113 113 LYS C C 113 176.010 174.859 1.151 1
1 1352 . 2 1 1 A 113 113 LYS CA C 113 56.253 55.782 0.471 1
1 1353 . 2 1 1 A 113 113 LYS CB C 113 32.754 30.615 2.139 1
1 1357 . 2 1 1 A 113 113 LYS N N 113 121.725 123.631 -1.906 1
1 1358 . 2 1 1 A 114 114 LYS H H 114 8.225 7.573 0.652 1
1 1359 . 2 1 1 A 114 114 LYS HA H 114 4.169 4.803 -0.634 1
1 1368 . 2 1 1 A 114 114 LYS C C 114 176.198 175.439 0.759 1
1 1369 . 2 1 1 A 114 114 LYS CA C 114 56.413 54.114 2.299 1
1 1370 . 2 1 1 A 114 114 LYS CB C 114 32.725 35.876 -3.151 1
1 1374 . 2 1 1 A 114 114 LYS N N 114 121.857 119.433 2.424 1
1 1375 . 2 1 1 A 115 115 TRP H H 115 8.078 7.667 0.411 1
1 1376 . 2 1 1 A 115 115 TRP HA H 115 4.709 5.032 -0.323 1
1 1385 . 2 1 1 A 115 115 TRP C C 115 175.119 176.560 -1.441 1
1 1386 . 2 1 1 A 115 115 TRP CA C 115 56.856 56.653 0.203 1
1 1387 . 2 1 1 A 115 115 TRP CB C 115 29.474 30.227 -0.753 1
1 1393 . 2 1 1 A 115 115 TRP N N 115 122.068 120.018 2.050 1
1 1 . 3 1 1 A 10 10 HIS HA H 10 4.616 5.092 -0.476 1
1 4 . 3 1 1 A 10 10 HIS C C 10 174.981 175.313 -0.332 1
1 5 . 3 1 1 A 10 10 HIS CA C 10 56.555 54.977 1.578 1
1 6 . 3 1 1 A 10 10 HIS CB C 10 30.231 31.931 -1.700 1
1 7 . 3 1 1 A 11 11 MET H H 11 8.103 8.822 -0.719 1
1 8 . 3 1 1 A 11 11 MET HA H 11 4.439 4.506 -0.067 1
1 13 . 3 1 1 A 11 11 MET C C 11 175.888 176.277 -0.389 1
1 14 . 3 1 1 A 11 11 MET CA C 11 55.090 54.852 0.238 1
1 15 . 3 1 1 A 11 11 MET CB C 11 33.121 33.625 -0.504 1
1 17 . 3 1 1 A 11 11 MET N N 11 120.743 120.674 0.069 1
1 18 . 3 1 1 A 12 12 LYS H H 12 8.065 8.477 -0.412 1
1 19 . 3 1 1 A 12 12 LYS HA H 12 4.407 4.657 -0.250 1
1 28 . 3 1 1 A 12 12 LYS CA C 12 54.894 53.934 0.960 1
1 29 . 3 1 1 A 12 12 LYS CB C 12 31.863 31.933 -0.070 1
1 33 . 3 1 1 A 12 12 LYS N N 12 123.187 121.709 1.478 1
1 34 . 3 1 1 A 13 13 PRO HA H 13 4.347 4.492 -0.145 1
1 41 . 3 1 1 A 13 13 PRO C C 13 176.891 177.501 -0.610 1
1 42 . 3 1 1 A 13 13 PRO CA C 13 62.542 62.405 0.137 1
1 43 . 3 1 1 A 13 13 PRO CB C 13 32.663 32.693 -0.030 1
1 46 . 3 1 1 A 14 14 LEU H H 14 8.339 8.740 -0.401 1
1 47 . 3 1 1 A 14 14 LEU HA H 14 3.373 3.813 -0.440 1
1 57 . 3 1 1 A 14 14 LEU C C 14 176.683 178.166 -1.483 1
1 58 . 3 1 1 A 14 14 LEU CA C 14 58.555 57.561 0.994 1
1 59 . 3 1 1 A 14 14 LEU CB C 14 41.828 41.015 0.813 1
1 63 . 3 1 1 A 14 14 LEU N N 14 123.191 124.011 -0.820 1
1 64 . 3 1 1 A 15 15 ALA H H 15 8.175 7.778 0.397 1
1 65 . 3 1 1 A 15 15 ALA HA H 15 3.983 4.180 -0.197 1
1 69 . 3 1 1 A 15 15 ALA C C 15 178.697 178.229 0.468 1
1 70 . 3 1 1 A 15 15 ALA CA C 15 54.164 54.090 0.074 1
1 71 . 3 1 1 A 15 15 ALA CB C 15 18.771 18.213 0.558 1
1 72 . 3 1 1 A 15 15 ALA N N 15 113.594 119.857 -6.263 1
1 73 . 3 1 1 A 16 16 GLU H H 16 7.458 7.918 -0.460 1
1 74 . 3 1 1 A 16 16 GLU HA H 16 4.266 4.432 -0.166 1
1 79 . 3 1 1 A 16 16 GLU C C 16 176.510 176.149 0.361 1
1 80 . 3 1 1 A 16 16 GLU CA C 16 55.196 56.069 -0.873 1
1 81 . 3 1 1 A 16 16 GLU CB C 16 30.907 30.681 0.226 1
1 83 . 3 1 1 A 16 16 GLU N N 16 113.348 115.939 -2.591 1
1 84 . 3 1 1 A 17 17 GLN H H 17 7.501 6.951 0.550 1
1 85 . 3 1 1 A 17 17 GLN HA H 17 3.683 4.095 -0.412 1
1 92 . 3 1 1 A 17 17 GLN C C 17 178.053 175.837 2.216 1
1 93 . 3 1 1 A 17 17 GLN CA C 17 54.606 55.186 -0.580 1
1 94 . 3 1 1 A 17 17 GLN CB C 17 25.758 28.367 -2.609 1
1 96 . 3 1 1 A 17 17 GLN N N 17 119.411 119.807 -0.396 1
1 98 . 3 1 1 A 18 18 ASP H H 18 8.949 8.551 0.398 1
1 99 . 3 1 1 A 18 18 ASP HA H 18 4.184 4.132 0.052 1
1 102 . 3 1 1 A 18 18 ASP C C 18 175.263 178.590 -3.327 1
1 103 . 3 1 1 A 18 18 ASP CA C 18 57.275 57.077 0.198 1
1 104 . 3 1 1 A 18 18 ASP CB C 18 40.620 40.275 0.345 1
1 105 . 3 1 1 A 18 18 ASP N N 18 124.676 123.230 1.446 1
1 106 . 3 1 1 A 19 19 TRP H H 19 6.068 7.413 -1.345 1
1 107 . 3 1 1 A 19 19 TRP HA H 19 5.045 4.597 0.448 1
1 116 . 3 1 1 A 19 19 TRP C C 19 175.902 176.432 -0.530 1
1 117 . 3 1 1 A 19 19 TRP CA C 19 53.542 57.930 -4.388 1
1 118 . 3 1 1 A 19 19 TRP CB C 19 29.179 28.471 0.708 1
1 124 . 3 1 1 A 19 19 TRP N N 19 107.757 118.358 -10.601 1
1 126 . 3 1 1 A 20 20 TYR H H 20 7.430 7.335 0.095 1
1 127 . 3 1 1 A 20 20 TYR HA H 20 5.601 5.203 0.398 1
1 132 . 3 1 1 A 20 20 TYR C C 20 175.498 175.818 -0.320 1
1 133 . 3 1 1 A 20 20 TYR CA C 20 56.967 57.066 -0.099 1
1 134 . 3 1 1 A 20 20 TYR CB C 20 39.083 38.502 0.581 1
1 137 . 3 1 1 A 20 20 TYR N N 20 123.173 122.003 1.170 1
1 138 . 3 1 1 A 21 21 HIS H H 21 8.934 9.090 -0.156 1
1 139 . 3 1 1 A 21 21 HIS HA H 21 4.295 4.382 -0.087 1
1 144 . 3 1 1 A 21 21 HIS C C 21 175.177 174.969 0.208 1
1 145 . 3 1 1 A 21 21 HIS CA C 21 56.572 56.119 0.453 1
1 146 . 3 1 1 A 21 21 HIS CB C 21 33.365 30.575 2.790 1
1 149 . 3 1 1 A 21 21 HIS N N 21 125.732 127.520 -1.788 1
1 150 . 3 1 1 A 22 22 GLY H H 22 5.280 6.662 -1.382 1
1 151 . 3 1 1 A 22 22 GLY HA2 H 22 3.905 3.444 0.461 1
1 152 . 3 1 1 A 22 22 GLY HA3 H 22 3.585 3.760 -0.175 1
1 153 . 3 1 1 A 22 22 GLY C C 22 174.411 173.637 0.774 1
1 154 . 3 1 1 A 22 22 GLY CA C 22 46.402 44.554 1.848 1
1 155 . 3 1 1 A 22 22 GLY N N 22 104.568 106.486 -1.918 1
1 156 . 3 1 1 A 23 23 ALA H H 23 8.768 8.177 0.591 1
1 157 . 3 1 1 A 23 23 ALA HA H 23 5.171 4.586 0.585 1
1 161 . 3 1 1 A 23 23 ALA C C 23 177.180 176.651 0.529 1
1 162 . 3 1 1 A 23 23 ALA CA C 23 51.153 51.156 -0.003 1
1 163 . 3 1 1 A 23 23 ALA CB C 23 16.999 18.293 -1.294 1
1 164 . 3 1 1 A 23 23 ALA N N 23 130.297 123.835 6.462 1
1 165 . 3 1 1 A 24 24 ILE H H 24 7.267 7.835 -0.568 1
1 166 . 3 1 1 A 24 24 ILE HA H 24 4.460 4.915 -0.455 1
1 176 . 3 1 1 A 24 24 ILE CA C 24 58.529 57.274 1.255 1
1 177 . 3 1 1 A 24 24 ILE CB C 24 38.763 39.455 -0.692 1
1 181 . 3 1 1 A 24 24 ILE N N 24 118.903 118.116 0.787 1
1 182 . 3 1 1 A 25 25 PRO HA H 25 4.224 4.495 -0.271 1
1 189 . 3 1 1 A 25 25 PRO C C 25 176.918 177.402 -0.484 1
1 190 . 3 1 1 A 25 25 PRO CA C 25 62.907 62.501 0.406 1
1 191 . 3 1 1 A 25 25 PRO CB C 25 32.671 32.709 -0.038 1
1 194 . 3 1 1 A 26 26 ARG H H 26 8.781 9.100 -0.319 1
1 195 . 3 1 1 A 26 26 ARG HA H 26 3.472 3.881 -0.409 1
1 202 . 3 1 1 A 26 26 ARG C C 26 178.112 177.880 0.232 1
1 203 . 3 1 1 A 26 26 ARG CA C 26 60.863 59.385 1.478 1
1 204 . 3 1 1 A 26 26 ARG CB C 26 30.314 29.873 0.441 1
1 207 . 3 1 1 A 26 26 ARG N N 26 124.635 121.444 3.191 1
1 208 . 3 1 1 A 27 27 ILE H H 27 8.540 8.120 0.420 1
1 209 . 3 1 1 A 27 27 ILE HA H 27 3.787 3.638 0.149 1
1 219 . 3 1 1 A 27 27 ILE C C 27 177.390 177.535 -0.145 1
1 220 . 3 1 1 A 27 27 ILE CA C 27 64.329 65.133 -0.804 1
1 221 . 3 1 1 A 27 27 ILE CB C 27 37.413 38.022 -0.609 1
1 225 . 3 1 1 A 27 27 ILE N N 27 115.859 120.121 -4.262 1
1 226 . 3 1 1 A 28 28 GLU H H 28 6.953 8.487 -1.534 1
1 227 . 3 1 1 A 28 28 GLU HA H 28 4.067 4.042 0.025 1
1 232 . 3 1 1 A 28 28 GLU C C 28 179.006 179.327 -0.321 1
1 233 . 3 1 1 A 28 28 GLU CA C 28 58.985 59.596 -0.611 1
1 234 . 3 1 1 A 28 28 GLU CB C 28 29.316 29.159 0.157 1
1 236 . 3 1 1 A 28 28 GLU N N 28 120.554 119.270 1.284 1
1 237 . 3 1 1 A 29 29 ALA H H 29 7.999 7.711 0.288 1
1 238 . 3 1 1 A 29 29 ALA HA H 29 3.822 4.034 -0.212 1
1 242 . 3 1 1 A 29 29 ALA C C 29 178.809 179.886 -1.077 1
1 243 . 3 1 1 A 29 29 ALA CA C 29 54.698 54.778 -0.080 1
1 244 . 3 1 1 A 29 29 ALA CB C 29 18.059 18.500 -0.441 1
1 245 . 3 1 1 A 29 29 ALA N N 29 120.122 122.516 -2.394 1
1 246 . 3 1 1 A 30 30 GLN H H 30 8.168 7.861 0.307 1
1 247 . 3 1 1 A 30 30 GLN HA H 30 3.811 4.213 -0.402 1
1 254 . 3 1 1 A 30 30 GLN C C 30 177.578 178.225 -0.647 1
1 255 . 3 1 1 A 30 30 GLN CA C 30 59.731 58.598 1.133 1
1 256 . 3 1 1 A 30 30 GLN CB C 30 28.161 28.878 -0.717 1
1 258 . 3 1 1 A 30 30 GLN N N 30 112.109 115.975 -3.866 1
1 260 . 3 1 1 A 31 31 GLU H H 31 7.248 8.018 -0.770 1
1 261 . 3 1 1 A 31 31 GLU HA H 31 4.063 4.089 -0.026 1
1 266 . 3 1 1 A 31 31 GLU C C 31 177.423 179.129 -1.706 1
1 267 . 3 1 1 A 31 31 GLU CA C 31 57.650 59.070 -1.420 1
1 268 . 3 1 1 A 31 31 GLU CB C 31 29.757 29.207 0.550 1
1 270 . 3 1 1 A 31 31 GLU N N 31 115.340 119.590 -4.250 1
1 271 . 3 1 1 A 32 32 LEU H H 32 7.169 7.411 -0.242 1
1 272 . 3 1 1 A 32 32 LEU HA H 32 4.087 4.296 -0.209 1
1 282 . 3 1 1 A 32 32 LEU C C 32 175.850 176.966 -1.116 1
1 283 . 3 1 1 A 32 32 LEU CA C 32 55.580 56.106 -0.526 1
1 284 . 3 1 1 A 32 32 LEU CB C 32 42.910 41.943 0.967 1
1 288 . 3 1 1 A 32 32 LEU N N 32 116.367 115.552 0.815 1
1 289 . 3 1 1 A 33 33 LEU H H 33 7.062 7.605 -0.543 1
1 290 . 3 1 1 A 33 33 LEU HA H 33 4.431 4.475 -0.044 1
1 300 . 3 1 1 A 33 33 LEU C C 33 174.837 176.977 -2.140 1
1 301 . 3 1 1 A 33 33 LEU CA C 33 53.521 54.556 -1.035 1
1 302 . 3 1 1 A 33 33 LEU CB C 33 43.301 41.441 1.860 1
1 306 . 3 1 1 A 33 33 LEU N N 33 118.568 122.367 -3.799 1
1 307 . 3 1 1 A 34 34 LYS H H 34 8.749 8.599 0.150 1
1 308 . 3 1 1 A 34 34 LYS HA H 34 4.162 4.250 -0.088 1
1 317 . 3 1 1 A 34 34 LYS C C 34 174.378 174.976 -0.598 1
1 318 . 3 1 1 A 34 34 LYS CA C 34 56.575 56.172 0.403 1
1 319 . 3 1 1 A 34 34 LYS CB C 34 36.918 34.595 2.323 1
1 323 . 3 1 1 A 34 34 LYS N N 34 121.659 118.053 3.606 1
1 324 . 3 1 1 A 35 35 LYS H H 35 8.137 7.298 0.839 1
1 325 . 3 1 1 A 35 35 LYS HA H 35 4.011 4.707 -0.696 1
1 334 . 3 1 1 A 35 35 LYS C C 35 174.343 175.106 -0.763 1
1 335 . 3 1 1 A 35 35 LYS CA C 35 53.960 54.304 -0.344 1
1 336 . 3 1 1 A 35 35 LYS CB C 35 35.587 35.603 -0.016 1
1 340 . 3 1 1 A 35 35 LYS N N 35 119.354 115.640 3.714 1
1 341 . 3 1 1 A 36 36 GLN H H 36 8.394 8.667 -0.273 1
1 342 . 3 1 1 A 36 36 GLN HA H 36 4.187 4.537 -0.350 1
1 349 . 3 1 1 A 36 36 GLN C C 36 177.012 176.530 0.482 1
1 350 . 3 1 1 A 36 36 GLN CA C 36 57.750 57.821 -0.071 1
1 351 . 3 1 1 A 36 36 GLN CB C 36 28.433 28.469 -0.036 1
1 353 . 3 1 1 A 36 36 GLN N N 36 120.248 123.209 -2.961 1
1 355 . 3 1 1 A 37 37 GLY H H 37 9.597 8.750 0.847 1
1 356 . 3 1 1 A 37 37 GLY HA2 H 37 4.486 4.131 0.355 1
1 357 . 3 1 1 A 37 37 GLY HA3 H 37 3.926 4.148 -0.222 1
1 358 . 3 1 1 A 37 37 GLY C C 37 176.285 174.600 1.685 1
1 359 . 3 1 1 A 37 37 GLY CA C 37 46.146 45.484 0.662 1
1 360 . 3 1 1 A 37 37 GLY N N 37 116.637 114.081 2.556 1
1 361 . 3 1 1 A 38 38 ASP H H 38 8.925 8.012 0.913 1
1 362 . 3 1 1 A 38 38 ASP HA H 38 5.697 4.660 1.037 1
1 365 . 3 1 1 A 38 38 ASP C C 38 176.181 175.707 0.474 1
1 366 . 3 1 1 A 38 38 ASP CA C 38 55.066 55.515 -0.449 1
1 367 . 3 1 1 A 38 38 ASP CB C 38 42.933 41.256 1.677 1
1 368 . 3 1 1 A 38 38 ASP N N 38 127.293 121.943 5.350 1
1 369 . 3 1 1 A 39 39 PHE H H 39 8.647 8.493 0.154 1
1 370 . 3 1 1 A 39 39 PHE HA H 39 6.025 5.914 0.111 1
1 378 . 3 1 1 A 39 39 PHE C C 39 170.948 173.032 -2.084 1
1 379 . 3 1 1 A 39 39 PHE CA C 39 56.376 56.169 0.207 1
1 380 . 3 1 1 A 39 39 PHE CB C 39 44.583 43.051 1.532 1
1 386 . 3 1 1 A 39 39 PHE N N 39 117.102 119.520 -2.418 1
1 387 . 3 1 1 A 40 40 LEU H H 40 9.186 9.102 0.084 1
1 388 . 3 1 1 A 40 40 LEU HA H 40 4.983 5.290 -0.307 1
1 398 . 3 1 1 A 40 40 LEU C C 40 174.787 174.512 0.275 1
1 399 . 3 1 1 A 40 40 LEU CA C 40 54.610 53.998 0.612 1
1 400 . 3 1 1 A 40 40 LEU CB C 40 44.330 45.498 -1.168 1
1 404 . 3 1 1 A 40 40 LEU N N 40 114.388 117.353 -2.965 1
1 405 . 3 1 1 A 41 41 VAL H H 41 9.390 9.486 -0.096 1
1 406 . 3 1 1 A 41 41 VAL HA H 41 5.742 5.225 0.517 1
1 414 . 3 1 1 A 41 41 VAL C C 41 172.760 174.921 -2.161 1
1 415 . 3 1 1 A 41 41 VAL CA C 41 60.814 61.354 -0.540 1
1 416 . 3 1 1 A 41 41 VAL CB C 41 34.908 33.821 1.087 1
1 419 . 3 1 1 A 41 41 VAL N N 41 119.873 121.618 -1.745 1
1 420 . 3 1 1 A 42 42 ARG H H 42 9.598 9.364 0.234 1
1 421 . 3 1 1 A 42 42 ARG HA H 42 5.247 5.396 -0.149 1
1 429 . 3 1 1 A 42 42 ARG C C 42 173.379 173.997 -0.618 1
1 430 . 3 1 1 A 42 42 ARG CA C 42 53.202 53.573 -0.371 1
1 431 . 3 1 1 A 42 42 ARG CB C 42 33.507 34.210 -0.703 1
1 434 . 3 1 1 A 42 42 ARG N N 42 124.179 124.714 -0.535 1
1 436 . 3 1 1 A 43 43 GLU H H 43 8.234 8.889 -0.655 1
1 437 . 3 1 1 A 43 43 GLU HA H 43 4.890 4.783 0.107 1
1 442 . 3 1 1 A 43 43 GLU C C 43 176.929 175.925 1.004 1
1 443 . 3 1 1 A 43 43 GLU CA C 43 54.846 54.667 0.179 1
1 444 . 3 1 1 A 43 43 GLU CB C 43 31.599 32.768 -1.169 1
1 446 . 3 1 1 A 43 43 GLU N N 43 124.103 121.010 3.093 1
1 447 . 3 1 1 A 44 44 SER H H 44 9.033 8.942 0.091 1
1 448 . 3 1 1 A 44 44 SER HA H 44 3.957 4.246 -0.289 1
1 451 . 3 1 1 A 44 44 SER C C 44 175.005 173.887 1.118 1
1 452 . 3 1 1 A 44 44 SER CA C 44 59.393 59.164 0.229 1
1 453 . 3 1 1 A 44 44 SER CB C 44 63.619 63.640 -0.021 1
1 454 . 3 1 1 A 44 44 SER N N 44 124.316 122.818 1.498 1
1 455 . 3 1 1 A 45 45 HIS H H 45 8.461 8.751 -0.290 1
1 456 . 3 1 1 A 45 45 HIS HA H 45 4.132 4.337 -0.205 1
1 460 . 3 1 1 A 45 45 HIS C C 45 176.480 177.972 -1.492 1
1 461 . 3 1 1 A 45 45 HIS CA C 45 58.887 59.294 -0.407 1
1 462 . 3 1 1 A 45 45 HIS CB C 45 30.180 30.461 -0.281 1
1 464 . 3 1 1 A 45 45 HIS N N 45 127.694 123.941 3.753 1
1 465 . 3 1 1 A 46 46 GLY H H 46 8.513 8.276 0.237 1
1 466 . 3 1 1 A 46 46 GLY HA2 H 46 3.827 3.915 -0.088 1
1 467 . 3 1 1 A 46 46 GLY HA3 H 46 3.827 3.922 -0.095 1
1 468 . 3 1 1 A 46 46 GLY C C 46 173.630 174.429 -0.799 1
1 469 . 3 1 1 A 46 46 GLY CA C 46 45.188 46.699 -1.511 1
1 470 . 3 1 1 A 46 46 GLY N N 46 110.761 106.607 4.154 1
1 471 . 3 1 1 A 47 47 LYS H H 47 7.216 7.736 -0.520 1
1 472 . 3 1 1 A 47 47 LYS HA H 47 4.540 4.672 -0.132 1
1 481 . 3 1 1 A 47 47 LYS CA C 47 53.475 52.878 0.597 1
1 482 . 3 1 1 A 47 47 LYS CB C 47 33.325 33.834 -0.509 1
1 486 . 3 1 1 A 47 47 LYS N N 47 121.356 120.244 1.112 1
1 487 . 3 1 1 A 48 48 PRO HA H 48 4.181 4.297 -0.116 1
1 494 . 3 1 1 A 48 48 PRO C C 48 178.920 177.688 1.232 1
1 495 . 3 1 1 A 48 48 PRO CA C 48 63.239 63.629 -0.390 1
1 496 . 3 1 1 A 48 48 PRO CB C 48 31.523 31.318 0.205 1
1 499 . 3 1 1 A 49 49 GLY H H 49 9.752 8.685 1.067 1
1 500 . 3 1 1 A 49 49 GLY HA2 H 49 4.053 3.884 0.169 1
1 501 . 3 1 1 A 49 49 GLY HA3 H 49 3.374 3.929 -0.555 1
1 502 . 3 1 1 A 49 49 GLY C C 49 172.093 173.808 -1.715 1
1 503 . 3 1 1 A 49 49 GLY CA C 49 45.041 45.285 -0.244 1
1 504 . 3 1 1 A 49 49 GLY N N 49 112.415 112.402 0.013 1
1 505 . 3 1 1 A 50 50 GLU H H 50 7.623 7.673 -0.050 1
1 506 . 3 1 1 A 50 50 GLU HA H 50 4.537 4.584 -0.047 1
1 511 . 3 1 1 A 50 50 GLU C C 50 173.297 175.223 -1.926 1
1 512 . 3 1 1 A 50 50 GLU CA C 50 55.174 55.748 -0.574 1
1 513 . 3 1 1 A 50 50 GLU CB C 50 31.651 30.141 1.510 1
1 515 . 3 1 1 A 50 50 GLU N N 50 121.600 121.752 -0.152 1
1 516 . 3 1 1 A 51 51 TYR H H 51 9.452 9.227 0.225 1
1 517 . 3 1 1 A 51 51 TYR HA H 51 5.382 5.371 0.011 1
1 524 . 3 1 1 A 51 51 TYR C C 51 174.387 175.876 -1.489 1
1 525 . 3 1 1 A 51 51 TYR CA C 51 57.592 58.151 -0.559 1
1 526 . 3 1 1 A 51 51 TYR CB C 51 41.820 40.033 1.787 1
1 531 . 3 1 1 A 51 51 TYR N N 51 125.790 127.107 -1.317 1
1 532 . 3 1 1 A 52 52 VAL H H 52 9.471 9.354 0.117 1
1 533 . 3 1 1 A 52 52 VAL HA H 52 4.840 4.921 -0.081 1
1 541 . 3 1 1 A 52 52 VAL C C 52 174.947 174.779 0.168 1
1 542 . 3 1 1 A 52 52 VAL CA C 52 60.991 61.177 -0.186 1
1 543 . 3 1 1 A 52 52 VAL CB C 52 36.829 34.668 2.161 1
1 546 . 3 1 1 A 52 52 VAL N N 52 120.617 123.342 -2.725 1
1 547 . 3 1 1 A 53 53 LEU H H 53 9.457 9.384 0.073 1
1 548 . 3 1 1 A 53 53 LEU HA H 53 5.294 5.224 0.070 1
1 558 . 3 1 1 A 53 53 LEU C C 53 175.024 175.650 -0.626 1
1 559 . 3 1 1 A 53 53 LEU CA C 53 53.904 54.398 -0.494 1
1 560 . 3 1 1 A 53 53 LEU CB C 53 44.756 44.040 0.716 1
1 564 . 3 1 1 A 53 53 LEU N N 53 127.725 131.287 -3.562 1
1 565 . 3 1 1 A 54 54 SER H H 54 9.461 9.543 -0.082 1
1 566 . 3 1 1 A 54 54 SER HA H 54 5.691 5.425 0.266 1
1 569 . 3 1 1 A 54 54 SER C C 54 172.227 172.976 -0.749 1
1 570 . 3 1 1 A 54 54 SER CA C 54 58.551 56.768 1.783 1
1 571 . 3 1 1 A 54 54 SER CB C 54 65.738 64.967 0.771 1
1 572 . 3 1 1 A 54 54 SER N N 54 127.178 122.653 4.525 1
1 573 . 3 1 1 A 55 55 VAL H H 55 9.049 9.022 0.027 1
1 574 . 3 1 1 A 55 55 VAL HA H 55 5.691 5.320 0.371 1
1 582 . 3 1 1 A 55 55 VAL C C 55 173.959 172.867 1.092 1
1 583 . 3 1 1 A 55 55 VAL CA C 55 58.398 59.854 -1.456 1
1 584 . 3 1 1 A 55 55 VAL CB C 55 36.262 36.014 0.248 1
1 587 . 3 1 1 A 55 55 VAL N N 55 120.619 126.681 -6.062 1
1 588 . 3 1 1 A 56 56 TYR H H 56 8.629 9.326 -0.697 1
1 589 . 3 1 1 A 56 56 TYR HA H 56 4.951 4.952 -0.001 1
1 596 . 3 1 1 A 56 56 TYR C C 56 175.224 174.299 0.925 1
1 597 . 3 1 1 A 56 56 TYR CA C 56 56.684 56.473 0.211 1
1 598 . 3 1 1 A 56 56 TYR CB C 56 39.646 39.139 0.507 1
1 603 . 3 1 1 A 56 56 TYR N N 56 127.444 129.934 -2.490 1
1 604 . 3 1 1 A 57 57 SER H H 57 8.869 8.856 0.013 1
1 605 . 3 1 1 A 57 57 SER HA H 57 4.739 4.985 -0.246 1
1 608 . 3 1 1 A 57 57 SER C C 57 174.492 173.521 0.971 1
1 609 . 3 1 1 A 57 57 SER CA C 57 57.591 56.727 0.864 1
1 610 . 3 1 1 A 57 57 SER CB C 57 64.281 66.204 -1.923 1
1 611 . 3 1 1 A 57 57 SER N N 57 122.165 123.075 -0.910 1
1 612 . 3 1 1 A 58 58 ASP H H 58 10.446 9.423 1.023 1
1 613 . 3 1 1 A 58 58 ASP HA H 58 4.382 4.271 0.111 1
1 616 . 3 1 1 A 58 58 ASP C C 58 176.398 175.255 1.143 1
1 617 . 3 1 1 A 58 58 ASP CA C 58 55.215 54.991 0.224 1
1 618 . 3 1 1 A 58 58 ASP CB C 58 39.513 39.709 -0.196 1
1 619 . 3 1 1 A 58 58 ASP N N 58 132.098 127.860 4.238 1
1 620 . 3 1 1 A 59 59 GLY H H 59 7.861 8.398 -0.537 1
1 621 . 3 1 1 A 59 59 GLY HA2 H 59 3.817 3.788 0.029 1
1 622 . 3 1 1 A 59 59 GLY HA3 H 59 4.086 3.822 0.264 1
1 623 . 3 1 1 A 59 59 GLY C C 59 173.111 173.434 -0.323 1
1 624 . 3 1 1 A 59 59 GLY CA C 59 45.486 45.268 0.218 1
1 625 . 3 1 1 A 59 59 GLY N N 59 102.674 104.601 -1.927 1
1 626 . 3 1 1 A 60 60 GLN H H 60 7.137 7.724 -0.587 1
1 627 . 3 1 1 A 60 60 GLN HA H 60 4.455 4.522 -0.067 1
1 634 . 3 1 1 A 60 60 GLN C C 60 173.549 174.562 -1.013 1
1 635 . 3 1 1 A 60 60 GLN CA C 60 53.388 53.361 0.027 1
1 636 . 3 1 1 A 60 60 GLN CB C 60 32.373 31.561 0.812 1
1 638 . 3 1 1 A 60 60 GLN N N 60 116.206 118.892 -2.686 1
1 640 . 3 1 1 A 61 61 ARG H H 61 8.589 8.284 0.305 1
1 641 . 3 1 1 A 61 61 ARG HA H 61 4.740 4.416 0.324 1
1 649 . 3 1 1 A 61 61 ARG C C 61 174.458 174.553 -0.095 1
1 650 . 3 1 1 A 61 61 ARG CA C 61 57.116 55.475 1.641 1
1 651 . 3 1 1 A 61 61 ARG CB C 61 29.615 30.567 -0.952 1
1 654 . 3 1 1 A 61 61 ARG N N 61 120.467 121.451 -0.984 1
1 656 . 3 1 1 A 62 62 ARG H H 62 8.867 8.815 0.052 1
1 657 . 3 1 1 A 62 62 ARG HA H 62 4.297 4.250 0.047 1
1 665 . 3 1 1 A 62 62 ARG C C 62 173.485 175.700 -2.215 1
1 666 . 3 1 1 A 62 62 ARG CA C 62 53.355 55.412 -2.057 1
1 667 . 3 1 1 A 62 62 ARG CB C 62 33.028 31.044 1.984 1
1 670 . 3 1 1 A 62 62 ARG N N 62 122.641 124.598 -1.957 1
1 672 . 3 1 1 A 63 63 HIS H H 63 7.997 8.419 -0.422 1
1 673 . 3 1 1 A 63 63 HIS HA H 63 5.427 5.314 0.113 1
1 678 . 3 1 1 A 63 63 HIS C C 63 174.946 173.879 1.067 1
1 679 . 3 1 1 A 63 63 HIS CA C 63 54.689 53.920 0.769 1
1 680 . 3 1 1 A 63 63 HIS CB C 63 33.008 32.043 0.965 1
1 683 . 3 1 1 A 63 63 HIS N N 63 119.064 119.754 -0.690 1
1 684 . 3 1 1 A 64 64 PHE H H 64 9.880 9.480 0.400 1
1 685 . 3 1 1 A 64 64 PHE HA H 64 4.824 5.023 -0.199 1
1 693 . 3 1 1 A 64 64 PHE C C 64 174.882 175.046 -0.164 1
1 694 . 3 1 1 A 64 64 PHE CA C 64 56.489 56.491 -0.002 1
1 695 . 3 1 1 A 64 64 PHE CB C 64 41.405 40.894 0.511 1
1 701 . 3 1 1 A 64 64 PHE N N 64 123.961 122.178 1.783 1
1 702 . 3 1 1 A 65 65 ILE H H 65 8.982 9.222 -0.240 1
1 703 . 3 1 1 A 65 65 ILE HA H 65 4.273 4.635 -0.362 1
1 713 . 3 1 1 A 65 65 ILE C C 65 176.556 175.887 0.669 1
1 714 . 3 1 1 A 65 65 ILE CA C 65 62.649 61.030 1.619 1
1 715 . 3 1 1 A 65 65 ILE CB C 65 38.296 38.390 -0.094 1
1 719 . 3 1 1 A 65 65 ILE N N 65 126.601 124.362 2.239 1
1 720 . 3 1 1 A 66 66 ILE H H 66 8.947 8.905 0.042 1
1 721 . 3 1 1 A 66 66 ILE HA H 66 3.780 4.373 -0.593 1
1 731 . 3 1 1 A 66 66 ILE C C 66 175.721 175.414 0.307 1
1 732 . 3 1 1 A 66 66 ILE CA C 66 62.960 60.761 2.199 1
1 733 . 3 1 1 A 66 66 ILE CB C 66 37.209 38.288 -1.079 1
1 737 . 3 1 1 A 66 66 ILE N N 66 130.139 129.376 0.763 1
1 738 . 3 1 1 A 67 67 GLN H H 67 8.410 9.035 -0.625 1
1 739 . 3 1 1 A 67 67 GLN HA H 67 4.422 4.862 -0.440 1
1 746 . 3 1 1 A 67 67 GLN C C 67 174.347 173.978 0.369 1
1 747 . 3 1 1 A 67 67 GLN CA C 67 55.867 55.261 0.606 1
1 748 . 3 1 1 A 67 67 GLN CB C 67 29.950 29.815 0.135 1
1 750 . 3 1 1 A 67 67 GLN N N 67 128.872 127.114 1.758 1
1 752 . 3 1 1 A 68 68 TYR H H 68 8.619 9.019 -0.400 1
1 753 . 3 1 1 A 68 68 TYR HA H 68 5.300 4.735 0.565 1
1 760 . 3 1 1 A 68 68 TYR C C 68 174.695 174.259 0.436 1
1 761 . 3 1 1 A 68 68 TYR CA C 68 55.579 56.366 -0.787 1
1 762 . 3 1 1 A 68 68 TYR CB C 68 39.479 38.551 0.928 1
1 767 . 3 1 1 A 68 68 TYR N N 68 124.772 126.210 -1.438 1
1 768 . 3 1 1 A 69 69 VAL H H 69 8.539 8.566 -0.027 1
1 769 . 3 1 1 A 69 69 VAL HA H 69 4.046 4.389 -0.343 1
1 777 . 3 1 1 A 69 69 VAL C C 69 175.010 175.009 0.001 1
1 778 . 3 1 1 A 69 69 VAL CA C 69 60.611 60.553 0.058 1
1 779 . 3 1 1 A 69 69 VAL CB C 69 35.358 34.429 0.929 1
1 782 . 3 1 1 A 69 69 VAL N N 69 126.652 126.816 -0.164 1
1 783 . 3 1 1 A 70 70 ASP H H 70 9.089 9.294 -0.205 1
1 784 . 3 1 1 A 70 70 ASP HA H 70 4.025 4.217 -0.192 1
1 787 . 3 1 1 A 70 70 ASP C C 70 174.813 175.119 -0.306 1
1 788 . 3 1 1 A 70 70 ASP CA C 70 55.623 55.462 0.161 1
1 789 . 3 1 1 A 70 70 ASP CB C 70 39.081 39.244 -0.163 1
1 790 . 3 1 1 A 70 70 ASP N N 70 128.327 127.284 1.043 1
1 791 . 3 1 1 A 71 71 ASN H H 71 8.128 8.092 0.036 1
1 792 . 3 1 1 A 71 71 ASN HA H 71 3.597 3.495 0.102 1
1 797 . 3 1 1 A 71 71 ASN C C 71 173.250 173.498 -0.248 1
1 798 . 3 1 1 A 71 71 ASN CA C 71 54.728 54.287 0.441 1
1 799 . 3 1 1 A 71 71 ASN CB C 71 37.601 37.060 0.541 1
1 800 . 3 1 1 A 71 71 ASN N N 71 107.230 108.222 -0.992 1
1 802 . 3 1 1 A 72 72 MET H H 72 7.256 7.197 0.059 1
1 803 . 3 1 1 A 72 72 MET HA H 72 4.740 4.915 -0.175 1
1 808 . 3 1 1 A 72 72 MET C C 72 173.780 174.141 -0.361 1
1 809 . 3 1 1 A 72 72 MET CA C 72 53.703 54.324 -0.621 1
1 810 . 3 1 1 A 72 72 MET CB C 72 36.570 37.115 -0.545 1
1 812 . 3 1 1 A 72 72 MET N N 72 117.117 116.473 0.644 1
1 813 . 3 1 1 A 73 73 TYR H H 73 9.430 9.385 0.045 1
1 814 . 3 1 1 A 73 73 TYR HA H 73 5.718 5.017 0.701 1
1 821 . 3 1 1 A 73 73 TYR C C 73 176.140 175.893 0.247 1
1 822 . 3 1 1 A 73 73 TYR CA C 73 57.290 57.974 -0.684 1
1 823 . 3 1 1 A 73 73 TYR CB C 73 40.013 39.089 0.924 1
1 828 . 3 1 1 A 73 73 TYR N N 73 119.856 122.598 -2.742 1
1 829 . 3 1 1 A 74 74 ARG H H 74 9.038 8.938 0.100 1
1 830 . 3 1 1 A 74 74 ARG HA H 74 4.867 4.957 -0.090 1
1 838 . 3 1 1 A 74 74 ARG C C 74 173.954 175.386 -1.432 1
1 839 . 3 1 1 A 74 74 ARG CA C 74 54.887 54.251 0.636 1
1 840 . 3 1 1 A 74 74 ARG CB C 74 34.484 33.929 0.555 1
1 843 . 3 1 1 A 74 74 ARG N N 74 117.344 122.199 -4.855 1
1 845 . 3 1 1 A 75 75 PHE H H 75 9.005 8.771 0.234 1
1 846 . 3 1 1 A 75 75 PHE HA H 75 5.046 4.674 0.372 1
1 854 . 3 1 1 A 75 75 PHE C C 75 176.186 176.434 -0.248 1
1 855 . 3 1 1 A 75 75 PHE CA C 75 59.658 59.670 -0.012 1
1 856 . 3 1 1 A 75 75 PHE CB C 75 39.356 40.242 -0.886 1
1 862 . 3 1 1 A 75 75 PHE N N 75 117.865 120.228 -2.363 1
1 863 . 3 1 1 A 76 76 GLU H H 76 8.213 8.361 -0.148 1
1 864 . 3 1 1 A 76 76 GLU HA H 76 4.586 4.688 -0.102 1
1 869 . 3 1 1 A 76 76 GLU C C 76 175.238 178.574 -3.336 1
1 870 . 3 1 1 A 76 76 GLU CA C 76 55.994 57.991 -1.997 1
1 871 . 3 1 1 A 76 76 GLU CB C 76 31.805 31.594 0.211 1
1 873 . 3 1 1 A 76 76 GLU N N 76 116.834 119.552 -2.718 1
1 874 . 3 1 1 A 77 77 GLY H H 77 8.692 8.081 0.611 1
1 875 . 3 1 1 A 77 77 GLY HA2 H 77 4.166 3.939 0.227 1
1 876 . 3 1 1 A 77 77 GLY HA3 H 77 4.015 3.943 0.072 1
1 877 . 3 1 1 A 77 77 GLY C C 77 173.784 173.771 0.013 1
1 878 . 3 1 1 A 77 77 GLY CA C 77 45.505 44.875 0.630 1
1 879 . 3 1 1 A 77 77 GLY N N 77 111.937 108.200 3.737 1
1 880 . 3 1 1 A 78 78 THR H H 78 8.332 8.122 0.210 1
1 881 . 3 1 1 A 78 78 THR HA H 78 3.900 4.427 -0.527 1
1 886 . 3 1 1 A 78 78 THR C C 78 173.591 174.131 -0.540 1
1 887 . 3 1 1 A 78 78 THR CA C 78 63.653 62.001 1.652 1
1 888 . 3 1 1 A 78 78 THR CB C 78 69.649 69.534 0.115 1
1 890 . 3 1 1 A 78 78 THR N N 78 120.765 116.889 3.876 1
1 891 . 3 1 1 A 79 79 GLY H H 79 8.038 8.270 -0.232 1
1 892 . 3 1 1 A 79 79 GLY HA2 H 79 4.748 4.349 0.399 1
1 893 . 3 1 1 A 79 79 GLY HA3 H 79 3.546 4.423 -0.877 1
1 894 . 3 1 1 A 79 79 GLY C C 79 172.580 171.628 0.952 1
1 895 . 3 1 1 A 79 79 GLY CA C 79 44.661 45.931 -1.270 1
1 896 . 3 1 1 A 79 79 GLY N N 79 109.887 111.152 -1.265 1
1 897 . 3 1 1 A 80 80 PHE H H 80 9.064 8.588 0.476 1
1 898 . 3 1 1 A 80 80 PHE HA H 80 4.886 4.995 -0.109 1
1 906 . 3 1 1 A 80 80 PHE C C 80 176.507 176.304 0.203 1
1 907 . 3 1 1 A 80 80 PHE CA C 80 57.257 56.848 0.409 1
1 908 . 3 1 1 A 80 80 PHE CB C 80 44.655 42.450 2.205 1
1 914 . 3 1 1 A 80 80 PHE N N 80 116.862 119.930 -3.068 1
1 915 . 3 1 1 A 81 81 SER H H 81 9.413 8.880 0.533 1
1 916 . 3 1 1 A 81 81 SER HA H 81 4.622 4.663 -0.041 1
1 919 . 3 1 1 A 81 81 SER C C 81 173.735 174.533 -0.798 1
1 920 . 3 1 1 A 81 81 SER CA C 81 61.410 60.294 1.116 1
1 921 . 3 1 1 A 81 81 SER CB C 81 64.165 63.723 0.442 1
1 922 . 3 1 1 A 81 81 SER N N 81 116.467 116.562 -0.095 1
1 923 . 3 1 1 A 82 82 ASN H H 82 7.688 7.958 -0.270 1
1 924 . 3 1 1 A 82 82 ASN HA H 82 4.952 5.172 -0.220 1
1 929 . 3 1 1 A 82 82 ASN C C 82 173.303 175.451 -2.148 1
1 930 . 3 1 1 A 82 82 ASN CA C 82 52.086 52.140 -0.054 1
1 931 . 3 1 1 A 82 82 ASN CB C 82 41.258 40.826 0.432 1
1 932 . 3 1 1 A 82 82 ASN N N 82 113.355 117.976 -4.621 1
1 934 . 3 1 1 A 83 83 ILE H H 83 8.858 8.632 0.226 1
1 935 . 3 1 1 A 83 83 ILE HA H 83 3.571 3.605 -0.034 1
1 945 . 3 1 1 A 83 83 ILE CA C 83 66.416 65.155 1.261 1
1 946 . 3 1 1 A 83 83 ILE CB C 83 35.074 34.483 0.591 1
1 950 . 3 1 1 A 83 83 ILE N N 83 118.908 124.183 -5.275 1
1 951 . 3 1 1 A 84 84 PRO HA H 84 4.411 4.651 -0.240 1
1 958 . 3 1 1 A 84 84 PRO C C 84 177.616 179.554 -1.938 1
1 959 . 3 1 1 A 84 84 PRO CA C 84 67.525 66.627 0.898 1
1 960 . 3 1 1 A 84 84 PRO CB C 84 31.029 30.864 0.165 1
1 963 . 3 1 1 A 85 85 GLN H H 85 8.405 8.290 0.115 1
1 964 . 3 1 1 A 85 85 GLN HA H 85 3.874 3.971 -0.097 1
1 971 . 3 1 1 A 85 85 GLN C C 85 178.213 178.123 0.090 1
1 972 . 3 1 1 A 85 85 GLN CA C 85 59.495 58.738 0.757 1
1 973 . 3 1 1 A 85 85 GLN CB C 85 29.270 28.142 1.128 1
1 975 . 3 1 1 A 85 85 GLN N N 85 115.597 117.279 -1.682 1
1 977 . 3 1 1 A 86 86 LEU H H 86 7.136 7.971 -0.835 1
1 978 . 3 1 1 A 86 86 LEU HA H 86 3.589 3.762 -0.173 1
1 988 . 3 1 1 A 86 86 LEU C C 86 177.728 178.468 -0.740 1
1 989 . 3 1 1 A 86 86 LEU CA C 86 58.136 58.358 -0.222 1
1 990 . 3 1 1 A 86 86 LEU CB C 86 42.290 41.748 0.542 1
1 994 . 3 1 1 A 86 86 LEU N N 86 121.840 121.963 -0.123 1
1 995 . 3 1 1 A 87 87 ILE H H 87 8.323 7.820 0.503 1
1 996 . 3 1 1 A 87 87 ILE HA H 87 3.415 3.345 0.070 1
1 1006 . 3 1 1 A 87 87 ILE C C 87 178.064 177.686 0.378 1
1 1007 . 3 1 1 A 87 87 ILE CA C 87 61.458 65.320 -3.862 1
1 1008 . 3 1 1 A 87 87 ILE CB C 87 34.561 37.112 -2.551 1
1 1012 . 3 1 1 A 87 87 ILE N N 87 118.117 119.422 -1.305 1
1 1013 . 3 1 1 A 88 88 ASP H H 88 8.805 8.424 0.381 1
1 1014 . 3 1 1 A 88 88 ASP HA H 88 4.548 4.262 0.286 1
1 1017 . 3 1 1 A 88 88 ASP C C 88 179.265 178.120 1.145 1
1 1018 . 3 1 1 A 88 88 ASP CA C 88 58.099 57.353 0.746 1
1 1019 . 3 1 1 A 88 88 ASP CB C 88 42.166 41.879 0.287 1
1 1020 . 3 1 1 A 88 88 ASP N N 88 119.143 120.583 -1.440 1
1 1021 . 3 1 1 A 89 89 HIS H H 89 8.113 7.943 0.170 1
1 1022 . 3 1 1 A 89 89 HIS HA H 89 4.225 4.376 -0.151 1
1 1026 . 3 1 1 A 89 89 HIS C C 89 179.261 177.147 2.114 1
1 1027 . 3 1 1 A 89 89 HIS CA C 89 60.647 58.998 1.649 1
1 1028 . 3 1 1 A 89 89 HIS CB C 89 30.801 29.581 1.220 1
1 1030 . 3 1 1 A 89 89 HIS N N 89 119.595 118.932 0.663 1
1 1031 . 3 1 1 A 90 90 HIS H H 90 7.685 7.883 -0.198 1
1 1032 . 3 1 1 A 90 90 HIS HA H 90 3.628 4.028 -0.400 1
1 1036 . 3 1 1 A 90 90 HIS C C 90 178.454 177.488 0.966 1
1 1037 . 3 1 1 A 90 90 HIS CA C 90 61.797 60.412 1.385 1
1 1038 . 3 1 1 A 90 90 HIS CB C 90 28.165 30.372 -2.207 1
1 1040 . 3 1 1 A 90 90 HIS N N 90 120.061 117.742 2.319 1
1 1041 . 3 1 1 A 91 91 TYR H H 91 9.394 8.241 1.153 1
1 1042 . 3 1 1 A 91 91 TYR HA H 91 4.238 3.892 0.346 1
1 1049 . 3 1 1 A 91 91 TYR C C 91 176.443 177.499 -1.056 1
1 1050 . 3 1 1 A 91 91 TYR CA C 91 60.669 61.721 -1.052 1
1 1051 . 3 1 1 A 91 91 TYR CB C 91 39.169 38.962 0.207 1
1 1056 . 3 1 1 A 91 91 TYR N N 91 123.532 119.982 3.550 1
1 1057 . 3 1 1 A 92 92 THR H H 92 8.774 8.505 0.269 1
1 1058 . 3 1 1 A 92 92 THR HA H 92 3.866 4.060 -0.194 1
1 1063 . 3 1 1 A 92 92 THR C C 92 177.050 176.256 0.794 1
1 1064 . 3 1 1 A 92 92 THR CA C 92 65.240 65.403 -0.163 1
1 1065 . 3 1 1 A 92 92 THR CB C 92 69.298 67.954 1.344 1
1 1067 . 3 1 1 A 92 92 THR N N 92 112.000 112.729 -0.729 1
1 1068 . 3 1 1 A 93 93 THR H H 93 7.617 7.647 -0.030 1
1 1069 . 3 1 1 A 93 93 THR HA H 93 4.133 4.096 0.037 1
1 1074 . 3 1 1 A 93 93 THR C C 93 176.234 174.769 1.465 1
1 1075 . 3 1 1 A 93 93 THR CA C 93 63.527 62.362 1.165 1
1 1076 . 3 1 1 A 93 93 THR CB C 93 71.234 69.591 1.643 1
1 1078 . 3 1 1 A 93 93 THR N N 93 109.883 113.079 -3.196 1
1 1079 . 3 1 1 A 94 94 LYS H H 94 7.210 7.726 -0.516 1
1 1080 . 3 1 1 A 94 94 LYS HA H 94 3.830 3.751 0.079 1
1 1089 . 3 1 1 A 94 94 LYS C C 94 174.331 175.038 -0.707 1
1 1090 . 3 1 1 A 94 94 LYS CA C 94 56.776 57.334 -0.558 1
1 1091 . 3 1 1 A 94 94 LYS CB C 94 28.095 30.976 -2.881 1
1 1095 . 3 1 1 A 94 94 LYS N N 94 112.818 121.227 -8.409 1
1 1096 . 3 1 1 A 95 95 GLN H H 95 7.439 7.526 -0.087 1
1 1097 . 3 1 1 A 95 95 GLN HA H 95 4.216 4.534 -0.318 1
1 1104 . 3 1 1 A 95 95 GLN C C 95 179.087 175.630 3.457 1
1 1105 . 3 1 1 A 95 95 GLN CA C 95 56.378 54.637 1.741 1
1 1106 . 3 1 1 A 95 95 GLN CB C 95 28.542 29.954 -1.412 1
1 1108 . 3 1 1 A 95 95 GLN N N 95 117.860 118.873 -1.013 1
1 1110 . 3 1 1 A 96 96 VAL H H 96 8.520 8.468 0.052 1
1 1111 . 3 1 1 A 96 96 VAL HA H 96 4.297 4.461 -0.164 1
1 1119 . 3 1 1 A 96 96 VAL C C 96 177.329 176.760 0.569 1
1 1120 . 3 1 1 A 96 96 VAL CA C 96 61.196 61.948 -0.752 1
1 1121 . 3 1 1 A 96 96 VAL CB C 96 32.735 32.968 -0.233 1
1 1124 . 3 1 1 A 96 96 VAL N N 96 124.208 119.130 5.078 1
1 1125 . 3 1 1 A 97 97 ILE H H 97 8.491 8.468 0.023 1
1 1126 . 3 1 1 A 97 97 ILE HA H 97 2.995 3.425 -0.430 1
1 1136 . 3 1 1 A 97 97 ILE CA C 97 62.066 63.465 -1.399 1
1 1137 . 3 1 1 A 97 97 ILE CB C 97 36.117 37.441 -1.324 1
1 1141 . 3 1 1 A 97 97 ILE N N 97 119.561 125.279 -5.718 1
1 1142 . 3 1 1 A 98 98 THR HA H 98 4.460 4.705 -0.245 1
1 1147 . 3 1 1 A 98 98 THR C C 98 174.335 174.846 -0.511 1
1 1148 . 3 1 1 A 98 98 THR CA C 98 58.244 59.828 -1.584 1
1 1149 . 3 1 1 A 98 98 THR CB C 98 73.056 71.816 1.240 1
1 1151 . 3 1 1 A 99 99 LYS H H 99 9.761 9.054 0.707 1
1 1152 . 3 1 1 A 99 99 LYS HA H 99 3.911 3.998 -0.087 1
1 1161 . 3 1 1 A 99 99 LYS C C 99 179.594 178.540 1.054 1
1 1162 . 3 1 1 A 99 99 LYS CA C 99 59.661 59.861 -0.200 1
1 1163 . 3 1 1 A 99 99 LYS CB C 99 31.978 32.052 -0.074 1
1 1167 . 3 1 1 A 99 99 LYS N N 99 125.750 122.678 3.072 1
1 1168 . 3 1 1 A 100 100 LYS H H 100 8.910 8.082 0.828 1
1 1169 . 3 1 1 A 100 100 LYS HA H 100 4.024 4.055 -0.031 1
1 1178 . 3 1 1 A 100 100 LYS C C 100 178.060 178.637 -0.577 1
1 1179 . 3 1 1 A 100 100 LYS CA C 100 58.642 59.485 -0.843 1
1 1180 . 3 1 1 A 100 100 LYS CB C 100 32.750 32.253 0.497 1
1 1184 . 3 1 1 A 100 100 LYS N N 100 117.112 120.574 -3.462 1
1 1185 . 3 1 1 A 101 101 SER H H 101 7.721 7.881 -0.160 1
1 1186 . 3 1 1 A 101 101 SER HA H 101 4.282 4.548 -0.266 1
1 1189 . 3 1 1 A 101 101 SER C C 101 176.403 175.529 0.874 1
1 1190 . 3 1 1 A 101 101 SER CA C 101 60.442 59.142 1.300 1
1 1191 . 3 1 1 A 101 101 SER CB C 101 63.775 64.497 -0.722 1
1 1192 . 3 1 1 A 101 101 SER N N 101 112.069 111.479 0.590 1
1 1193 . 3 1 1 A 102 102 GLY H H 102 8.038 8.375 -0.337 1
1 1194 . 3 1 1 A 102 102 GLY HA2 H 102 4.024 3.902 0.122 1
1 1195 . 3 1 1 A 102 102 GLY HA3 H 102 3.713 3.915 -0.202 1
1 1196 . 3 1 1 A 102 102 GLY C C 102 173.991 174.507 -0.516 1
1 1197 . 3 1 1 A 102 102 GLY CA C 102 46.458 45.294 1.164 1
1 1198 . 3 1 1 A 102 102 GLY N N 102 111.144 110.542 0.602 1
1 1199 . 3 1 1 A 103 103 VAL H H 103 7.155 7.462 -0.307 1
1 1200 . 3 1 1 A 103 103 VAL HA H 103 3.652 3.999 -0.347 1
1 1208 . 3 1 1 A 103 103 VAL C C 103 173.805 175.419 -1.614 1
1 1209 . 3 1 1 A 103 103 VAL CA C 103 64.310 62.723 1.587 1
1 1210 . 3 1 1 A 103 103 VAL CB C 103 32.254 31.954 0.300 1
1 1213 . 3 1 1 A 103 103 VAL N N 103 119.836 122.245 -2.409 1
1 1214 . 3 1 1 A 104 104 VAL H H 104 7.653 8.970 -1.317 1
1 1215 . 3 1 1 A 104 104 VAL HA H 104 4.048 4.657 -0.609 1
1 1223 . 3 1 1 A 104 104 VAL C C 104 175.708 174.139 1.569 1
1 1224 . 3 1 1 A 104 104 VAL CA C 104 60.275 60.667 -0.392 1
1 1225 . 3 1 1 A 104 104 VAL CB C 104 35.112 34.973 0.139 1
1 1228 . 3 1 1 A 104 104 VAL N N 104 125.859 127.538 -1.679 1
1 1229 . 3 1 1 A 105 105 LEU H H 105 8.616 8.342 0.274 1
1 1230 . 3 1 1 A 105 105 LEU HA H 105 3.905 4.792 -0.887 1
1 1240 . 3 1 1 A 105 105 LEU C C 105 175.380 175.830 -0.450 1
1 1241 . 3 1 1 A 105 105 LEU CA C 105 54.471 53.696 0.775 1
1 1242 . 3 1 1 A 105 105 LEU CB C 105 39.821 42.685 -2.864 1
1 1246 . 3 1 1 A 105 105 LEU N N 105 123.839 126.399 -2.560 1
1 1247 . 3 1 1 A 106 106 LEU H H 106 8.894 8.614 0.280 1
1 1248 . 3 1 1 A 106 106 LEU HA H 106 4.839 5.018 -0.179 1
1 1258 . 3 1 1 A 106 106 LEU C C 106 176.930 176.436 0.494 1
1 1259 . 3 1 1 A 106 106 LEU CA C 106 56.288 53.270 3.018 1
1 1260 . 3 1 1 A 106 106 LEU CB C 106 45.237 45.507 -0.270 1
1 1264 . 3 1 1 A 106 106 LEU N N 106 120.590 121.592 -1.002 1
1 1265 . 3 1 1 A 107 107 ASN H H 107 8.124 9.034 -0.910 1
1 1266 . 3 1 1 A 107 107 ASN HA H 107 5.650 4.657 0.993 1
1 1271 . 3 1 1 A 107 107 ASN CA C 107 50.293 53.925 -3.632 1
1 1272 . 3 1 1 A 107 107 ASN CB C 107 41.223 36.200 5.023 1
1 1273 . 3 1 1 A 107 107 ASN N N 107 116.866 118.032 -1.166 1
1 1275 . 3 1 1 A 108 108 PRO HA H 108 2.926 3.836 -0.910 1
1 1282 . 3 1 1 A 108 108 PRO C C 108 176.671 175.537 1.134 1
1 1283 . 3 1 1 A 108 108 PRO CA C 108 60.804 62.444 -1.640 1
1 1284 . 3 1 1 A 108 108 PRO CB C 108 31.774 32.307 -0.533 1
1 1287 . 3 1 1 A 109 109 ILE H H 109 8.648 7.617 1.031 1
1 1288 . 3 1 1 A 109 109 ILE HA H 109 4.519 4.525 -0.006 1
1 1298 . 3 1 1 A 109 109 ILE CA C 109 55.070 58.283 -3.213 1
1 1299 . 3 1 1 A 109 109 ILE CB C 109 36.068 38.295 -2.227 1
1 1303 . 3 1 1 A 109 109 ILE N N 109 128.817 123.044 5.773 1
1 1304 . 3 1 1 A 110 110 PRO HA H 110 4.587 4.425 0.162 1
1 1311 . 3 1 1 A 110 110 PRO C C 110 177.013 176.625 0.388 1
1 1312 . 3 1 1 A 110 110 PRO CA C 110 61.850 63.012 -1.162 1
1 1313 . 3 1 1 A 110 110 PRO CB C 110 32.507 31.655 0.852 1
1 1316 . 3 1 1 A 111 111 LYS H H 111 8.038 8.086 -0.048 1
1 1317 . 3 1 1 A 111 111 LYS HA H 111 3.553 2.956 0.597 1
1 1326 . 3 1 1 A 111 111 LYS C C 111 176.123 175.286 0.837 1
1 1327 . 3 1 1 A 111 111 LYS CA C 111 56.220 55.501 0.719 1
1 1328 . 3 1 1 A 111 111 LYS CB C 111 32.373 32.597 -0.224 1
1 1332 . 3 1 1 A 111 111 LYS N N 111 120.147 118.447 1.700 1
1 1333 . 3 1 1 A 112 112 ASP H H 112 8.463 8.502 -0.039 1
1 1334 . 3 1 1 A 112 112 ASP HA H 112 4.523 4.870 -0.347 1
1 1337 . 3 1 1 A 112 112 ASP C C 112 175.986 175.914 0.072 1
1 1338 . 3 1 1 A 112 112 ASP CA C 112 54.256 53.137 1.119 1
1 1339 . 3 1 1 A 112 112 ASP CB C 112 41.563 42.869 -1.306 1
1 1340 . 3 1 1 A 112 112 ASP N N 112 121.863 120.856 1.007 1
1 1341 . 3 1 1 A 113 113 LYS H H 113 8.059 8.436 -0.377 1
1 1342 . 3 1 1 A 113 113 LYS HA H 113 4.136 4.371 -0.235 1
1 1351 . 3 1 1 A 113 113 LYS C C 113 176.010 175.709 0.301 1
1 1352 . 3 1 1 A 113 113 LYS CA C 113 56.253 55.850 0.403 1
1 1353 . 3 1 1 A 113 113 LYS CB C 113 32.754 32.416 0.338 1
1 1357 . 3 1 1 A 113 113 LYS N N 113 121.725 120.719 1.006 1
1 1358 . 3 1 1 A 114 114 LYS H H 114 8.225 7.243 0.982 1
1 1359 . 3 1 1 A 114 114 LYS HA H 114 4.169 3.606 0.563 1
1 1368 . 3 1 1 A 114 114 LYS C C 114 176.198 176.114 0.084 1
1 1369 . 3 1 1 A 114 114 LYS CA C 114 56.413 56.225 0.188 1
1 1370 . 3 1 1 A 114 114 LYS CB C 114 32.725 33.255 -0.530 1
1 1374 . 3 1 1 A 114 114 LYS N N 114 121.857 122.016 -0.159 1
1 1375 . 3 1 1 A 115 115 TRP H H 115 8.078 8.201 -0.123 1
1 1376 . 3 1 1 A 115 115 TRP HA H 115 4.709 4.819 -0.110 1
1 1385 . 3 1 1 A 115 115 TRP C C 115 175.119 175.603 -0.484 1
1 1386 . 3 1 1 A 115 115 TRP CA C 115 56.856 56.131 0.725 1
1 1387 . 3 1 1 A 115 115 TRP CB C 115 29.474 27.245 2.229 1
1 1393 . 3 1 1 A 115 115 TRP N N 115 122.068 126.588 -4.520 1
1 1 . 4 1 1 A 10 10 HIS HA H 10 4.616 4.727 -0.111 1
1 4 . 4 1 1 A 10 10 HIS C C 10 174.981 173.373 1.608 1
1 5 . 4 1 1 A 10 10 HIS CA C 10 56.555 56.218 0.337 1
1 6 . 4 1 1 A 10 10 HIS CB C 10 30.231 32.666 -2.435 1
1 7 . 4 1 1 A 11 11 MET H H 11 8.103 7.801 0.302 1
1 8 . 4 1 1 A 11 11 MET HA H 11 4.439 4.221 0.218 1
1 13 . 4 1 1 A 11 11 MET C C 11 175.888 176.227 -0.339 1
1 14 . 4 1 1 A 11 11 MET CA C 11 55.090 55.476 -0.386 1
1 15 . 4 1 1 A 11 11 MET CB C 11 33.121 32.672 0.449 1
1 17 . 4 1 1 A 11 11 MET N N 11 120.743 122.122 -1.379 1
1 18 . 4 1 1 A 12 12 LYS H H 12 8.065 8.437 -0.372 1
1 19 . 4 1 1 A 12 12 LYS HA H 12 4.407 4.764 -0.357 1
1 28 . 4 1 1 A 12 12 LYS CA C 12 54.894 53.752 1.142 1
1 29 . 4 1 1 A 12 12 LYS CB C 12 31.863 32.290 -0.427 1
1 33 . 4 1 1 A 12 12 LYS N N 12 123.187 122.683 0.504 1
1 34 . 4 1 1 A 13 13 PRO HA H 13 4.347 4.509 -0.162 1
1 41 . 4 1 1 A 13 13 PRO C C 13 176.891 177.264 -0.373 1
1 42 . 4 1 1 A 13 13 PRO CA C 13 62.542 62.267 0.275 1
1 43 . 4 1 1 A 13 13 PRO CB C 13 32.663 33.382 -0.719 1
1 46 . 4 1 1 A 14 14 LEU H H 14 8.339 8.780 -0.441 1
1 47 . 4 1 1 A 14 14 LEU HA H 14 3.373 3.792 -0.419 1
1 57 . 4 1 1 A 14 14 LEU C C 14 176.683 178.107 -1.424 1
1 58 . 4 1 1 A 14 14 LEU CA C 14 58.555 57.550 1.005 1
1 59 . 4 1 1 A 14 14 LEU CB C 14 41.828 40.948 0.880 1
1 63 . 4 1 1 A 14 14 LEU N N 14 123.191 123.338 -0.147 1
1 64 . 4 1 1 A 15 15 ALA H H 15 8.175 7.813 0.362 1
1 65 . 4 1 1 A 15 15 ALA HA H 15 3.983 4.162 -0.179 1
1 69 . 4 1 1 A 15 15 ALA C C 15 178.697 178.450 0.247 1
1 70 . 4 1 1 A 15 15 ALA CA C 15 54.164 54.385 -0.221 1
1 71 . 4 1 1 A 15 15 ALA CB C 15 18.771 18.209 0.562 1
1 72 . 4 1 1 A 15 15 ALA N N 15 113.594 119.753 -6.159 1
1 73 . 4 1 1 A 16 16 GLU H H 16 7.458 7.654 -0.196 1
1 74 . 4 1 1 A 16 16 GLU HA H 16 4.266 4.344 -0.078 1
1 79 . 4 1 1 A 16 16 GLU C C 16 176.510 176.448 0.062 1
1 80 . 4 1 1 A 16 16 GLU CA C 16 55.196 56.419 -1.223 1
1 81 . 4 1 1 A 16 16 GLU CB C 16 30.907 29.886 1.021 1
1 83 . 4 1 1 A 16 16 GLU N N 16 113.348 115.120 -1.772 1
1 84 . 4 1 1 A 17 17 GLN H H 17 7.501 7.070 0.431 1
1 85 . 4 1 1 A 17 17 GLN HA H 17 3.683 4.031 -0.348 1
1 92 . 4 1 1 A 17 17 GLN C C 17 178.053 175.818 2.235 1
1 93 . 4 1 1 A 17 17 GLN CA C 17 54.606 55.232 -0.626 1
1 94 . 4 1 1 A 17 17 GLN CB C 17 25.758 28.169 -2.411 1
1 96 . 4 1 1 A 17 17 GLN N N 17 119.411 119.745 -0.334 1
1 98 . 4 1 1 A 18 18 ASP H H 18 8.949 8.447 0.502 1
1 99 . 4 1 1 A 18 18 ASP HA H 18 4.184 4.140 0.044 1
1 102 . 4 1 1 A 18 18 ASP C C 18 175.263 177.779 -2.516 1
1 103 . 4 1 1 A 18 18 ASP CA C 18 57.275 56.786 0.489 1
1 104 . 4 1 1 A 18 18 ASP CB C 18 40.620 40.167 0.453 1
1 105 . 4 1 1 A 18 18 ASP N N 18 124.676 123.120 1.556 1
1 106 . 4 1 1 A 19 19 TRP H H 19 6.068 7.144 -1.076 1
1 107 . 4 1 1 A 19 19 TRP HA H 19 5.045 4.607 0.438 1
1 116 . 4 1 1 A 19 19 TRP C C 19 175.902 176.015 -0.113 1
1 117 . 4 1 1 A 19 19 TRP CA C 19 53.542 57.385 -3.843 1
1 118 . 4 1 1 A 19 19 TRP CB C 19 29.179 29.227 -0.048 1
1 124 . 4 1 1 A 19 19 TRP N N 19 107.757 117.373 -9.616 1
1 126 . 4 1 1 A 20 20 TYR H H 20 7.430 7.541 -0.111 1
1 127 . 4 1 1 A 20 20 TYR HA H 20 5.601 5.294 0.307 1
1 132 . 4 1 1 A 20 20 TYR C C 20 175.498 175.392 0.106 1
1 133 . 4 1 1 A 20 20 TYR CA C 20 56.967 57.053 -0.086 1
1 134 . 4 1 1 A 20 20 TYR CB C 20 39.083 39.224 -0.141 1
1 137 . 4 1 1 A 20 20 TYR N N 20 123.173 121.484 1.689 1
1 138 . 4 1 1 A 21 21 HIS H H 21 8.934 8.641 0.293 1
1 139 . 4 1 1 A 21 21 HIS HA H 21 4.295 4.506 -0.211 1
1 144 . 4 1 1 A 21 21 HIS C C 21 175.177 174.958 0.219 1
1 145 . 4 1 1 A 21 21 HIS CA C 21 56.572 56.136 0.436 1
1 146 . 4 1 1 A 21 21 HIS CB C 21 33.365 30.811 2.554 1
1 149 . 4 1 1 A 21 21 HIS N N 21 125.732 127.077 -1.345 1
1 150 . 4 1 1 A 22 22 GLY H H 22 5.280 6.613 -1.333 1
1 151 . 4 1 1 A 22 22 GLY HA2 H 22 3.905 3.656 0.249 1
1 152 . 4 1 1 A 22 22 GLY HA3 H 22 3.585 3.842 -0.257 1
1 153 . 4 1 1 A 22 22 GLY C C 22 174.411 173.652 0.759 1
1 154 . 4 1 1 A 22 22 GLY CA C 22 46.402 44.298 2.104 1
1 155 . 4 1 1 A 22 22 GLY N N 22 104.568 106.604 -2.036 1
1 156 . 4 1 1 A 23 23 ALA H H 23 8.768 8.178 0.590 1
1 157 . 4 1 1 A 23 23 ALA HA H 23 5.171 4.692 0.479 1
1 161 . 4 1 1 A 23 23 ALA C C 23 177.180 176.499 0.681 1
1 162 . 4 1 1 A 23 23 ALA CA C 23 51.153 51.399 -0.246 1
1 163 . 4 1 1 A 23 23 ALA CB C 23 16.999 17.985 -0.986 1
1 164 . 4 1 1 A 23 23 ALA N N 23 130.297 123.328 6.969 1
1 165 . 4 1 1 A 24 24 ILE H H 24 7.267 7.982 -0.715 1
1 166 . 4 1 1 A 24 24 ILE HA H 24 4.460 4.853 -0.393 1
1 176 . 4 1 1 A 24 24 ILE CA C 24 58.529 57.496 1.033 1
1 177 . 4 1 1 A 24 24 ILE CB C 24 38.763 39.287 -0.524 1
1 181 . 4 1 1 A 24 24 ILE N N 24 118.903 118.143 0.760 1
1 182 . 4 1 1 A 25 25 PRO HA H 25 4.224 4.475 -0.251 1
1 189 . 4 1 1 A 25 25 PRO C C 25 176.918 177.551 -0.633 1
1 190 . 4 1 1 A 25 25 PRO CA C 25 62.907 62.507 0.400 1
1 191 . 4 1 1 A 25 25 PRO CB C 25 32.671 32.474 0.197 1
1 194 . 4 1 1 A 26 26 ARG H H 26 8.781 9.143 -0.362 1
1 195 . 4 1 1 A 26 26 ARG HA H 26 3.472 3.872 -0.400 1
1 202 . 4 1 1 A 26 26 ARG C C 26 178.112 177.908 0.204 1
1 203 . 4 1 1 A 26 26 ARG CA C 26 60.863 59.450 1.413 1
1 204 . 4 1 1 A 26 26 ARG CB C 26 30.314 29.889 0.425 1
1 207 . 4 1 1 A 26 26 ARG N N 26 124.635 121.118 3.517 1
1 208 . 4 1 1 A 27 27 ILE H H 27 8.540 8.106 0.434 1
1 209 . 4 1 1 A 27 27 ILE HA H 27 3.787 3.666 0.121 1
1 219 . 4 1 1 A 27 27 ILE C C 27 177.390 177.484 -0.094 1
1 220 . 4 1 1 A 27 27 ILE CA C 27 64.329 64.790 -0.461 1
1 221 . 4 1 1 A 27 27 ILE CB C 27 37.413 37.937 -0.524 1
1 225 . 4 1 1 A 27 27 ILE N N 27 115.859 120.132 -4.273 1
1 226 . 4 1 1 A 28 28 GLU H H 28 6.953 8.549 -1.596 1
1 227 . 4 1 1 A 28 28 GLU HA H 28 4.067 4.008 0.059 1
1 232 . 4 1 1 A 28 28 GLU C C 28 179.006 179.316 -0.310 1
1 233 . 4 1 1 A 28 28 GLU CA C 28 58.985 59.504 -0.519 1
1 234 . 4 1 1 A 28 28 GLU CB C 28 29.316 29.024 0.292 1
1 236 . 4 1 1 A 28 28 GLU N N 28 120.554 119.276 1.278 1
1 237 . 4 1 1 A 29 29 ALA H H 29 7.999 7.659 0.340 1
1 238 . 4 1 1 A 29 29 ALA HA H 29 3.822 4.044 -0.222 1
1 242 . 4 1 1 A 29 29 ALA C C 29 178.809 179.884 -1.075 1
1 243 . 4 1 1 A 29 29 ALA CA C 29 54.698 54.856 -0.158 1
1 244 . 4 1 1 A 29 29 ALA CB C 29 18.059 18.476 -0.417 1
1 245 . 4 1 1 A 29 29 ALA N N 29 120.122 122.496 -2.374 1
1 246 . 4 1 1 A 30 30 GLN H H 30 8.168 7.892 0.276 1
1 247 . 4 1 1 A 30 30 GLN HA H 30 3.811 4.162 -0.351 1
1 254 . 4 1 1 A 30 30 GLN C C 30 177.578 178.156 -0.578 1
1 255 . 4 1 1 A 30 30 GLN CA C 30 59.731 58.562 1.169 1
1 256 . 4 1 1 A 30 30 GLN CB C 30 28.161 28.920 -0.759 1
1 258 . 4 1 1 A 30 30 GLN N N 30 112.109 115.875 -3.766 1
1 260 . 4 1 1 A 31 31 GLU H H 31 7.248 8.256 -1.008 1
1 261 . 4 1 1 A 31 31 GLU HA H 31 4.063 4.035 0.028 1
1 266 . 4 1 1 A 31 31 GLU C C 31 177.423 179.335 -1.912 1
1 267 . 4 1 1 A 31 31 GLU CA C 31 57.650 59.002 -1.352 1
1 268 . 4 1 1 A 31 31 GLU CB C 31 29.757 29.305 0.452 1
1 270 . 4 1 1 A 31 31 GLU N N 31 115.340 119.593 -4.253 1
1 271 . 4 1 1 A 32 32 LEU H H 32 7.169 7.889 -0.720 1
1 272 . 4 1 1 A 32 32 LEU HA H 32 4.087 4.025 0.062 1
1 282 . 4 1 1 A 32 32 LEU C C 32 175.850 177.153 -1.303 1
1 283 . 4 1 1 A 32 32 LEU CA C 32 55.580 57.275 -1.695 1
1 284 . 4 1 1 A 32 32 LEU CB C 32 42.910 41.236 1.674 1
1 288 . 4 1 1 A 32 32 LEU N N 32 116.367 116.866 -0.499 1
1 289 . 4 1 1 A 33 33 LEU H H 33 7.062 7.620 -0.558 1
1 290 . 4 1 1 A 33 33 LEU HA H 33 4.431 4.122 0.309 1
1 300 . 4 1 1 A 33 33 LEU C C 33 174.837 177.013 -2.176 1
1 301 . 4 1 1 A 33 33 LEU CA C 33 53.521 55.013 -1.492 1
1 302 . 4 1 1 A 33 33 LEU CB C 33 43.301 41.315 1.986 1
1 306 . 4 1 1 A 33 33 LEU N N 33 118.568 122.604 -4.036 1
1 307 . 4 1 1 A 34 34 LYS H H 34 8.749 8.650 0.099 1
1 308 . 4 1 1 A 34 34 LYS HA H 34 4.162 4.453 -0.291 1
1 317 . 4 1 1 A 34 34 LYS C C 34 174.378 175.682 -1.304 1
1 318 . 4 1 1 A 34 34 LYS CA C 34 56.575 56.338 0.237 1
1 319 . 4 1 1 A 34 34 LYS CB C 34 36.918 34.598 2.320 1
1 323 . 4 1 1 A 34 34 LYS N N 34 121.659 118.692 2.967 1
1 324 . 4 1 1 A 35 35 LYS H H 35 8.137 7.576 0.561 1
1 325 . 4 1 1 A 35 35 LYS HA H 35 4.011 4.932 -0.921 1
1 334 . 4 1 1 A 35 35 LYS C C 35 174.343 174.846 -0.503 1
1 335 . 4 1 1 A 35 35 LYS CA C 35 53.960 54.661 -0.701 1
1 336 . 4 1 1 A 35 35 LYS CB C 35 35.587 35.562 0.025 1
1 340 . 4 1 1 A 35 35 LYS N N 35 119.354 116.330 3.024 1
1 341 . 4 1 1 A 36 36 GLN H H 36 8.394 8.704 -0.310 1
1 342 . 4 1 1 A 36 36 GLN HA H 36 4.187 4.400 -0.213 1
1 349 . 4 1 1 A 36 36 GLN C C 36 177.012 176.827 0.185 1
1 350 . 4 1 1 A 36 36 GLN CA C 36 57.750 57.827 -0.077 1
1 351 . 4 1 1 A 36 36 GLN CB C 36 28.433 28.384 0.049 1
1 353 . 4 1 1 A 36 36 GLN N N 36 120.248 122.636 -2.388 1
1 355 . 4 1 1 A 37 37 GLY H H 37 9.597 9.334 0.263 1
1 356 . 4 1 1 A 37 37 GLY HA2 H 37 4.486 4.106 0.380 1
1 357 . 4 1 1 A 37 37 GLY HA3 H 37 3.926 4.109 -0.183 1
1 358 . 4 1 1 A 37 37 GLY C C 37 176.285 174.255 2.030 1
1 359 . 4 1 1 A 37 37 GLY CA C 37 46.146 45.200 0.946 1
1 360 . 4 1 1 A 37 37 GLY N N 37 116.637 115.278 1.359 1
1 361 . 4 1 1 A 38 38 ASP H H 38 8.925 7.828 1.097 1
1 362 . 4 1 1 A 38 38 ASP HA H 38 5.697 4.688 1.009 1
1 365 . 4 1 1 A 38 38 ASP C C 38 176.181 175.761 0.420 1
1 366 . 4 1 1 A 38 38 ASP CA C 38 55.066 55.446 -0.380 1
1 367 . 4 1 1 A 38 38 ASP CB C 38 42.933 41.064 1.869 1
1 368 . 4 1 1 A 38 38 ASP N N 38 127.293 122.012 5.281 1
1 369 . 4 1 1 A 39 39 PHE H H 39 8.647 8.589 0.058 1
1 370 . 4 1 1 A 39 39 PHE HA H 39 6.025 5.964 0.061 1
1 378 . 4 1 1 A 39 39 PHE C C 39 170.948 173.051 -2.103 1
1 379 . 4 1 1 A 39 39 PHE CA C 39 56.376 56.079 0.297 1
1 380 . 4 1 1 A 39 39 PHE CB C 39 44.583 43.127 1.456 1
1 386 . 4 1 1 A 39 39 PHE N N 39 117.102 120.593 -3.491 1
1 387 . 4 1 1 A 40 40 LEU H H 40 9.186 9.143 0.043 1
1 388 . 4 1 1 A 40 40 LEU HA H 40 4.983 5.395 -0.412 1
1 398 . 4 1 1 A 40 40 LEU C C 40 174.787 174.642 0.145 1
1 399 . 4 1 1 A 40 40 LEU CA C 40 54.610 53.786 0.824 1
1 400 . 4 1 1 A 40 40 LEU CB C 40 44.330 46.006 -1.676 1
1 404 . 4 1 1 A 40 40 LEU N N 40 114.388 117.847 -3.459 1
1 405 . 4 1 1 A 41 41 VAL H H 41 9.390 9.348 0.042 1
1 406 . 4 1 1 A 41 41 VAL HA H 41 5.742 5.111 0.631 1
1 414 . 4 1 1 A 41 41 VAL C C 41 172.760 175.250 -2.490 1
1 415 . 4 1 1 A 41 41 VAL CA C 41 60.814 61.477 -0.663 1
1 416 . 4 1 1 A 41 41 VAL CB C 41 34.908 33.683 1.225 1
1 419 . 4 1 1 A 41 41 VAL N N 41 119.873 121.759 -1.886 1
1 420 . 4 1 1 A 42 42 ARG H H 42 9.598 9.264 0.334 1
1 421 . 4 1 1 A 42 42 ARG HA H 42 5.247 5.177 0.070 1
1 429 . 4 1 1 A 42 42 ARG C C 42 173.379 174.518 -1.139 1
1 430 . 4 1 1 A 42 42 ARG CA C 42 53.202 53.954 -0.752 1
1 431 . 4 1 1 A 42 42 ARG CB C 42 33.507 34.123 -0.616 1
1 434 . 4 1 1 A 42 42 ARG N N 42 124.179 124.853 -0.674 1
1 436 . 4 1 1 A 43 43 GLU H H 43 8.234 8.396 -0.162 1
1 437 . 4 1 1 A 43 43 GLU HA H 43 4.890 4.302 0.588 1
1 442 . 4 1 1 A 43 43 GLU C C 43 176.929 176.353 0.576 1
1 443 . 4 1 1 A 43 43 GLU CA C 43 54.846 55.344 -0.498 1
1 444 . 4 1 1 A 43 43 GLU CB C 43 31.599 30.826 0.773 1
1 446 . 4 1 1 A 43 43 GLU N N 43 124.103 123.582 0.521 1
1 447 . 4 1 1 A 44 44 SER H H 44 9.033 8.686 0.347 1
1 448 . 4 1 1 A 44 44 SER HA H 44 3.957 4.357 -0.400 1
1 451 . 4 1 1 A 44 44 SER C C 44 175.005 174.838 0.167 1
1 452 . 4 1 1 A 44 44 SER CA C 44 59.393 60.219 -0.826 1
1 453 . 4 1 1 A 44 44 SER CB C 44 63.619 63.062 0.557 1
1 454 . 4 1 1 A 44 44 SER N N 44 124.316 121.778 2.538 1
1 455 . 4 1 1 A 45 45 HIS H H 45 8.461 8.985 -0.524 1
1 456 . 4 1 1 A 45 45 HIS HA H 45 4.132 4.155 -0.023 1
1 460 . 4 1 1 A 45 45 HIS C C 45 176.480 176.798 -0.318 1
1 461 . 4 1 1 A 45 45 HIS CA C 45 58.887 59.483 -0.596 1
1 462 . 4 1 1 A 45 45 HIS CB C 45 30.180 30.142 0.038 1
1 464 . 4 1 1 A 45 45 HIS N N 45 127.694 126.091 1.603 1
1 465 . 4 1 1 A 46 46 GLY H H 46 8.513 8.160 0.353 1
1 466 . 4 1 1 A 46 46 GLY HA2 H 46 3.827 3.862 -0.035 1
1 467 . 4 1 1 A 46 46 GLY HA3 H 46 3.827 3.900 -0.073 1
1 468 . 4 1 1 A 46 46 GLY C C 46 173.630 173.763 -0.133 1
1 469 . 4 1 1 A 46 46 GLY CA C 46 45.188 45.358 -0.170 1
1 470 . 4 1 1 A 46 46 GLY N N 46 110.761 105.042 5.719 1
1 471 . 4 1 1 A 47 47 LYS H H 47 7.216 7.684 -0.468 1
1 472 . 4 1 1 A 47 47 LYS HA H 47 4.540 4.750 -0.210 1
1 481 . 4 1 1 A 47 47 LYS CA C 47 53.475 53.116 0.359 1
1 482 . 4 1 1 A 47 47 LYS CB C 47 33.325 33.750 -0.425 1
1 486 . 4 1 1 A 47 47 LYS N N 47 121.356 120.381 0.975 1
1 487 . 4 1 1 A 48 48 PRO HA H 48 4.181 4.238 -0.057 1
1 494 . 4 1 1 A 48 48 PRO C C 48 178.920 177.650 1.270 1
1 495 . 4 1 1 A 48 48 PRO CA C 48 63.239 63.686 -0.447 1
1 496 . 4 1 1 A 48 48 PRO CB C 48 31.523 31.299 0.224 1
1 499 . 4 1 1 A 49 49 GLY H H 49 9.752 8.677 1.075 1
1 500 . 4 1 1 A 49 49 GLY HA2 H 49 4.053 3.917 0.136 1
1 501 . 4 1 1 A 49 49 GLY HA3 H 49 3.374 3.993 -0.619 1
1 502 . 4 1 1 A 49 49 GLY C C 49 172.093 173.497 -1.404 1
1 503 . 4 1 1 A 49 49 GLY CA C 49 45.041 45.225 -0.184 1
1 504 . 4 1 1 A 49 49 GLY N N 49 112.415 112.745 -0.330 1
1 505 . 4 1 1 A 50 50 GLU H H 50 7.623 7.480 0.143 1
1 506 . 4 1 1 A 50 50 GLU HA H 50 4.537 4.881 -0.344 1
1 511 . 4 1 1 A 50 50 GLU C C 50 173.297 174.655 -1.358 1
1 512 . 4 1 1 A 50 50 GLU CA C 50 55.174 55.269 -0.095 1
1 513 . 4 1 1 A 50 50 GLU CB C 50 31.651 32.129 -0.478 1
1 515 . 4 1 1 A 50 50 GLU N N 50 121.600 121.128 0.472 1
1 516 . 4 1 1 A 51 51 TYR H H 51 9.452 9.283 0.169 1
1 517 . 4 1 1 A 51 51 TYR HA H 51 5.382 5.328 0.054 1
1 524 . 4 1 1 A 51 51 TYR C C 51 174.387 175.264 -0.877 1
1 525 . 4 1 1 A 51 51 TYR CA C 51 57.592 56.976 0.616 1
1 526 . 4 1 1 A 51 51 TYR CB C 51 41.820 41.565 0.255 1
1 531 . 4 1 1 A 51 51 TYR N N 51 125.790 126.898 -1.108 1
1 532 . 4 1 1 A 52 52 VAL H H 52 9.471 9.580 -0.109 1
1 533 . 4 1 1 A 52 52 VAL HA H 52 4.840 4.979 -0.139 1
1 541 . 4 1 1 A 52 52 VAL C C 52 174.947 174.602 0.345 1
1 542 . 4 1 1 A 52 52 VAL CA C 52 60.991 60.945 0.046 1
1 543 . 4 1 1 A 52 52 VAL CB C 52 36.829 34.629 2.200 1
1 546 . 4 1 1 A 52 52 VAL N N 52 120.617 121.771 -1.154 1
1 547 . 4 1 1 A 53 53 LEU H H 53 9.457 9.302 0.155 1
1 548 . 4 1 1 A 53 53 LEU HA H 53 5.294 5.098 0.196 1
1 558 . 4 1 1 A 53 53 LEU C C 53 175.024 175.618 -0.594 1
1 559 . 4 1 1 A 53 53 LEU CA C 53 53.904 54.688 -0.784 1
1 560 . 4 1 1 A 53 53 LEU CB C 53 44.756 44.370 0.386 1
1 564 . 4 1 1 A 53 53 LEU N N 53 127.725 131.199 -3.474 1
1 565 . 4 1 1 A 54 54 SER H H 54 9.461 9.504 -0.043 1
1 566 . 4 1 1 A 54 54 SER HA H 54 5.691 5.072 0.619 1
1 569 . 4 1 1 A 54 54 SER C C 54 172.227 172.891 -0.664 1
1 570 . 4 1 1 A 54 54 SER CA C 54 58.551 56.895 1.656 1
1 571 . 4 1 1 A 54 54 SER CB C 54 65.738 64.232 1.506 1
1 572 . 4 1 1 A 54 54 SER N N 54 127.178 122.828 4.350 1
1 573 . 4 1 1 A 55 55 VAL H H 55 9.049 9.041 0.008 1
1 574 . 4 1 1 A 55 55 VAL HA H 55 5.691 5.414 0.277 1
1 582 . 4 1 1 A 55 55 VAL C C 55 173.959 172.792 1.167 1
1 583 . 4 1 1 A 55 55 VAL CA C 55 58.398 59.557 -1.159 1
1 584 . 4 1 1 A 55 55 VAL CB C 55 36.262 35.330 0.932 1
1 587 . 4 1 1 A 55 55 VAL N N 55 120.619 127.954 -7.335 1
1 588 . 4 1 1 A 56 56 TYR H H 56 8.629 9.315 -0.686 1
1 589 . 4 1 1 A 56 56 TYR HA H 56 4.951 5.017 -0.066 1
1 596 . 4 1 1 A 56 56 TYR C C 56 175.224 174.672 0.552 1
1 597 . 4 1 1 A 56 56 TYR CA C 56 56.684 56.403 0.281 1
1 598 . 4 1 1 A 56 56 TYR CB C 56 39.646 39.555 0.091 1
1 603 . 4 1 1 A 56 56 TYR N N 56 127.444 130.476 -3.032 1
1 604 . 4 1 1 A 57 57 SER H H 57 8.869 8.740 0.129 1
1 605 . 4 1 1 A 57 57 SER HA H 57 4.739 4.690 0.049 1
1 608 . 4 1 1 A 57 57 SER C C 57 174.492 172.551 1.941 1
1 609 . 4 1 1 A 57 57 SER CA C 57 57.591 57.134 0.457 1
1 610 . 4 1 1 A 57 57 SER CB C 57 64.281 66.322 -2.041 1
1 611 . 4 1 1 A 57 57 SER N N 57 122.165 122.918 -0.753 1
1 612 . 4 1 1 A 58 58 ASP H H 58 10.446 9.177 1.269 1
1 613 . 4 1 1 A 58 58 ASP HA H 58 4.382 4.260 0.122 1
1 616 . 4 1 1 A 58 58 ASP C C 58 176.398 176.245 0.153 1
1 617 . 4 1 1 A 58 58 ASP CA C 58 55.215 55.185 0.030 1
1 618 . 4 1 1 A 58 58 ASP CB C 58 39.513 39.257 0.256 1
1 619 . 4 1 1 A 58 58 ASP N N 58 132.098 128.042 4.056 1
1 620 . 4 1 1 A 59 59 GLY H H 59 7.861 8.344 -0.483 1
1 621 . 4 1 1 A 59 59 GLY HA2 H 59 3.817 3.615 0.202 1
1 622 . 4 1 1 A 59 59 GLY HA3 H 59 4.086 3.794 0.292 1
1 623 . 4 1 1 A 59 59 GLY C C 59 173.111 173.700 -0.589 1
1 624 . 4 1 1 A 59 59 GLY CA C 59 45.486 45.569 -0.083 1
1 625 . 4 1 1 A 59 59 GLY N N 59 102.674 104.531 -1.857 1
1 626 . 4 1 1 A 60 60 GLN H H 60 7.137 7.479 -0.342 1
1 627 . 4 1 1 A 60 60 GLN HA H 60 4.455 4.795 -0.340 1
1 634 . 4 1 1 A 60 60 GLN C C 60 173.549 174.618 -1.069 1
1 635 . 4 1 1 A 60 60 GLN CA C 60 53.388 53.639 -0.251 1
1 636 . 4 1 1 A 60 60 GLN CB C 60 32.373 32.159 0.214 1
1 638 . 4 1 1 A 60 60 GLN N N 60 116.206 118.785 -2.579 1
1 640 . 4 1 1 A 61 61 ARG H H 61 8.589 8.469 0.120 1
1 641 . 4 1 1 A 61 61 ARG HA H 61 4.740 4.531 0.209 1
1 649 . 4 1 1 A 61 61 ARG C C 61 174.458 174.542 -0.084 1
1 650 . 4 1 1 A 61 61 ARG CA C 61 57.116 55.548 1.568 1
1 651 . 4 1 1 A 61 61 ARG CB C 61 29.615 30.748 -1.133 1
1 654 . 4 1 1 A 61 61 ARG N N 61 120.467 122.253 -1.786 1
1 656 . 4 1 1 A 62 62 ARG H H 62 8.867 8.809 0.058 1
1 657 . 4 1 1 A 62 62 ARG HA H 62 4.297 4.349 -0.052 1
1 665 . 4 1 1 A 62 62 ARG C C 62 173.485 175.469 -1.984 1
1 666 . 4 1 1 A 62 62 ARG CA C 62 53.355 55.305 -1.950 1
1 667 . 4 1 1 A 62 62 ARG CB C 62 33.028 30.940 2.088 1
1 670 . 4 1 1 A 62 62 ARG N N 62 122.641 124.701 -2.060 1
1 672 . 4 1 1 A 63 63 HIS H H 63 7.997 8.425 -0.428 1
1 673 . 4 1 1 A 63 63 HIS HA H 63 5.427 5.383 0.044 1
1 678 . 4 1 1 A 63 63 HIS C C 63 174.946 174.200 0.746 1
1 679 . 4 1 1 A 63 63 HIS CA C 63 54.689 53.546 1.143 1
1 680 . 4 1 1 A 63 63 HIS CB C 63 33.008 32.542 0.466 1
1 683 . 4 1 1 A 63 63 HIS N N 63 119.064 120.186 -1.122 1
1 684 . 4 1 1 A 64 64 PHE H H 64 9.880 9.073 0.807 1
1 685 . 4 1 1 A 64 64 PHE HA H 64 4.824 5.015 -0.191 1
1 693 . 4 1 1 A 64 64 PHE C C 64 174.882 175.360 -0.478 1
1 694 . 4 1 1 A 64 64 PHE CA C 64 56.489 56.272 0.217 1
1 695 . 4 1 1 A 64 64 PHE CB C 64 41.405 42.067 -0.662 1
1 701 . 4 1 1 A 64 64 PHE N N 64 123.961 121.665 2.296 1
1 702 . 4 1 1 A 65 65 ILE H H 65 8.982 9.133 -0.151 1
1 703 . 4 1 1 A 65 65 ILE HA H 65 4.273 4.626 -0.353 1
1 713 . 4 1 1 A 65 65 ILE C C 65 176.556 175.572 0.984 1
1 714 . 4 1 1 A 65 65 ILE CA C 65 62.649 61.072 1.577 1
1 715 . 4 1 1 A 65 65 ILE CB C 65 38.296 38.571 -0.275 1
1 719 . 4 1 1 A 65 65 ILE N N 65 126.601 123.842 2.759 1
1 720 . 4 1 1 A 66 66 ILE H H 66 8.947 9.273 -0.326 1
1 721 . 4 1 1 A 66 66 ILE HA H 66 3.780 4.393 -0.613 1
1 731 . 4 1 1 A 66 66 ILE C C 66 175.721 175.146 0.575 1
1 732 . 4 1 1 A 66 66 ILE CA C 66 62.960 60.426 2.534 1
1 733 . 4 1 1 A 66 66 ILE CB C 66 37.209 38.452 -1.243 1
1 737 . 4 1 1 A 66 66 ILE N N 66 130.139 128.767 1.372 1
1 738 . 4 1 1 A 67 67 GLN H H 67 8.410 9.087 -0.677 1
1 739 . 4 1 1 A 67 67 GLN HA H 67 4.422 4.830 -0.408 1
1 746 . 4 1 1 A 67 67 GLN C C 67 174.347 174.388 -0.041 1
1 747 . 4 1 1 A 67 67 GLN CA C 67 55.867 55.195 0.672 1
1 748 . 4 1 1 A 67 67 GLN CB C 67 29.950 29.890 0.060 1
1 750 . 4 1 1 A 67 67 GLN N N 67 128.872 126.962 1.910 1
1 752 . 4 1 1 A 68 68 TYR H H 68 8.619 9.041 -0.422 1
1 753 . 4 1 1 A 68 68 TYR HA H 68 5.300 4.625 0.675 1
1 760 . 4 1 1 A 68 68 TYR C C 68 174.695 174.217 0.478 1
1 761 . 4 1 1 A 68 68 TYR CA C 68 55.579 56.699 -1.120 1
1 762 . 4 1 1 A 68 68 TYR CB C 68 39.479 38.701 0.778 1
1 767 . 4 1 1 A 68 68 TYR N N 68 124.772 125.722 -0.950 1
1 768 . 4 1 1 A 69 69 VAL H H 69 8.539 8.742 -0.203 1
1 769 . 4 1 1 A 69 69 VAL HA H 69 4.046 4.272 -0.226 1
1 777 . 4 1 1 A 69 69 VAL C C 69 175.010 175.396 -0.386 1
1 778 . 4 1 1 A 69 69 VAL CA C 69 60.611 60.953 -0.342 1
1 779 . 4 1 1 A 69 69 VAL CB C 69 35.358 34.076 1.282 1
1 782 . 4 1 1 A 69 69 VAL N N 69 126.652 128.164 -1.512 1
1 783 . 4 1 1 A 70 70 ASP H H 70 9.089 9.279 -0.190 1
1 784 . 4 1 1 A 70 70 ASP HA H 70 4.025 4.134 -0.109 1
1 787 . 4 1 1 A 70 70 ASP C C 70 174.813 175.081 -0.268 1
1 788 . 4 1 1 A 70 70 ASP CA C 70 55.623 55.535 0.088 1
1 789 . 4 1 1 A 70 70 ASP CB C 70 39.081 38.879 0.202 1
1 790 . 4 1 1 A 70 70 ASP N N 70 128.327 129.125 -0.798 1
1 791 . 4 1 1 A 71 71 ASN H H 71 8.128 8.102 0.026 1
1 792 . 4 1 1 A 71 71 ASN HA H 71 3.597 4.119 -0.522 1
1 797 . 4 1 1 A 71 71 ASN C C 71 173.250 173.839 -0.589 1
1 798 . 4 1 1 A 71 71 ASN CA C 71 54.728 54.544 0.184 1
1 799 . 4 1 1 A 71 71 ASN CB C 71 37.601 36.907 0.694 1
1 800 . 4 1 1 A 71 71 ASN N N 71 107.230 107.411 -0.181 1
1 802 . 4 1 1 A 72 72 MET H H 72 7.256 7.501 -0.245 1
1 803 . 4 1 1 A 72 72 MET HA H 72 4.740 4.841 -0.101 1
1 808 . 4 1 1 A 72 72 MET C C 72 173.780 174.211 -0.431 1
1 809 . 4 1 1 A 72 72 MET CA C 72 53.703 54.175 -0.472 1
1 810 . 4 1 1 A 72 72 MET CB C 72 36.570 35.219 1.351 1
1 812 . 4 1 1 A 72 72 MET N N 72 117.117 117.655 -0.538 1
1 813 . 4 1 1 A 73 73 TYR H H 73 9.430 9.212 0.218 1
1 814 . 4 1 1 A 73 73 TYR HA H 73 5.718 5.154 0.564 1
1 821 . 4 1 1 A 73 73 TYR C C 73 176.140 175.851 0.289 1
1 822 . 4 1 1 A 73 73 TYR CA C 73 57.290 57.733 -0.443 1
1 823 . 4 1 1 A 73 73 TYR CB C 73 40.013 39.299 0.714 1
1 828 . 4 1 1 A 73 73 TYR N N 73 119.856 123.176 -3.320 1
1 829 . 4 1 1 A 74 74 ARG H H 74 9.038 8.897 0.141 1
1 830 . 4 1 1 A 74 74 ARG HA H 74 4.867 4.992 -0.125 1
1 838 . 4 1 1 A 74 74 ARG C C 74 173.954 175.694 -1.740 1
1 839 . 4 1 1 A 74 74 ARG CA C 74 54.887 54.451 0.436 1
1 840 . 4 1 1 A 74 74 ARG CB C 74 34.484 33.719 0.765 1
1 843 . 4 1 1 A 74 74 ARG N N 74 117.344 122.333 -4.989 1
1 845 . 4 1 1 A 75 75 PHE H H 75 9.005 9.049 -0.044 1
1 846 . 4 1 1 A 75 75 PHE HA H 75 5.046 4.490 0.556 1
1 854 . 4 1 1 A 75 75 PHE C C 75 176.186 177.135 -0.949 1
1 855 . 4 1 1 A 75 75 PHE CA C 75 59.658 60.157 -0.499 1
1 856 . 4 1 1 A 75 75 PHE CB C 75 39.356 39.932 -0.576 1
1 862 . 4 1 1 A 75 75 PHE N N 75 117.865 122.208 -4.343 1
1 863 . 4 1 1 A 76 76 GLU H H 76 8.213 8.212 0.001 1
1 864 . 4 1 1 A 76 76 GLU HA H 76 4.586 4.638 -0.052 1
1 869 . 4 1 1 A 76 76 GLU C C 76 175.238 177.759 -2.521 1
1 870 . 4 1 1 A 76 76 GLU CA C 76 55.994 56.900 -0.906 1
1 871 . 4 1 1 A 76 76 GLU CB C 76 31.805 31.713 0.092 1
1 873 . 4 1 1 A 76 76 GLU N N 76 116.834 114.704 2.130 1
1 874 . 4 1 1 A 77 77 GLY H H 77 8.692 8.010 0.682 1
1 875 . 4 1 1 A 77 77 GLY HA2 H 77 4.166 4.086 0.080 1
1 876 . 4 1 1 A 77 77 GLY HA3 H 77 4.015 4.090 -0.075 1
1 877 . 4 1 1 A 77 77 GLY C C 77 173.784 174.512 -0.728 1
1 878 . 4 1 1 A 77 77 GLY CA C 77 45.505 46.138 -0.633 1
1 879 . 4 1 1 A 77 77 GLY N N 77 111.937 108.492 3.445 1
1 880 . 4 1 1 A 78 78 THR H H 78 8.332 7.915 0.417 1
1 881 . 4 1 1 A 78 78 THR HA H 78 3.900 4.351 -0.451 1
1 886 . 4 1 1 A 78 78 THR C C 78 173.591 174.429 -0.838 1
1 887 . 4 1 1 A 78 78 THR CA C 78 63.653 62.947 0.706 1
1 888 . 4 1 1 A 78 78 THR CB C 78 69.649 69.193 0.456 1
1 890 . 4 1 1 A 78 78 THR N N 78 120.765 113.642 7.123 1
1 891 . 4 1 1 A 79 79 GLY H H 79 8.038 8.532 -0.494 1
1 892 . 4 1 1 A 79 79 GLY HA2 H 79 4.748 4.441 0.307 1
1 893 . 4 1 1 A 79 79 GLY HA3 H 79 3.546 4.567 -1.021 1
1 894 . 4 1 1 A 79 79 GLY C C 79 172.580 171.852 0.728 1
1 895 . 4 1 1 A 79 79 GLY CA C 79 44.661 44.450 0.211 1
1 896 . 4 1 1 A 79 79 GLY N N 79 109.887 113.557 -3.670 1
1 897 . 4 1 1 A 80 80 PHE H H 80 9.064 8.765 0.299 1
1 898 . 4 1 1 A 80 80 PHE HA H 80 4.886 5.039 -0.153 1
1 906 . 4 1 1 A 80 80 PHE C C 80 176.507 176.282 0.225 1
1 907 . 4 1 1 A 80 80 PHE CA C 80 57.257 56.762 0.495 1
1 908 . 4 1 1 A 80 80 PHE CB C 80 44.655 42.397 2.258 1
1 914 . 4 1 1 A 80 80 PHE N N 80 116.862 119.812 -2.950 1
1 915 . 4 1 1 A 81 81 SER H H 81 9.413 8.784 0.629 1
1 916 . 4 1 1 A 81 81 SER HA H 81 4.622 4.738 -0.116 1
1 919 . 4 1 1 A 81 81 SER C C 81 173.735 174.843 -1.108 1
1 920 . 4 1 1 A 81 81 SER CA C 81 61.410 61.429 -0.019 1
1 921 . 4 1 1 A 81 81 SER CB C 81 64.165 63.365 0.800 1
1 922 . 4 1 1 A 81 81 SER N N 81 116.467 116.922 -0.455 1
1 923 . 4 1 1 A 82 82 ASN H H 82 7.688 8.158 -0.470 1
1 924 . 4 1 1 A 82 82 ASN HA H 82 4.952 5.209 -0.257 1
1 929 . 4 1 1 A 82 82 ASN C C 82 173.303 175.483 -2.180 1
1 930 . 4 1 1 A 82 82 ASN CA C 82 52.086 52.173 -0.087 1
1 931 . 4 1 1 A 82 82 ASN CB C 82 41.258 40.819 0.439 1
1 932 . 4 1 1 A 82 82 ASN N N 82 113.355 117.310 -3.955 1
1 934 . 4 1 1 A 83 83 ILE H H 83 8.858 8.578 0.280 1
1 935 . 4 1 1 A 83 83 ILE HA H 83 3.571 3.638 -0.067 1
1 945 . 4 1 1 A 83 83 ILE CA C 83 66.416 65.249 1.167 1
1 946 . 4 1 1 A 83 83 ILE CB C 83 35.074 34.594 0.480 1
1 950 . 4 1 1 A 83 83 ILE N N 83 118.908 123.636 -4.728 1
1 951 . 4 1 1 A 84 84 PRO HA H 84 4.411 4.715 -0.304 1
1 958 . 4 1 1 A 84 84 PRO C C 84 177.616 179.637 -2.021 1
1 959 . 4 1 1 A 84 84 PRO CA C 84 67.525 66.694 0.831 1
1 960 . 4 1 1 A 84 84 PRO CB C 84 31.029 30.767 0.262 1
1 963 . 4 1 1 A 85 85 GLN H H 85 8.405 8.393 0.012 1
1 964 . 4 1 1 A 85 85 GLN HA H 85 3.874 4.029 -0.155 1
1 971 . 4 1 1 A 85 85 GLN C C 85 178.213 178.239 -0.026 1
1 972 . 4 1 1 A 85 85 GLN CA C 85 59.495 58.538 0.957 1
1 973 . 4 1 1 A 85 85 GLN CB C 85 29.270 28.209 1.061 1
1 975 . 4 1 1 A 85 85 GLN N N 85 115.597 117.337 -1.740 1
1 977 . 4 1 1 A 86 86 LEU H H 86 7.136 8.119 -0.983 1
1 978 . 4 1 1 A 86 86 LEU HA H 86 3.589 3.717 -0.128 1
1 988 . 4 1 1 A 86 86 LEU C C 86 177.728 178.335 -0.607 1
1 989 . 4 1 1 A 86 86 LEU CA C 86 58.136 58.365 -0.229 1
1 990 . 4 1 1 A 86 86 LEU CB C 86 42.290 41.812 0.478 1
1 994 . 4 1 1 A 86 86 LEU N N 86 121.840 121.824 0.016 1
1 995 . 4 1 1 A 87 87 ILE H H 87 8.323 7.621 0.702 1
1 996 . 4 1 1 A 87 87 ILE HA H 87 3.415 3.408 0.007 1
1 1006 . 4 1 1 A 87 87 ILE C C 87 178.064 177.684 0.380 1
1 1007 . 4 1 1 A 87 87 ILE CA C 87 61.458 65.268 -3.810 1
1 1008 . 4 1 1 A 87 87 ILE CB C 87 34.561 37.012 -2.451 1
1 1012 . 4 1 1 A 87 87 ILE N N 87 118.117 119.357 -1.240 1
1 1013 . 4 1 1 A 88 88 ASP H H 88 8.805 8.667 0.138 1
1 1014 . 4 1 1 A 88 88 ASP HA H 88 4.548 4.308 0.240 1
1 1017 . 4 1 1 A 88 88 ASP C C 88 179.265 178.470 0.795 1
1 1018 . 4 1 1 A 88 88 ASP CA C 88 58.099 57.312 0.787 1
1 1019 . 4 1 1 A 88 88 ASP CB C 88 42.166 41.932 0.234 1
1 1020 . 4 1 1 A 88 88 ASP N N 88 119.143 120.636 -1.493 1
1 1021 . 4 1 1 A 89 89 HIS H H 89 8.113 7.886 0.227 1
1 1022 . 4 1 1 A 89 89 HIS HA H 89 4.225 4.552 -0.327 1
1 1026 . 4 1 1 A 89 89 HIS C C 89 179.261 177.148 2.113 1
1 1027 . 4 1 1 A 89 89 HIS CA C 89 60.647 58.757 1.890 1
1 1028 . 4 1 1 A 89 89 HIS CB C 89 30.801 29.406 1.395 1
1 1030 . 4 1 1 A 89 89 HIS N N 89 119.595 118.975 0.620 1
1 1031 . 4 1 1 A 90 90 HIS H H 90 7.685 7.700 -0.015 1
1 1032 . 4 1 1 A 90 90 HIS HA H 90 3.628 4.083 -0.455 1
1 1036 . 4 1 1 A 90 90 HIS C C 90 178.454 177.557 0.897 1
1 1037 . 4 1 1 A 90 90 HIS CA C 90 61.797 60.229 1.568 1
1 1038 . 4 1 1 A 90 90 HIS CB C 90 28.165 30.056 -1.891 1
1 1040 . 4 1 1 A 90 90 HIS N N 90 120.061 117.629 2.432 1
1 1041 . 4 1 1 A 91 91 TYR H H 91 9.394 8.315 1.079 1
1 1042 . 4 1 1 A 91 91 TYR HA H 91 4.238 3.901 0.337 1
1 1049 . 4 1 1 A 91 91 TYR C C 91 176.443 177.523 -1.080 1
1 1050 . 4 1 1 A 91 91 TYR CA C 91 60.669 61.826 -1.157 1
1 1051 . 4 1 1 A 91 91 TYR CB C 91 39.169 39.069 0.100 1
1 1056 . 4 1 1 A 91 91 TYR N N 91 123.532 119.878 3.654 1
1 1057 . 4 1 1 A 92 92 THR H H 92 8.774 8.369 0.405 1
1 1058 . 4 1 1 A 92 92 THR HA H 92 3.866 4.035 -0.169 1
1 1063 . 4 1 1 A 92 92 THR C C 92 177.050 176.231 0.819 1
1 1064 . 4 1 1 A 92 92 THR CA C 92 65.240 65.278 -0.038 1
1 1065 . 4 1 1 A 92 92 THR CB C 92 69.298 68.009 1.289 1
1 1067 . 4 1 1 A 92 92 THR N N 92 112.000 112.831 -0.831 1
1 1068 . 4 1 1 A 93 93 THR H H 93 7.617 7.556 0.061 1
1 1069 . 4 1 1 A 93 93 THR HA H 93 4.133 4.117 0.016 1
1 1074 . 4 1 1 A 93 93 THR C C 93 176.234 174.788 1.446 1
1 1075 . 4 1 1 A 93 93 THR CA C 93 63.527 62.505 1.022 1
1 1076 . 4 1 1 A 93 93 THR CB C 93 71.234 69.826 1.408 1
1 1078 . 4 1 1 A 93 93 THR N N 93 109.883 112.396 -2.513 1
1 1079 . 4 1 1 A 94 94 LYS H H 94 7.210 7.645 -0.435 1
1 1080 . 4 1 1 A 94 94 LYS HA H 94 3.830 3.781 0.049 1
1 1089 . 4 1 1 A 94 94 LYS C C 94 174.331 175.131 -0.800 1
1 1090 . 4 1 1 A 94 94 LYS CA C 94 56.776 57.406 -0.630 1
1 1091 . 4 1 1 A 94 94 LYS CB C 94 28.095 31.041 -2.946 1
1 1095 . 4 1 1 A 94 94 LYS N N 94 112.818 121.250 -8.432 1
1 1096 . 4 1 1 A 95 95 GLN H H 95 7.439 7.504 -0.065 1
1 1097 . 4 1 1 A 95 95 GLN HA H 95 4.216 4.618 -0.402 1
1 1104 . 4 1 1 A 95 95 GLN C C 95 179.087 175.816 3.271 1
1 1105 . 4 1 1 A 95 95 GLN CA C 95 56.378 54.506 1.872 1
1 1106 . 4 1 1 A 95 95 GLN CB C 95 28.542 30.361 -1.819 1
1 1108 . 4 1 1 A 95 95 GLN N N 95 117.860 118.347 -0.487 1
1 1110 . 4 1 1 A 96 96 VAL H H 96 8.520 8.376 0.144 1
1 1111 . 4 1 1 A 96 96 VAL HA H 96 4.297 4.321 -0.024 1
1 1119 . 4 1 1 A 96 96 VAL C C 96 177.329 176.669 0.660 1
1 1120 . 4 1 1 A 96 96 VAL CA C 96 61.196 62.141 -0.945 1
1 1121 . 4 1 1 A 96 96 VAL CB C 96 32.735 33.014 -0.279 1
1 1124 . 4 1 1 A 96 96 VAL N N 96 124.208 120.092 4.116 1
1 1125 . 4 1 1 A 97 97 ILE H H 97 8.491 8.699 -0.208 1
1 1126 . 4 1 1 A 97 97 ILE HA H 97 2.995 3.526 -0.531 1
1 1136 . 4 1 1 A 97 97 ILE CA C 97 62.066 62.999 -0.933 1
1 1137 . 4 1 1 A 97 97 ILE CB C 97 36.117 37.866 -1.749 1
1 1141 . 4 1 1 A 97 97 ILE N N 97 119.561 124.699 -5.138 1
1 1142 . 4 1 1 A 98 98 THR HA H 98 4.460 4.490 -0.030 1
1 1147 . 4 1 1 A 98 98 THR C C 98 174.335 174.814 -0.479 1
1 1148 . 4 1 1 A 98 98 THR CA C 98 58.244 59.592 -1.348 1
1 1149 . 4 1 1 A 98 98 THR CB C 98 73.056 71.318 1.738 1
1 1151 . 4 1 1 A 99 99 LYS H H 99 9.761 9.005 0.756 1
1 1152 . 4 1 1 A 99 99 LYS HA H 99 3.911 3.994 -0.083 1
1 1161 . 4 1 1 A 99 99 LYS C C 99 179.594 178.227 1.367 1
1 1162 . 4 1 1 A 99 99 LYS CA C 99 59.661 59.188 0.473 1
1 1163 . 4 1 1 A 99 99 LYS CB C 99 31.978 31.945 0.033 1
1 1167 . 4 1 1 A 99 99 LYS N N 99 125.750 122.692 3.058 1
1 1168 . 4 1 1 A 100 100 LYS H H 100 8.910 8.373 0.537 1
1 1169 . 4 1 1 A 100 100 LYS HA H 100 4.024 4.104 -0.080 1
1 1178 . 4 1 1 A 100 100 LYS C C 100 178.060 177.612 0.448 1
1 1179 . 4 1 1 A 100 100 LYS CA C 100 58.642 58.848 -0.206 1
1 1180 . 4 1 1 A 100 100 LYS CB C 100 32.750 31.642 1.108 1
1 1184 . 4 1 1 A 100 100 LYS N N 100 117.112 118.559 -1.447 1
1 1185 . 4 1 1 A 101 101 SER H H 101 7.721 7.590 0.131 1
1 1186 . 4 1 1 A 101 101 SER HA H 101 4.282 4.609 -0.327 1
1 1189 . 4 1 1 A 101 101 SER C C 101 176.403 174.963 1.440 1
1 1190 . 4 1 1 A 101 101 SER CA C 101 60.442 58.774 1.668 1
1 1191 . 4 1 1 A 101 101 SER CB C 101 63.775 65.177 -1.402 1
1 1192 . 4 1 1 A 101 101 SER N N 101 112.069 114.596 -2.527 1
1 1193 . 4 1 1 A 102 102 GLY H H 102 8.038 8.477 -0.439 1
1 1194 . 4 1 1 A 102 102 GLY HA2 H 102 4.024 3.877 0.147 1
1 1195 . 4 1 1 A 102 102 GLY HA3 H 102 3.713 3.912 -0.199 1
1 1196 . 4 1 1 A 102 102 GLY C C 102 173.991 174.670 -0.679 1
1 1197 . 4 1 1 A 102 102 GLY CA C 102 46.458 46.578 -0.120 1
1 1198 . 4 1 1 A 102 102 GLY N N 102 111.144 109.323 1.821 1
1 1199 . 4 1 1 A 103 103 VAL H H 103 7.155 8.033 -0.878 1
1 1200 . 4 1 1 A 103 103 VAL HA H 103 3.652 3.983 -0.331 1
1 1208 . 4 1 1 A 103 103 VAL C C 103 173.805 175.140 -1.335 1
1 1209 . 4 1 1 A 103 103 VAL CA C 103 64.310 62.664 1.646 1
1 1210 . 4 1 1 A 103 103 VAL CB C 103 32.254 32.036 0.218 1
1 1213 . 4 1 1 A 103 103 VAL N N 103 119.836 120.753 -0.917 1
1 1214 . 4 1 1 A 104 104 VAL H H 104 7.653 8.987 -1.334 1
1 1215 . 4 1 1 A 104 104 VAL HA H 104 4.048 4.431 -0.383 1
1 1223 . 4 1 1 A 104 104 VAL C C 104 175.708 174.419 1.289 1
1 1224 . 4 1 1 A 104 104 VAL CA C 104 60.275 60.870 -0.595 1
1 1225 . 4 1 1 A 104 104 VAL CB C 104 35.112 34.295 0.817 1
1 1228 . 4 1 1 A 104 104 VAL N N 104 125.859 127.814 -1.955 1
1 1229 . 4 1 1 A 105 105 LEU H H 105 8.616 8.386 0.230 1
1 1230 . 4 1 1 A 105 105 LEU HA H 105 3.905 4.476 -0.571 1
1 1240 . 4 1 1 A 105 105 LEU C C 105 175.380 176.143 -0.763 1
1 1241 . 4 1 1 A 105 105 LEU CA C 105 54.471 53.798 0.673 1
1 1242 . 4 1 1 A 105 105 LEU CB C 105 39.821 41.474 -1.653 1
1 1246 . 4 1 1 A 105 105 LEU N N 105 123.839 126.512 -2.673 1
1 1247 . 4 1 1 A 106 106 LEU H H 106 8.894 8.580 0.314 1
1 1248 . 4 1 1 A 106 106 LEU HA H 106 4.839 5.111 -0.272 1
1 1258 . 4 1 1 A 106 106 LEU C C 106 176.930 176.393 0.537 1
1 1259 . 4 1 1 A 106 106 LEU CA C 106 56.288 53.300 2.988 1
1 1260 . 4 1 1 A 106 106 LEU CB C 106 45.237 45.505 -0.268 1
1 1264 . 4 1 1 A 106 106 LEU N N 106 120.590 121.713 -1.123 1
1 1265 . 4 1 1 A 107 107 ASN H H 107 8.124 9.131 -1.007 1
1 1266 . 4 1 1 A 107 107 ASN HA H 107 5.650 4.617 1.033 1
1 1271 . 4 1 1 A 107 107 ASN CA C 107 50.293 53.955 -3.662 1
1 1272 . 4 1 1 A 107 107 ASN CB C 107 41.223 36.188 5.035 1
1 1273 . 4 1 1 A 107 107 ASN N N 107 116.866 118.671 -1.805 1
1 1275 . 4 1 1 A 108 108 PRO HA H 108 2.926 3.845 -0.919 1
1 1282 . 4 1 1 A 108 108 PRO C C 108 176.671 175.526 1.145 1
1 1283 . 4 1 1 A 108 108 PRO CA C 108 60.804 62.287 -1.483 1
1 1284 . 4 1 1 A 108 108 PRO CB C 108 31.774 32.148 -0.374 1
1 1287 . 4 1 1 A 109 109 ILE H H 109 8.648 7.687 0.961 1
1 1288 . 4 1 1 A 109 109 ILE HA H 109 4.519 4.485 0.034 1
1 1298 . 4 1 1 A 109 109 ILE CA C 109 55.070 58.363 -3.293 1
1 1299 . 4 1 1 A 109 109 ILE CB C 109 36.068 38.310 -2.242 1
1 1303 . 4 1 1 A 109 109 ILE N N 109 128.817 123.090 5.727 1
1 1304 . 4 1 1 A 110 110 PRO HA H 110 4.587 4.825 -0.238 1
1 1311 . 4 1 1 A 110 110 PRO C C 110 177.013 176.106 0.907 1
1 1312 . 4 1 1 A 110 110 PRO CA C 110 61.850 62.279 -0.429 1
1 1313 . 4 1 1 A 110 110 PRO CB C 110 32.507 33.109 -0.602 1
1 1316 . 4 1 1 A 111 111 LYS H H 111 8.038 8.245 -0.207 1
1 1317 . 4 1 1 A 111 111 LYS HA H 111 3.553 4.968 -1.415 1
1 1326 . 4 1 1 A 111 111 LYS C C 111 176.123 175.037 1.086 1
1 1327 . 4 1 1 A 111 111 LYS CA C 111 56.220 54.111 2.109 1
1 1328 . 4 1 1 A 111 111 LYS CB C 111 32.373 35.169 -2.796 1
1 1332 . 4 1 1 A 111 111 LYS N N 111 120.147 116.378 3.769 1
1 1333 . 4 1 1 A 112 112 ASP H H 112 8.463 8.574 -0.111 1
1 1334 . 4 1 1 A 112 112 ASP HA H 112 4.523 4.784 -0.261 1
1 1337 . 4 1 1 A 112 112 ASP C C 112 175.986 176.061 -0.075 1
1 1338 . 4 1 1 A 112 112 ASP CA C 112 54.256 52.111 2.145 1
1 1339 . 4 1 1 A 112 112 ASP CB C 112 41.563 41.288 0.275 1
1 1340 . 4 1 1 A 112 112 ASP N N 112 121.863 122.133 -0.270 1
1 1341 . 4 1 1 A 113 113 LYS H H 113 8.059 8.374 -0.315 1
1 1342 . 4 1 1 A 113 113 LYS HA H 113 4.136 4.280 -0.144 1
1 1351 . 4 1 1 A 113 113 LYS C C 113 176.010 176.169 -0.159 1
1 1352 . 4 1 1 A 113 113 LYS CA C 113 56.253 55.217 1.036 1
1 1353 . 4 1 1 A 113 113 LYS CB C 113 32.754 32.953 -0.199 1
1 1357 . 4 1 1 A 113 113 LYS N N 113 121.725 117.688 4.037 1
1 1358 . 4 1 1 A 114 114 LYS H H 114 8.225 7.068 1.157 1
1 1359 . 4 1 1 A 114 114 LYS HA H 114 4.169 4.300 -0.131 1
1 1368 . 4 1 1 A 114 114 LYS C C 114 176.198 175.866 0.332 1
1 1369 . 4 1 1 A 114 114 LYS CA C 114 56.413 55.345 1.068 1
1 1370 . 4 1 1 A 114 114 LYS CB C 114 32.725 33.114 -0.389 1
1 1374 . 4 1 1 A 114 114 LYS N N 114 121.857 115.777 6.080 1
1 1375 . 4 1 1 A 115 115 TRP H H 115 8.078 8.448 -0.370 1
1 1376 . 4 1 1 A 115 115 TRP HA H 115 4.709 4.735 -0.026 1
1 1385 . 4 1 1 A 115 115 TRP C C 115 175.119 175.916 -0.797 1
1 1386 . 4 1 1 A 115 115 TRP CA C 115 56.856 56.604 0.252 1
1 1387 . 4 1 1 A 115 115 TRP CB C 115 29.474 29.929 -0.455 1
1 1393 . 4 1 1 A 115 115 TRP N N 115 122.068 121.847 0.221 1
1 1 . 5 1 1 A 10 10 HIS HA H 10 4.616 4.425 0.191 1
1 4 . 5 1 1 A 10 10 HIS C C 10 174.981 175.574 -0.593 1
1 5 . 5 1 1 A 10 10 HIS CA C 10 56.555 57.860 -1.305 1
1 6 . 5 1 1 A 10 10 HIS CB C 10 30.231 30.881 -0.650 1
1 7 . 5 1 1 A 11 11 MET H H 11 8.103 8.296 -0.193 1
1 8 . 5 1 1 A 11 11 MET HA H 11 4.439 4.475 -0.036 1
1 13 . 5 1 1 A 11 11 MET C C 11 175.888 175.354 0.534 1
1 14 . 5 1 1 A 11 11 MET CA C 11 55.090 54.813 0.277 1
1 15 . 5 1 1 A 11 11 MET CB C 11 33.121 33.907 -0.786 1
1 17 . 5 1 1 A 11 11 MET N N 11 120.743 124.278 -3.535 1
1 18 . 5 1 1 A 12 12 LYS H H 12 8.065 8.540 -0.475 1
1 19 . 5 1 1 A 12 12 LYS HA H 12 4.407 4.874 -0.467 1
1 28 . 5 1 1 A 12 12 LYS CA C 12 54.894 52.970 1.924 1
1 29 . 5 1 1 A 12 12 LYS CB C 12 31.863 35.138 -3.275 1
1 33 . 5 1 1 A 12 12 LYS N N 12 123.187 118.078 5.109 1
1 34 . 5 1 1 A 13 13 PRO HA H 13 4.347 4.475 -0.128 1
1 41 . 5 1 1 A 13 13 PRO C C 13 176.891 176.821 0.070 1
1 42 . 5 1 1 A 13 13 PRO CA C 13 62.542 62.194 0.348 1
1 43 . 5 1 1 A 13 13 PRO CB C 13 32.663 33.679 -1.016 1
1 46 . 5 1 1 A 14 14 LEU H H 14 8.339 8.730 -0.391 1
1 47 . 5 1 1 A 14 14 LEU HA H 14 3.373 3.759 -0.386 1
1 57 . 5 1 1 A 14 14 LEU C C 14 176.683 178.239 -1.556 1
1 58 . 5 1 1 A 14 14 LEU CA C 14 58.555 57.207 1.348 1
1 59 . 5 1 1 A 14 14 LEU CB C 14 41.828 40.907 0.921 1
1 63 . 5 1 1 A 14 14 LEU N N 14 123.191 122.922 0.269 1
1 64 . 5 1 1 A 15 15 ALA H H 15 8.175 7.800 0.375 1
1 65 . 5 1 1 A 15 15 ALA HA H 15 3.983 4.114 -0.131 1
1 69 . 5 1 1 A 15 15 ALA C C 15 178.697 178.452 0.245 1
1 70 . 5 1 1 A 15 15 ALA CA C 15 54.164 54.380 -0.216 1
1 71 . 5 1 1 A 15 15 ALA CB C 15 18.771 18.174 0.597 1
1 72 . 5 1 1 A 15 15 ALA N N 15 113.594 119.894 -6.300 1
1 73 . 5 1 1 A 16 16 GLU H H 16 7.458 7.464 -0.006 1
1 74 . 5 1 1 A 16 16 GLU HA H 16 4.266 4.341 -0.075 1
1 79 . 5 1 1 A 16 16 GLU C C 16 176.510 176.508 0.002 1
1 80 . 5 1 1 A 16 16 GLU CA C 16 55.196 56.407 -1.211 1
1 81 . 5 1 1 A 16 16 GLU CB C 16 30.907 29.757 1.150 1
1 83 . 5 1 1 A 16 16 GLU N N 16 113.348 114.980 -1.632 1
1 84 . 5 1 1 A 17 17 GLN H H 17 7.501 6.970 0.531 1
1 85 . 5 1 1 A 17 17 GLN HA H 17 3.683 4.028 -0.345 1
1 92 . 5 1 1 A 17 17 GLN C C 17 178.053 176.284 1.769 1
1 93 . 5 1 1 A 17 17 GLN CA C 17 54.606 54.926 -0.320 1
1 94 . 5 1 1 A 17 17 GLN CB C 17 25.758 28.324 -2.566 1
1 96 . 5 1 1 A 17 17 GLN N N 17 119.411 119.634 -0.223 1
1 98 . 5 1 1 A 18 18 ASP H H 18 8.949 8.642 0.307 1
1 99 . 5 1 1 A 18 18 ASP HA H 18 4.184 4.151 0.033 1
1 102 . 5 1 1 A 18 18 ASP C C 18 175.263 177.434 -2.171 1
1 103 . 5 1 1 A 18 18 ASP CA C 18 57.275 56.860 0.415 1
1 104 . 5 1 1 A 18 18 ASP CB C 18 40.620 39.647 0.973 1
1 105 . 5 1 1 A 18 18 ASP N N 18 124.676 122.799 1.877 1
1 106 . 5 1 1 A 19 19 TRP H H 19 6.068 7.207 -1.139 1
1 107 . 5 1 1 A 19 19 TRP HA H 19 5.045 4.766 0.279 1
1 116 . 5 1 1 A 19 19 TRP C C 19 175.902 176.152 -0.250 1
1 117 . 5 1 1 A 19 19 TRP CA C 19 53.542 57.514 -3.972 1
1 118 . 5 1 1 A 19 19 TRP CB C 19 29.179 28.838 0.341 1
1 124 . 5 1 1 A 19 19 TRP N N 19 107.757 116.812 -9.055 1
1 126 . 5 1 1 A 20 20 TYR H H 20 7.430 7.360 0.070 1
1 127 . 5 1 1 A 20 20 TYR HA H 20 5.601 5.305 0.296 1
1 132 . 5 1 1 A 20 20 TYR C C 20 175.498 175.844 -0.346 1
1 133 . 5 1 1 A 20 20 TYR CA C 20 56.967 56.959 0.008 1
1 134 . 5 1 1 A 20 20 TYR CB C 20 39.083 38.840 0.243 1
1 137 . 5 1 1 A 20 20 TYR N N 20 123.173 121.605 1.568 1
1 138 . 5 1 1 A 21 21 HIS H H 21 8.934 8.774 0.160 1
1 139 . 5 1 1 A 21 21 HIS HA H 21 4.295 4.282 0.013 1
1 144 . 5 1 1 A 21 21 HIS C C 21 175.177 175.088 0.089 1
1 145 . 5 1 1 A 21 21 HIS CA C 21 56.572 56.586 -0.014 1
1 146 . 5 1 1 A 21 21 HIS CB C 21 33.365 31.540 1.825 1
1 149 . 5 1 1 A 21 21 HIS N N 21 125.732 127.480 -1.748 1
1 150 . 5 1 1 A 22 22 GLY H H 22 5.280 6.785 -1.505 1
1 151 . 5 1 1 A 22 22 GLY HA2 H 22 3.905 3.504 0.401 1
1 152 . 5 1 1 A 22 22 GLY HA3 H 22 3.585 3.798 -0.213 1
1 153 . 5 1 1 A 22 22 GLY C C 22 174.411 173.824 0.587 1
1 154 . 5 1 1 A 22 22 GLY CA C 22 46.402 44.697 1.705 1
1 155 . 5 1 1 A 22 22 GLY N N 22 104.568 106.774 -2.206 1
1 156 . 5 1 1 A 23 23 ALA H H 23 8.768 8.153 0.615 1
1 157 . 5 1 1 A 23 23 ALA HA H 23 5.171 4.812 0.359 1
1 161 . 5 1 1 A 23 23 ALA C C 23 177.180 176.508 0.672 1
1 162 . 5 1 1 A 23 23 ALA CA C 23 51.153 51.174 -0.021 1
1 163 . 5 1 1 A 23 23 ALA CB C 23 16.999 18.177 -1.178 1
1 164 . 5 1 1 A 23 23 ALA N N 23 130.297 124.684 5.613 1
1 165 . 5 1 1 A 24 24 ILE H H 24 7.267 7.831 -0.564 1
1 166 . 5 1 1 A 24 24 ILE HA H 24 4.460 4.851 -0.391 1
1 176 . 5 1 1 A 24 24 ILE CA C 24 58.529 57.428 1.101 1
1 177 . 5 1 1 A 24 24 ILE CB C 24 38.763 39.312 -0.549 1
1 181 . 5 1 1 A 24 24 ILE N N 24 118.903 118.218 0.685 1
1 182 . 5 1 1 A 25 25 PRO HA H 25 4.224 4.514 -0.290 1
1 189 . 5 1 1 A 25 25 PRO C C 25 176.918 177.195 -0.277 1
1 190 . 5 1 1 A 25 25 PRO CA C 25 62.907 62.301 0.606 1
1 191 . 5 1 1 A 25 25 PRO CB C 25 32.671 33.347 -0.676 1
1 194 . 5 1 1 A 26 26 ARG H H 26 8.781 9.058 -0.277 1
1 195 . 5 1 1 A 26 26 ARG HA H 26 3.472 3.871 -0.399 1
1 202 . 5 1 1 A 26 26 ARG C C 26 178.112 178.306 -0.194 1
1 203 . 5 1 1 A 26 26 ARG CA C 26 60.863 59.471 1.392 1
1 204 . 5 1 1 A 26 26 ARG CB C 26 30.314 29.805 0.509 1
1 207 . 5 1 1 A 26 26 ARG N N 26 124.635 120.924 3.711 1
1 208 . 5 1 1 A 27 27 ILE H H 27 8.540 8.116 0.424 1
1 209 . 5 1 1 A 27 27 ILE HA H 27 3.787 3.676 0.111 1
1 219 . 5 1 1 A 27 27 ILE C C 27 177.390 177.458 -0.068 1
1 220 . 5 1 1 A 27 27 ILE CA C 27 64.329 64.886 -0.557 1
1 221 . 5 1 1 A 27 27 ILE CB C 27 37.413 37.927 -0.514 1
1 225 . 5 1 1 A 27 27 ILE N N 27 115.859 119.868 -4.009 1
1 226 . 5 1 1 A 28 28 GLU H H 28 6.953 8.582 -1.629 1
1 227 . 5 1 1 A 28 28 GLU HA H 28 4.067 4.034 0.033 1
1 232 . 5 1 1 A 28 28 GLU C C 28 179.006 179.197 -0.191 1
1 233 . 5 1 1 A 28 28 GLU CA C 28 58.985 59.596 -0.611 1
1 234 . 5 1 1 A 28 28 GLU CB C 28 29.316 29.014 0.302 1
1 236 . 5 1 1 A 28 28 GLU N N 28 120.554 119.154 1.400 1
1 237 . 5 1 1 A 29 29 ALA H H 29 7.999 7.675 0.324 1
1 238 . 5 1 1 A 29 29 ALA HA H 29 3.822 4.108 -0.286 1
1 242 . 5 1 1 A 29 29 ALA C C 29 178.809 179.709 -0.900 1
1 243 . 5 1 1 A 29 29 ALA CA C 29 54.698 54.897 -0.199 1
1 244 . 5 1 1 A 29 29 ALA CB C 29 18.059 18.465 -0.406 1
1 245 . 5 1 1 A 29 29 ALA N N 29 120.122 122.491 -2.369 1
1 246 . 5 1 1 A 30 30 GLN H H 30 8.168 8.075 0.093 1
1 247 . 5 1 1 A 30 30 GLN HA H 30 3.811 4.204 -0.393 1
1 254 . 5 1 1 A 30 30 GLN C C 30 177.578 178.288 -0.710 1
1 255 . 5 1 1 A 30 30 GLN CA C 30 59.731 58.442 1.289 1
1 256 . 5 1 1 A 30 30 GLN CB C 30 28.161 29.079 -0.918 1
1 258 . 5 1 1 A 30 30 GLN N N 30 112.109 115.860 -3.751 1
1 260 . 5 1 1 A 31 31 GLU H H 31 7.248 8.303 -1.055 1
1 261 . 5 1 1 A 31 31 GLU HA H 31 4.063 4.073 -0.010 1
1 266 . 5 1 1 A 31 31 GLU C C 31 177.423 179.045 -1.622 1
1 267 . 5 1 1 A 31 31 GLU CA C 31 57.650 59.163 -1.513 1
1 268 . 5 1 1 A 31 31 GLU CB C 31 29.757 29.144 0.613 1
1 270 . 5 1 1 A 31 31 GLU N N 31 115.340 119.453 -4.113 1
1 271 . 5 1 1 A 32 32 LEU H H 32 7.169 7.878 -0.709 1
1 272 . 5 1 1 A 32 32 LEU HA H 32 4.087 4.116 -0.029 1
1 282 . 5 1 1 A 32 32 LEU C C 32 175.850 177.181 -1.331 1
1 283 . 5 1 1 A 32 32 LEU CA C 32 55.580 57.533 -1.953 1
1 284 . 5 1 1 A 32 32 LEU CB C 32 42.910 41.325 1.585 1
1 288 . 5 1 1 A 32 32 LEU N N 32 116.367 115.700 0.667 1
1 289 . 5 1 1 A 33 33 LEU H H 33 7.062 7.633 -0.571 1
1 290 . 5 1 1 A 33 33 LEU HA H 33 4.431 4.186 0.245 1
1 300 . 5 1 1 A 33 33 LEU C C 33 174.837 177.137 -2.300 1
1 301 . 5 1 1 A 33 33 LEU CA C 33 53.521 55.133 -1.612 1
1 302 . 5 1 1 A 33 33 LEU CB C 33 43.301 41.638 1.663 1
1 306 . 5 1 1 A 33 33 LEU N N 33 118.568 122.557 -3.989 1
1 307 . 5 1 1 A 34 34 LYS H H 34 8.749 8.647 0.102 1
1 308 . 5 1 1 A 34 34 LYS HA H 34 4.162 4.207 -0.045 1
1 317 . 5 1 1 A 34 34 LYS C C 34 174.378 175.426 -1.048 1
1 318 . 5 1 1 A 34 34 LYS CA C 34 56.575 56.268 0.307 1
1 319 . 5 1 1 A 34 34 LYS CB C 34 36.918 34.487 2.431 1
1 323 . 5 1 1 A 34 34 LYS N N 34 121.659 118.768 2.891 1
1 324 . 5 1 1 A 35 35 LYS H H 35 8.137 7.561 0.576 1
1 325 . 5 1 1 A 35 35 LYS HA H 35 4.011 4.789 -0.778 1
1 334 . 5 1 1 A 35 35 LYS C C 35 174.343 175.463 -1.120 1
1 335 . 5 1 1 A 35 35 LYS CA C 35 53.960 54.408 -0.448 1
1 336 . 5 1 1 A 35 35 LYS CB C 35 35.587 35.472 0.115 1
1 340 . 5 1 1 A 35 35 LYS N N 35 119.354 116.265 3.089 1
1 341 . 5 1 1 A 36 36 GLN H H 36 8.394 8.698 -0.304 1
1 342 . 5 1 1 A 36 36 GLN HA H 36 4.187 4.657 -0.470 1
1 349 . 5 1 1 A 36 36 GLN C C 36 177.012 176.691 0.321 1
1 350 . 5 1 1 A 36 36 GLN CA C 36 57.750 57.913 -0.163 1
1 351 . 5 1 1 A 36 36 GLN CB C 36 28.433 28.446 -0.013 1
1 353 . 5 1 1 A 36 36 GLN N N 36 120.248 123.303 -3.055 1
1 355 . 5 1 1 A 37 37 GLY H H 37 9.597 8.945 0.652 1
1 356 . 5 1 1 A 37 37 GLY HA2 H 37 4.486 4.120 0.366 1
1 357 . 5 1 1 A 37 37 GLY HA3 H 37 3.926 4.121 -0.195 1
1 358 . 5 1 1 A 37 37 GLY C C 37 176.285 174.563 1.722 1
1 359 . 5 1 1 A 37 37 GLY CA C 37 46.146 45.442 0.704 1
1 360 . 5 1 1 A 37 37 GLY N N 37 116.637 114.672 1.965 1
1 361 . 5 1 1 A 38 38 ASP H H 38 8.925 7.935 0.990 1
1 362 . 5 1 1 A 38 38 ASP HA H 38 5.697 4.695 1.002 1
1 365 . 5 1 1 A 38 38 ASP C C 38 176.181 175.691 0.490 1
1 366 . 5 1 1 A 38 38 ASP CA C 38 55.066 55.537 -0.471 1
1 367 . 5 1 1 A 38 38 ASP CB C 38 42.933 41.273 1.660 1
1 368 . 5 1 1 A 38 38 ASP N N 38 127.293 121.954 5.339 1
1 369 . 5 1 1 A 39 39 PHE H H 39 8.647 8.572 0.075 1
1 370 . 5 1 1 A 39 39 PHE HA H 39 6.025 6.044 -0.019 1
1 378 . 5 1 1 A 39 39 PHE C C 39 170.948 173.053 -2.105 1
1 379 . 5 1 1 A 39 39 PHE CA C 39 56.376 56.171 0.205 1
1 380 . 5 1 1 A 39 39 PHE CB C 39 44.583 43.168 1.415 1
1 386 . 5 1 1 A 39 39 PHE N N 39 117.102 119.792 -2.690 1
1 387 . 5 1 1 A 40 40 LEU H H 40 9.186 9.216 -0.030 1
1 388 . 5 1 1 A 40 40 LEU HA H 40 4.983 5.276 -0.293 1
1 398 . 5 1 1 A 40 40 LEU C C 40 174.787 174.536 0.251 1
1 399 . 5 1 1 A 40 40 LEU CA C 40 54.610 53.846 0.764 1
1 400 . 5 1 1 A 40 40 LEU CB C 40 44.330 45.992 -1.662 1
1 404 . 5 1 1 A 40 40 LEU N N 40 114.388 117.816 -3.428 1
1 405 . 5 1 1 A 41 41 VAL H H 41 9.390 9.451 -0.061 1
1 406 . 5 1 1 A 41 41 VAL HA H 41 5.742 5.047 0.695 1
1 414 . 5 1 1 A 41 41 VAL C C 41 172.760 175.309 -2.549 1
1 415 . 5 1 1 A 41 41 VAL CA C 41 60.814 61.634 -0.820 1
1 416 . 5 1 1 A 41 41 VAL CB C 41 34.908 33.221 1.687 1
1 419 . 5 1 1 A 41 41 VAL N N 41 119.873 122.316 -2.443 1
1 420 . 5 1 1 A 42 42 ARG H H 42 9.598 9.279 0.319 1
1 421 . 5 1 1 A 42 42 ARG HA H 42 5.247 5.427 -0.180 1
1 429 . 5 1 1 A 42 42 ARG C C 42 173.379 174.099 -0.720 1
1 430 . 5 1 1 A 42 42 ARG CA C 42 53.202 53.956 -0.754 1
1 431 . 5 1 1 A 42 42 ARG CB C 42 33.507 34.033 -0.526 1
1 434 . 5 1 1 A 42 42 ARG N N 42 124.179 124.667 -0.488 1
1 436 . 5 1 1 A 43 43 GLU H H 43 8.234 8.925 -0.691 1
1 437 . 5 1 1 A 43 43 GLU HA H 43 4.890 4.796 0.094 1
1 442 . 5 1 1 A 43 43 GLU C C 43 176.929 175.954 0.975 1
1 443 . 5 1 1 A 43 43 GLU CA C 43 54.846 54.743 0.103 1
1 444 . 5 1 1 A 43 43 GLU CB C 43 31.599 32.659 -1.060 1
1 446 . 5 1 1 A 43 43 GLU N N 43 124.103 121.356 2.747 1
1 447 . 5 1 1 A 44 44 SER H H 44 9.033 9.002 0.031 1
1 448 . 5 1 1 A 44 44 SER HA H 44 3.957 4.378 -0.421 1
1 451 . 5 1 1 A 44 44 SER C C 44 175.005 174.872 0.133 1
1 452 . 5 1 1 A 44 44 SER CA C 44 59.393 59.901 -0.508 1
1 453 . 5 1 1 A 44 44 SER CB C 44 63.619 62.990 0.629 1
1 454 . 5 1 1 A 44 44 SER N N 44 124.316 121.056 3.260 1
1 455 . 5 1 1 A 45 45 HIS H H 45 8.461 8.979 -0.518 1
1 456 . 5 1 1 A 45 45 HIS HA H 45 4.132 4.160 -0.028 1
1 460 . 5 1 1 A 45 45 HIS C C 45 176.480 176.654 -0.174 1
1 461 . 5 1 1 A 45 45 HIS CA C 45 58.887 59.362 -0.475 1
1 462 . 5 1 1 A 45 45 HIS CB C 45 30.180 30.272 -0.092 1
1 464 . 5 1 1 A 45 45 HIS N N 45 127.694 125.858 1.836 1
1 465 . 5 1 1 A 46 46 GLY H H 46 8.513 8.164 0.349 1
1 466 . 5 1 1 A 46 46 GLY HA2 H 46 3.827 3.813 0.014 1
1 467 . 5 1 1 A 46 46 GLY HA3 H 46 3.827 3.881 -0.054 1
1 468 . 5 1 1 A 46 46 GLY C C 46 173.630 173.605 0.025 1
1 469 . 5 1 1 A 46 46 GLY CA C 46 45.188 45.290 -0.102 1
1 470 . 5 1 1 A 46 46 GLY N N 46 110.761 105.001 5.760 1
1 471 . 5 1 1 A 47 47 LYS H H 47 7.216 7.731 -0.515 1
1 472 . 5 1 1 A 47 47 LYS HA H 47 4.540 4.792 -0.252 1
1 481 . 5 1 1 A 47 47 LYS CA C 47 53.475 53.005 0.470 1
1 482 . 5 1 1 A 47 47 LYS CB C 47 33.325 34.053 -0.728 1
1 486 . 5 1 1 A 47 47 LYS N N 47 121.356 120.486 0.870 1
1 487 . 5 1 1 A 48 48 PRO HA H 48 4.181 4.230 -0.049 1
1 494 . 5 1 1 A 48 48 PRO C C 48 178.920 177.578 1.342 1
1 495 . 5 1 1 A 48 48 PRO CA C 48 63.239 63.672 -0.433 1
1 496 . 5 1 1 A 48 48 PRO CB C 48 31.523 31.297 0.226 1
1 499 . 5 1 1 A 49 49 GLY H H 49 9.752 8.679 1.073 1
1 500 . 5 1 1 A 49 49 GLY HA2 H 49 4.053 3.852 0.201 1
1 501 . 5 1 1 A 49 49 GLY HA3 H 49 3.374 4.001 -0.627 1
1 502 . 5 1 1 A 49 49 GLY C C 49 172.093 173.517 -1.424 1
1 503 . 5 1 1 A 49 49 GLY CA C 49 45.041 45.173 -0.132 1
1 504 . 5 1 1 A 49 49 GLY N N 49 112.415 112.687 -0.272 1
1 505 . 5 1 1 A 50 50 GLU H H 50 7.623 7.496 0.127 1
1 506 . 5 1 1 A 50 50 GLU HA H 50 4.537 4.678 -0.141 1
1 511 . 5 1 1 A 50 50 GLU C C 50 173.297 174.529 -1.232 1
1 512 . 5 1 1 A 50 50 GLU CA C 50 55.174 55.237 -0.063 1
1 513 . 5 1 1 A 50 50 GLU CB C 50 31.651 30.899 0.752 1
1 515 . 5 1 1 A 50 50 GLU N N 50 121.600 121.221 0.379 1
1 516 . 5 1 1 A 51 51 TYR H H 51 9.452 9.212 0.240 1
1 517 . 5 1 1 A 51 51 TYR HA H 51 5.382 5.407 -0.025 1
1 524 . 5 1 1 A 51 51 TYR C C 51 174.387 174.776 -0.389 1
1 525 . 5 1 1 A 51 51 TYR CA C 51 57.592 57.138 0.454 1
1 526 . 5 1 1 A 51 51 TYR CB C 51 41.820 40.609 1.211 1
1 531 . 5 1 1 A 51 51 TYR N N 51 125.790 126.973 -1.183 1
1 532 . 5 1 1 A 52 52 VAL H H 52 9.471 9.475 -0.004 1
1 533 . 5 1 1 A 52 52 VAL HA H 52 4.840 4.857 -0.017 1
1 541 . 5 1 1 A 52 52 VAL C C 52 174.947 175.266 -0.319 1
1 542 . 5 1 1 A 52 52 VAL CA C 52 60.991 61.411 -0.420 1
1 543 . 5 1 1 A 52 52 VAL CB C 52 36.829 34.102 2.727 1
1 546 . 5 1 1 A 52 52 VAL N N 52 120.617 123.336 -2.719 1
1 547 . 5 1 1 A 53 53 LEU H H 53 9.457 9.252 0.205 1
1 548 . 5 1 1 A 53 53 LEU HA H 53 5.294 5.113 0.181 1
1 558 . 5 1 1 A 53 53 LEU C C 53 175.024 174.934 0.090 1
1 559 . 5 1 1 A 53 53 LEU CA C 53 53.904 54.653 -0.749 1
1 560 . 5 1 1 A 53 53 LEU CB C 53 44.756 44.201 0.555 1
1 564 . 5 1 1 A 53 53 LEU N N 53 127.725 131.445 -3.720 1
1 565 . 5 1 1 A 54 54 SER H H 54 9.461 9.339 0.122 1
1 566 . 5 1 1 A 54 54 SER HA H 54 5.691 5.594 0.097 1
1 569 . 5 1 1 A 54 54 SER C C 54 172.227 173.393 -1.166 1
1 570 . 5 1 1 A 54 54 SER CA C 54 58.551 57.904 0.647 1
1 571 . 5 1 1 A 54 54 SER CB C 54 65.738 64.990 0.748 1
1 572 . 5 1 1 A 54 54 SER N N 54 127.178 124.551 2.627 1
1 573 . 5 1 1 A 55 55 VAL H H 55 9.049 8.847 0.202 1
1 574 . 5 1 1 A 55 55 VAL HA H 55 5.691 5.493 0.198 1
1 582 . 5 1 1 A 55 55 VAL C C 55 173.959 173.347 0.612 1
1 583 . 5 1 1 A 55 55 VAL CA C 55 58.398 59.862 -1.464 1
1 584 . 5 1 1 A 55 55 VAL CB C 55 36.262 35.992 0.270 1
1 587 . 5 1 1 A 55 55 VAL N N 55 120.619 123.683 -3.064 1
1 588 . 5 1 1 A 56 56 TYR H H 56 8.629 9.182 -0.553 1
1 589 . 5 1 1 A 56 56 TYR HA H 56 4.951 4.893 0.058 1
1 596 . 5 1 1 A 56 56 TYR C C 56 175.224 174.679 0.545 1
1 597 . 5 1 1 A 56 56 TYR CA C 56 56.684 57.361 -0.677 1
1 598 . 5 1 1 A 56 56 TYR CB C 56 39.646 38.555 1.091 1
1 603 . 5 1 1 A 56 56 TYR N N 56 127.444 130.268 -2.824 1
1 604 . 5 1 1 A 57 57 SER H H 57 8.869 8.811 0.058 1
1 605 . 5 1 1 A 57 57 SER HA H 57 4.739 4.794 -0.055 1
1 608 . 5 1 1 A 57 57 SER C C 57 174.492 172.674 1.818 1
1 609 . 5 1 1 A 57 57 SER CA C 57 57.591 57.076 0.515 1
1 610 . 5 1 1 A 57 57 SER CB C 57 64.281 66.395 -2.114 1
1 611 . 5 1 1 A 57 57 SER N N 57 122.165 123.016 -0.851 1
1 612 . 5 1 1 A 58 58 ASP H H 58 10.446 9.392 1.054 1
1 613 . 5 1 1 A 58 58 ASP HA H 58 4.382 4.296 0.086 1
1 616 . 5 1 1 A 58 58 ASP C C 58 176.398 176.163 0.235 1
1 617 . 5 1 1 A 58 58 ASP CA C 58 55.215 55.256 -0.041 1
1 618 . 5 1 1 A 58 58 ASP CB C 58 39.513 39.182 0.331 1
1 619 . 5 1 1 A 58 58 ASP N N 58 132.098 128.137 3.961 1
1 620 . 5 1 1 A 59 59 GLY H H 59 7.861 8.415 -0.554 1
1 621 . 5 1 1 A 59 59 GLY HA2 H 59 3.817 3.794 0.023 1
1 622 . 5 1 1 A 59 59 GLY HA3 H 59 4.086 3.851 0.235 1
1 623 . 5 1 1 A 59 59 GLY C C 59 173.111 173.382 -0.271 1
1 624 . 5 1 1 A 59 59 GLY CA C 59 45.486 45.301 0.185 1
1 625 . 5 1 1 A 59 59 GLY N N 59 102.674 104.818 -2.144 1
1 626 . 5 1 1 A 60 60 GLN H H 60 7.137 7.507 -0.370 1
1 627 . 5 1 1 A 60 60 GLN HA H 60 4.455 4.485 -0.030 1
1 634 . 5 1 1 A 60 60 GLN C C 60 173.549 174.567 -1.018 1
1 635 . 5 1 1 A 60 60 GLN CA C 60 53.388 53.699 -0.311 1
1 636 . 5 1 1 A 60 60 GLN CB C 60 32.373 31.074 1.299 1
1 638 . 5 1 1 A 60 60 GLN N N 60 116.206 118.996 -2.790 1
1 640 . 5 1 1 A 61 61 ARG H H 61 8.589 8.293 0.296 1
1 641 . 5 1 1 A 61 61 ARG HA H 61 4.740 4.387 0.353 1
1 649 . 5 1 1 A 61 61 ARG C C 61 174.458 174.751 -0.293 1
1 650 . 5 1 1 A 61 61 ARG CA C 61 57.116 55.270 1.846 1
1 651 . 5 1 1 A 61 61 ARG CB C 61 29.615 30.628 -1.013 1
1 654 . 5 1 1 A 61 61 ARG N N 61 120.467 120.962 -0.495 1
1 656 . 5 1 1 A 62 62 ARG H H 62 8.867 8.732 0.135 1
1 657 . 5 1 1 A 62 62 ARG HA H 62 4.297 4.184 0.113 1
1 665 . 5 1 1 A 62 62 ARG C C 62 173.485 175.534 -2.049 1
1 666 . 5 1 1 A 62 62 ARG CA C 62 53.355 55.789 -2.434 1
1 667 . 5 1 1 A 62 62 ARG CB C 62 33.028 30.959 2.069 1
1 670 . 5 1 1 A 62 62 ARG N N 62 122.641 124.606 -1.965 1
1 672 . 5 1 1 A 63 63 HIS H H 63 7.997 8.303 -0.306 1
1 673 . 5 1 1 A 63 63 HIS HA H 63 5.427 5.190 0.237 1
1 678 . 5 1 1 A 63 63 HIS C C 63 174.946 173.997 0.949 1
1 679 . 5 1 1 A 63 63 HIS CA C 63 54.689 54.269 0.420 1
1 680 . 5 1 1 A 63 63 HIS CB C 63 33.008 32.172 0.836 1
1 683 . 5 1 1 A 63 63 HIS N N 63 119.064 118.496 0.568 1
1 684 . 5 1 1 A 64 64 PHE H H 64 9.880 9.425 0.455 1
1 685 . 5 1 1 A 64 64 PHE HA H 64 4.824 5.014 -0.190 1
1 693 . 5 1 1 A 64 64 PHE C C 64 174.882 175.239 -0.357 1
1 694 . 5 1 1 A 64 64 PHE CA C 64 56.489 56.490 -0.001 1
1 695 . 5 1 1 A 64 64 PHE CB C 64 41.405 40.726 0.679 1
1 701 . 5 1 1 A 64 64 PHE N N 64 123.961 122.140 1.821 1
1 702 . 5 1 1 A 65 65 ILE H H 65 8.982 8.983 -0.001 1
1 703 . 5 1 1 A 65 65 ILE HA H 65 4.273 4.498 -0.225 1
1 713 . 5 1 1 A 65 65 ILE C C 65 176.556 176.152 0.404 1
1 714 . 5 1 1 A 65 65 ILE CA C 65 62.649 61.763 0.886 1
1 715 . 5 1 1 A 65 65 ILE CB C 65 38.296 38.134 0.162 1
1 719 . 5 1 1 A 65 65 ILE N N 65 126.601 125.469 1.132 1
1 720 . 5 1 1 A 66 66 ILE H H 66 8.947 8.999 -0.052 1
1 721 . 5 1 1 A 66 66 ILE HA H 66 3.780 3.970 -0.190 1
1 731 . 5 1 1 A 66 66 ILE C C 66 175.721 175.765 -0.044 1
1 732 . 5 1 1 A 66 66 ILE CA C 66 62.960 61.145 1.815 1
1 733 . 5 1 1 A 66 66 ILE CB C 66 37.209 37.968 -0.759 1
1 737 . 5 1 1 A 66 66 ILE N N 66 130.139 129.133 1.006 1
1 738 . 5 1 1 A 67 67 GLN H H 67 8.410 8.418 -0.008 1
1 739 . 5 1 1 A 67 67 GLN HA H 67 4.422 4.585 -0.163 1
1 746 . 5 1 1 A 67 67 GLN C C 67 174.347 174.979 -0.632 1
1 747 . 5 1 1 A 67 67 GLN CA C 67 55.867 55.945 -0.078 1
1 748 . 5 1 1 A 67 67 GLN CB C 67 29.950 29.419 0.531 1
1 750 . 5 1 1 A 67 67 GLN N N 67 128.872 127.503 1.369 1
1 752 . 5 1 1 A 68 68 TYR H H 68 8.619 9.000 -0.381 1
1 753 . 5 1 1 A 68 68 TYR HA H 68 5.300 4.769 0.531 1
1 760 . 5 1 1 A 68 68 TYR C C 68 174.695 174.276 0.419 1
1 761 . 5 1 1 A 68 68 TYR CA C 68 55.579 56.504 -0.925 1
1 762 . 5 1 1 A 68 68 TYR CB C 68 39.479 38.701 0.778 1
1 767 . 5 1 1 A 68 68 TYR N N 68 124.772 126.210 -1.438 1
1 768 . 5 1 1 A 69 69 VAL H H 69 8.539 8.682 -0.143 1
1 769 . 5 1 1 A 69 69 VAL HA H 69 4.046 4.339 -0.293 1
1 777 . 5 1 1 A 69 69 VAL C C 69 175.010 175.356 -0.346 1
1 778 . 5 1 1 A 69 69 VAL CA C 69 60.611 61.039 -0.428 1
1 779 . 5 1 1 A 69 69 VAL CB C 69 35.358 34.229 1.129 1
1 782 . 5 1 1 A 69 69 VAL N N 69 126.652 127.956 -1.304 1
1 783 . 5 1 1 A 70 70 ASP H H 70 9.089 9.338 -0.249 1
1 784 . 5 1 1 A 70 70 ASP HA H 70 4.025 4.201 -0.176 1
1 787 . 5 1 1 A 70 70 ASP C C 70 174.813 175.036 -0.223 1
1 788 . 5 1 1 A 70 70 ASP CA C 70 55.623 55.504 0.119 1
1 789 . 5 1 1 A 70 70 ASP CB C 70 39.081 39.223 -0.142 1
1 790 . 5 1 1 A 70 70 ASP N N 70 128.327 129.048 -0.721 1
1 791 . 5 1 1 A 71 71 ASN H H 71 8.128 8.034 0.094 1
1 792 . 5 1 1 A 71 71 ASN HA H 71 3.597 3.473 0.124 1
1 797 . 5 1 1 A 71 71 ASN C C 71 173.250 173.705 -0.455 1
1 798 . 5 1 1 A 71 71 ASN CA C 71 54.728 54.245 0.483 1
1 799 . 5 1 1 A 71 71 ASN CB C 71 37.601 37.093 0.508 1
1 800 . 5 1 1 A 71 71 ASN N N 71 107.230 107.871 -0.641 1
1 802 . 5 1 1 A 72 72 MET H H 72 7.256 7.486 -0.230 1
1 803 . 5 1 1 A 72 72 MET HA H 72 4.740 4.728 0.012 1
1 808 . 5 1 1 A 72 72 MET C C 72 173.780 174.564 -0.784 1
1 809 . 5 1 1 A 72 72 MET CA C 72 53.703 54.272 -0.569 1
1 810 . 5 1 1 A 72 72 MET CB C 72 36.570 35.590 0.980 1
1 812 . 5 1 1 A 72 72 MET N N 72 117.117 116.960 0.157 1
1 813 . 5 1 1 A 73 73 TYR H H 73 9.430 9.146 0.284 1
1 814 . 5 1 1 A 73 73 TYR HA H 73 5.718 5.229 0.489 1
1 821 . 5 1 1 A 73 73 TYR C C 73 176.140 175.754 0.386 1
1 822 . 5 1 1 A 73 73 TYR CA C 73 57.290 57.247 0.043 1
1 823 . 5 1 1 A 73 73 TYR CB C 73 40.013 39.752 0.261 1
1 828 . 5 1 1 A 73 73 TYR N N 73 119.856 121.125 -1.269 1
1 829 . 5 1 1 A 74 74 ARG H H 74 9.038 8.680 0.358 1
1 830 . 5 1 1 A 74 74 ARG HA H 74 4.867 5.029 -0.162 1
1 838 . 5 1 1 A 74 74 ARG C C 74 173.954 174.604 -0.650 1
1 839 . 5 1 1 A 74 74 ARG CA C 74 54.887 54.233 0.654 1
1 840 . 5 1 1 A 74 74 ARG CB C 74 34.484 34.306 0.178 1
1 843 . 5 1 1 A 74 74 ARG N N 74 117.344 121.415 -4.071 1
1 845 . 5 1 1 A 75 75 PHE H H 75 9.005 8.716 0.289 1
1 846 . 5 1 1 A 75 75 PHE HA H 75 5.046 5.060 -0.014 1
1 854 . 5 1 1 A 75 75 PHE C C 75 176.186 176.589 -0.403 1
1 855 . 5 1 1 A 75 75 PHE CA C 75 59.658 59.270 0.388 1
1 856 . 5 1 1 A 75 75 PHE CB C 75 39.356 40.128 -0.772 1
1 862 . 5 1 1 A 75 75 PHE N N 75 117.865 117.498 0.367 1
1 863 . 5 1 1 A 76 76 GLU H H 76 8.213 8.335 -0.122 1
1 864 . 5 1 1 A 76 76 GLU HA H 76 4.586 4.546 0.040 1
1 869 . 5 1 1 A 76 76 GLU C C 76 175.238 176.558 -1.320 1
1 870 . 5 1 1 A 76 76 GLU CA C 76 55.994 56.719 -0.725 1
1 871 . 5 1 1 A 76 76 GLU CB C 76 31.805 31.253 0.552 1
1 873 . 5 1 1 A 76 76 GLU N N 76 116.834 118.368 -1.534 1
1 874 . 5 1 1 A 77 77 GLY H H 77 8.692 8.055 0.637 1
1 875 . 5 1 1 A 77 77 GLY HA2 H 77 4.166 4.124 0.042 1
1 876 . 5 1 1 A 77 77 GLY HA3 H 77 4.015 4.156 -0.141 1
1 877 . 5 1 1 A 77 77 GLY C C 77 173.784 173.182 0.602 1
1 878 . 5 1 1 A 77 77 GLY CA C 77 45.505 45.388 0.117 1
1 879 . 5 1 1 A 77 77 GLY N N 77 111.937 108.163 3.774 1
1 880 . 5 1 1 A 78 78 THR H H 78 8.332 8.624 -0.292 1
1 881 . 5 1 1 A 78 78 THR HA H 78 3.900 4.241 -0.341 1
1 886 . 5 1 1 A 78 78 THR C C 78 173.591 174.720 -1.129 1
1 887 . 5 1 1 A 78 78 THR CA C 78 63.653 63.169 0.484 1
1 888 . 5 1 1 A 78 78 THR CB C 78 69.649 69.835 -0.186 1
1 890 . 5 1 1 A 78 78 THR N N 78 120.765 117.035 3.730 1
1 891 . 5 1 1 A 79 79 GLY H H 79 8.038 8.430 -0.392 1
1 892 . 5 1 1 A 79 79 GLY HA2 H 79 4.748 4.217 0.531 1
1 893 . 5 1 1 A 79 79 GLY HA3 H 79 3.546 4.343 -0.797 1
1 894 . 5 1 1 A 79 79 GLY C C 79 172.580 172.092 0.488 1
1 895 . 5 1 1 A 79 79 GLY CA C 79 44.661 44.485 0.176 1
1 896 . 5 1 1 A 79 79 GLY N N 79 109.887 113.356 -3.469 1
1 897 . 5 1 1 A 80 80 PHE H H 80 9.064 9.381 -0.317 1
1 898 . 5 1 1 A 80 80 PHE HA H 80 4.886 4.947 -0.061 1
1 906 . 5 1 1 A 80 80 PHE C C 80 176.507 176.436 0.071 1
1 907 . 5 1 1 A 80 80 PHE CA C 80 57.257 57.316 -0.059 1
1 908 . 5 1 1 A 80 80 PHE CB C 80 44.655 41.940 2.715 1
1 914 . 5 1 1 A 80 80 PHE N N 80 116.862 124.206 -7.344 1
1 915 . 5 1 1 A 81 81 SER H H 81 9.413 9.067 0.346 1
1 916 . 5 1 1 A 81 81 SER HA H 81 4.622 4.419 0.203 1
1 919 . 5 1 1 A 81 81 SER C C 81 173.735 174.152 -0.417 1
1 920 . 5 1 1 A 81 81 SER CA C 81 61.410 60.987 0.423 1
1 921 . 5 1 1 A 81 81 SER CB C 81 64.165 63.510 0.655 1
1 922 . 5 1 1 A 81 81 SER N N 81 116.467 117.151 -0.684 1
1 923 . 5 1 1 A 82 82 ASN H H 82 7.688 8.150 -0.462 1
1 924 . 5 1 1 A 82 82 ASN HA H 82 4.952 5.176 -0.224 1
1 929 . 5 1 1 A 82 82 ASN C C 82 173.303 175.454 -2.151 1
1 930 . 5 1 1 A 82 82 ASN CA C 82 52.086 52.120 -0.034 1
1 931 . 5 1 1 A 82 82 ASN CB C 82 41.258 41.344 -0.086 1
1 932 . 5 1 1 A 82 82 ASN N N 82 113.355 115.865 -2.510 1
1 934 . 5 1 1 A 83 83 ILE H H 83 8.858 8.708 0.150 1
1 935 . 5 1 1 A 83 83 ILE HA H 83 3.571 3.677 -0.106 1
1 945 . 5 1 1 A 83 83 ILE CA C 83 66.416 65.447 0.969 1
1 946 . 5 1 1 A 83 83 ILE CB C 83 35.074 34.808 0.266 1
1 950 . 5 1 1 A 83 83 ILE N N 83 118.908 122.921 -4.013 1
1 951 . 5 1 1 A 84 84 PRO HA H 84 4.411 4.725 -0.314 1
1 958 . 5 1 1 A 84 84 PRO C C 84 177.616 179.309 -1.693 1
1 959 . 5 1 1 A 84 84 PRO CA C 84 67.525 66.295 1.230 1
1 960 . 5 1 1 A 84 84 PRO CB C 84 31.029 30.468 0.561 1
1 963 . 5 1 1 A 85 85 GLN H H 85 8.405 8.275 0.130 1
1 964 . 5 1 1 A 85 85 GLN HA H 85 3.874 4.072 -0.198 1
1 971 . 5 1 1 A 85 85 GLN C C 85 178.213 178.227 -0.014 1
1 972 . 5 1 1 A 85 85 GLN CA C 85 59.495 58.743 0.752 1
1 973 . 5 1 1 A 85 85 GLN CB C 85 29.270 28.208 1.062 1
1 975 . 5 1 1 A 85 85 GLN N N 85 115.597 117.884 -2.287 1
1 977 . 5 1 1 A 86 86 LEU H H 86 7.136 7.931 -0.795 1
1 978 . 5 1 1 A 86 86 LEU HA H 86 3.589 3.399 0.190 1
1 988 . 5 1 1 A 86 86 LEU C C 86 177.728 178.441 -0.713 1
1 989 . 5 1 1 A 86 86 LEU CA C 86 58.136 58.229 -0.093 1
1 990 . 5 1 1 A 86 86 LEU CB C 86 42.290 41.445 0.845 1
1 994 . 5 1 1 A 86 86 LEU N N 86 121.840 121.726 0.114 1
1 995 . 5 1 1 A 87 87 ILE H H 87 8.323 8.066 0.257 1
1 996 . 5 1 1 A 87 87 ILE HA H 87 3.415 3.382 0.033 1
1 1006 . 5 1 1 A 87 87 ILE C C 87 178.064 177.702 0.362 1
1 1007 . 5 1 1 A 87 87 ILE CA C 87 61.458 65.397 -3.939 1
1 1008 . 5 1 1 A 87 87 ILE CB C 87 34.561 37.714 -3.153 1
1 1012 . 5 1 1 A 87 87 ILE N N 87 118.117 119.727 -1.610 1
1 1013 . 5 1 1 A 88 88 ASP H H 88 8.805 8.333 0.472 1
1 1014 . 5 1 1 A 88 88 ASP HA H 88 4.548 4.353 0.195 1
1 1017 . 5 1 1 A 88 88 ASP C C 88 179.265 178.074 1.191 1
1 1018 . 5 1 1 A 88 88 ASP CA C 88 58.099 57.430 0.669 1
1 1019 . 5 1 1 A 88 88 ASP CB C 88 42.166 42.021 0.145 1
1 1020 . 5 1 1 A 88 88 ASP N N 88 119.143 120.553 -1.410 1
1 1021 . 5 1 1 A 89 89 HIS H H 89 8.113 8.043 0.070 1
1 1022 . 5 1 1 A 89 89 HIS HA H 89 4.225 4.292 -0.067 1
1 1026 . 5 1 1 A 89 89 HIS C C 89 179.261 177.103 2.158 1
1 1027 . 5 1 1 A 89 89 HIS CA C 89 60.647 59.040 1.607 1
1 1028 . 5 1 1 A 89 89 HIS CB C 89 30.801 29.886 0.915 1
1 1030 . 5 1 1 A 89 89 HIS N N 89 119.595 119.169 0.426 1
1 1031 . 5 1 1 A 90 90 HIS H H 90 7.685 7.924 -0.239 1
1 1032 . 5 1 1 A 90 90 HIS HA H 90 3.628 4.068 -0.440 1
1 1036 . 5 1 1 A 90 90 HIS C C 90 178.454 177.326 1.128 1
1 1037 . 5 1 1 A 90 90 HIS CA C 90 61.797 60.142 1.655 1
1 1038 . 5 1 1 A 90 90 HIS CB C 90 28.165 29.763 -1.598 1
1 1040 . 5 1 1 A 90 90 HIS N N 90 120.061 117.577 2.484 1
1 1041 . 5 1 1 A 91 91 TYR H H 91 9.394 8.353 1.041 1
1 1042 . 5 1 1 A 91 91 TYR HA H 91 4.238 4.051 0.187 1
1 1049 . 5 1 1 A 91 91 TYR C C 91 176.443 177.364 -0.921 1
1 1050 . 5 1 1 A 91 91 TYR CA C 91 60.669 61.672 -1.003 1
1 1051 . 5 1 1 A 91 91 TYR CB C 91 39.169 38.677 0.492 1
1 1056 . 5 1 1 A 91 91 TYR N N 91 123.532 120.225 3.307 1
1 1057 . 5 1 1 A 92 92 THR H H 92 8.774 8.593 0.181 1
1 1058 . 5 1 1 A 92 92 THR HA H 92 3.866 4.125 -0.259 1
1 1063 . 5 1 1 A 92 92 THR C C 92 177.050 176.185 0.865 1
1 1064 . 5 1 1 A 92 92 THR CA C 92 65.240 65.497 -0.257 1
1 1065 . 5 1 1 A 92 92 THR CB C 92 69.298 68.121 1.177 1
1 1067 . 5 1 1 A 92 92 THR N N 92 112.000 112.568 -0.568 1
1 1068 . 5 1 1 A 93 93 THR H H 93 7.617 7.435 0.182 1
1 1069 . 5 1 1 A 93 93 THR HA H 93 4.133 4.202 -0.069 1
1 1074 . 5 1 1 A 93 93 THR C C 93 176.234 174.849 1.385 1
1 1075 . 5 1 1 A 93 93 THR CA C 93 63.527 62.222 1.305 1
1 1076 . 5 1 1 A 93 93 THR CB C 93 71.234 69.263 1.971 1
1 1078 . 5 1 1 A 93 93 THR N N 93 109.883 112.169 -2.286 1
1 1079 . 5 1 1 A 94 94 LYS H H 94 7.210 7.814 -0.604 1
1 1080 . 5 1 1 A 94 94 LYS HA H 94 3.830 3.769 0.061 1
1 1089 . 5 1 1 A 94 94 LYS C C 94 174.331 175.044 -0.713 1
1 1090 . 5 1 1 A 94 94 LYS CA C 94 56.776 57.394 -0.618 1
1 1091 . 5 1 1 A 94 94 LYS CB C 94 28.095 31.060 -2.965 1
1 1095 . 5 1 1 A 94 94 LYS N N 94 112.818 121.238 -8.420 1
1 1096 . 5 1 1 A 95 95 GLN H H 95 7.439 7.906 -0.467 1
1 1097 . 5 1 1 A 95 95 GLN HA H 95 4.216 4.459 -0.243 1
1 1104 . 5 1 1 A 95 95 GLN C C 95 179.087 175.766 3.321 1
1 1105 . 5 1 1 A 95 95 GLN CA C 95 56.378 55.514 0.864 1
1 1106 . 5 1 1 A 95 95 GLN CB C 95 28.542 29.946 -1.404 1
1 1108 . 5 1 1 A 95 95 GLN N N 95 117.860 119.084 -1.224 1
1 1110 . 5 1 1 A 96 96 VAL H H 96 8.520 8.685 -0.165 1
1 1111 . 5 1 1 A 96 96 VAL HA H 96 4.297 4.556 -0.259 1
1 1119 . 5 1 1 A 96 96 VAL C C 96 177.329 176.511 0.818 1
1 1120 . 5 1 1 A 96 96 VAL CA C 96 61.196 61.252 -0.056 1
1 1121 . 5 1 1 A 96 96 VAL CB C 96 32.735 33.659 -0.924 1
1 1124 . 5 1 1 A 96 96 VAL N N 96 124.208 119.489 4.719 1
1 1125 . 5 1 1 A 97 97 ILE H H 97 8.491 8.449 0.042 1
1 1126 . 5 1 1 A 97 97 ILE HA H 97 2.995 3.575 -0.580 1
1 1136 . 5 1 1 A 97 97 ILE CA C 97 62.066 62.863 -0.797 1
1 1137 . 5 1 1 A 97 97 ILE CB C 97 36.117 37.894 -1.777 1
1 1141 . 5 1 1 A 97 97 ILE N N 97 119.561 123.691 -4.130 1
1 1142 . 5 1 1 A 98 98 THR HA H 98 4.460 4.598 -0.138 1
1 1147 . 5 1 1 A 98 98 THR C C 98 174.335 174.711 -0.376 1
1 1148 . 5 1 1 A 98 98 THR CA C 98 58.244 59.459 -1.215 1
1 1149 . 5 1 1 A 98 98 THR CB C 98 73.056 71.826 1.230 1
1 1151 . 5 1 1 A 99 99 LYS H H 99 9.761 9.028 0.733 1
1 1152 . 5 1 1 A 99 99 LYS HA H 99 3.911 4.005 -0.094 1
1 1161 . 5 1 1 A 99 99 LYS C C 99 179.594 178.453 1.141 1
1 1162 . 5 1 1 A 99 99 LYS CA C 99 59.661 59.050 0.611 1
1 1163 . 5 1 1 A 99 99 LYS CB C 99 31.978 32.088 -0.110 1
1 1167 . 5 1 1 A 99 99 LYS N N 99 125.750 122.012 3.738 1
1 1168 . 5 1 1 A 100 100 LYS H H 100 8.910 7.533 1.377 1
1 1169 . 5 1 1 A 100 100 LYS HA H 100 4.024 4.185 -0.161 1
1 1178 . 5 1 1 A 100 100 LYS C C 100 178.060 177.199 0.861 1
1 1179 . 5 1 1 A 100 100 LYS CA C 100 58.642 58.537 0.105 1
1 1180 . 5 1 1 A 100 100 LYS CB C 100 32.750 32.344 0.406 1
1 1184 . 5 1 1 A 100 100 LYS N N 100 117.112 118.551 -1.439 1
1 1185 . 5 1 1 A 101 101 SER H H 101 7.721 7.564 0.157 1
1 1186 . 5 1 1 A 101 101 SER HA H 101 4.282 4.597 -0.315 1
1 1189 . 5 1 1 A 101 101 SER C C 101 176.403 174.918 1.485 1
1 1190 . 5 1 1 A 101 101 SER CA C 101 60.442 59.203 1.239 1
1 1191 . 5 1 1 A 101 101 SER CB C 101 63.775 65.379 -1.604 1
1 1192 . 5 1 1 A 101 101 SER N N 101 112.069 112.838 -0.769 1
1 1193 . 5 1 1 A 102 102 GLY H H 102 8.038 8.487 -0.449 1
1 1194 . 5 1 1 A 102 102 GLY HA2 H 102 4.024 3.921 0.103 1
1 1195 . 5 1 1 A 102 102 GLY HA3 H 102 3.713 3.946 -0.233 1
1 1196 . 5 1 1 A 102 102 GLY C C 102 173.991 174.458 -0.467 1
1 1197 . 5 1 1 A 102 102 GLY CA C 102 46.458 46.777 -0.319 1
1 1198 . 5 1 1 A 102 102 GLY N N 102 111.144 108.798 2.346 1
1 1199 . 5 1 1 A 103 103 VAL H H 103 7.155 7.625 -0.470 1
1 1200 . 5 1 1 A 103 103 VAL HA H 103 3.652 4.289 -0.637 1
1 1208 . 5 1 1 A 103 103 VAL C C 103 173.805 174.924 -1.119 1
1 1209 . 5 1 1 A 103 103 VAL CA C 103 64.310 61.707 2.603 1
1 1210 . 5 1 1 A 103 103 VAL CB C 103 32.254 33.643 -1.389 1
1 1213 . 5 1 1 A 103 103 VAL N N 103 119.836 119.641 0.195 1
1 1214 . 5 1 1 A 104 104 VAL H H 104 7.653 9.016 -1.363 1
1 1215 . 5 1 1 A 104 104 VAL HA H 104 4.048 4.585 -0.537 1
1 1223 . 5 1 1 A 104 104 VAL C C 104 175.708 174.131 1.577 1
1 1224 . 5 1 1 A 104 104 VAL CA C 104 60.275 60.643 -0.368 1
1 1225 . 5 1 1 A 104 104 VAL CB C 104 35.112 34.455 0.657 1
1 1228 . 5 1 1 A 104 104 VAL N N 104 125.859 127.791 -1.932 1
1 1229 . 5 1 1 A 105 105 LEU H H 105 8.616 8.318 0.298 1
1 1230 . 5 1 1 A 105 105 LEU HA H 105 3.905 4.569 -0.664 1
1 1240 . 5 1 1 A 105 105 LEU C C 105 175.380 175.796 -0.416 1
1 1241 . 5 1 1 A 105 105 LEU CA C 105 54.471 53.710 0.761 1
1 1242 . 5 1 1 A 105 105 LEU CB C 105 39.821 41.566 -1.745 1
1 1246 . 5 1 1 A 105 105 LEU N N 105 123.839 126.114 -2.275 1
1 1247 . 5 1 1 A 106 106 LEU H H 106 8.894 8.517 0.377 1
1 1248 . 5 1 1 A 106 106 LEU HA H 106 4.839 4.976 -0.137 1
1 1258 . 5 1 1 A 106 106 LEU C C 106 176.930 176.327 0.603 1
1 1259 . 5 1 1 A 106 106 LEU CA C 106 56.288 53.228 3.060 1
1 1260 . 5 1 1 A 106 106 LEU CB C 106 45.237 45.556 -0.319 1
1 1264 . 5 1 1 A 106 106 LEU N N 106 120.590 121.831 -1.241 1
1 1265 . 5 1 1 A 107 107 ASN H H 107 8.124 9.008 -0.884 1
1 1266 . 5 1 1 A 107 107 ASN HA H 107 5.650 4.658 0.992 1
1 1271 . 5 1 1 A 107 107 ASN CA C 107 50.293 53.981 -3.688 1
1 1272 . 5 1 1 A 107 107 ASN CB C 107 41.223 36.218 5.005 1
1 1273 . 5 1 1 A 107 107 ASN N N 107 116.866 117.425 -0.559 1
1 1275 . 5 1 1 A 108 108 PRO HA H 108 2.926 3.981 -1.055 1
1 1282 . 5 1 1 A 108 108 PRO C C 108 176.671 175.528 1.143 1
1 1283 . 5 1 1 A 108 108 PRO CA C 108 60.804 62.574 -1.770 1
1 1284 . 5 1 1 A 108 108 PRO CB C 108 31.774 32.220 -0.446 1
1 1287 . 5 1 1 A 109 109 ILE H H 109 8.648 7.838 0.810 1
1 1288 . 5 1 1 A 109 109 ILE HA H 109 4.519 4.556 -0.037 1
1 1298 . 5 1 1 A 109 109 ILE CA C 109 55.070 58.279 -3.209 1
1 1299 . 5 1 1 A 109 109 ILE CB C 109 36.068 38.461 -2.393 1
1 1303 . 5 1 1 A 109 109 ILE N N 109 128.817 123.198 5.619 1
1 1304 . 5 1 1 A 110 110 PRO HA H 110 4.587 4.526 0.061 1
1 1311 . 5 1 1 A 110 110 PRO C C 110 177.013 176.426 0.587 1
1 1312 . 5 1 1 A 110 110 PRO CA C 110 61.850 62.463 -0.613 1
1 1313 . 5 1 1 A 110 110 PRO CB C 110 32.507 32.249 0.258 1
1 1316 . 5 1 1 A 111 111 LYS H H 111 8.038 8.182 -0.144 1
1 1317 . 5 1 1 A 111 111 LYS HA H 111 3.553 4.256 -0.703 1
1 1326 . 5 1 1 A 111 111 LYS C C 111 176.123 175.684 0.439 1
1 1327 . 5 1 1 A 111 111 LYS CA C 111 56.220 54.811 1.409 1
1 1328 . 5 1 1 A 111 111 LYS CB C 111 32.373 34.072 -1.699 1
1 1332 . 5 1 1 A 111 111 LYS N N 111 120.147 117.946 2.201 1
1 1333 . 5 1 1 A 112 112 ASP H H 112 8.463 8.616 -0.153 1
1 1334 . 5 1 1 A 112 112 ASP HA H 112 4.523 5.056 -0.533 1
1 1337 . 5 1 1 A 112 112 ASP C C 112 175.986 175.704 0.282 1
1 1338 . 5 1 1 A 112 112 ASP CA C 112 54.256 51.654 2.602 1
1 1339 . 5 1 1 A 112 112 ASP CB C 112 41.563 42.589 -1.026 1
1 1340 . 5 1 1 A 112 112 ASP N N 112 121.863 120.205 1.658 1
1 1341 . 5 1 1 A 113 113 LYS H H 113 8.059 8.555 -0.496 1
1 1342 . 5 1 1 A 113 113 LYS HA H 113 4.136 4.716 -0.580 1
1 1351 . 5 1 1 A 113 113 LYS C C 113 176.010 176.446 -0.436 1
1 1352 . 5 1 1 A 113 113 LYS CA C 113 56.253 55.291 0.962 1
1 1353 . 5 1 1 A 113 113 LYS CB C 113 32.754 32.758 -0.004 1
1 1357 . 5 1 1 A 113 113 LYS N N 113 121.725 117.814 3.911 1
1 1358 . 5 1 1 A 114 114 LYS H H 114 8.225 7.347 0.878 1
1 1359 . 5 1 1 A 114 114 LYS HA H 114 4.169 4.207 -0.038 1
1 1368 . 5 1 1 A 114 114 LYS C C 114 176.198 177.540 -1.342 1
1 1369 . 5 1 1 A 114 114 LYS CA C 114 56.413 55.924 0.489 1
1 1370 . 5 1 1 A 114 114 LYS CB C 114 32.725 32.943 -0.218 1
1 1374 . 5 1 1 A 114 114 LYS N N 114 121.857 120.573 1.284 1
1 1375 . 5 1 1 A 115 115 TRP H H 115 8.078 8.188 -0.110 1
1 1376 . 5 1 1 A 115 115 TRP HA H 115 4.709 4.723 -0.014 1
1 1385 . 5 1 1 A 115 115 TRP C C 115 175.119 176.328 -1.209 1
1 1386 . 5 1 1 A 115 115 TRP CA C 115 56.856 57.555 -0.699 1
1 1387 . 5 1 1 A 115 115 TRP CB C 115 29.474 29.704 -0.230 1
1 1393 . 5 1 1 A 115 115 TRP N N 115 122.068 122.963 -0.895 1
1 1 . 6 1 1 A 10 10 HIS HA H 10 4.616 4.939 -0.323 1
1 4 . 6 1 1 A 10 10 HIS C C 10 174.981 173.591 1.390 1
1 5 . 6 1 1 A 10 10 HIS CA C 10 56.555 55.763 0.792 1
1 6 . 6 1 1 A 10 10 HIS CB C 10 30.231 33.157 -2.926 1
1 7 . 6 1 1 A 11 11 MET H H 11 8.103 8.545 -0.442 1
1 8 . 6 1 1 A 11 11 MET HA H 11 4.439 4.631 -0.192 1
1 13 . 6 1 1 A 11 11 MET C C 11 175.888 175.536 0.352 1
1 14 . 6 1 1 A 11 11 MET CA C 11 55.090 54.169 0.921 1
1 15 . 6 1 1 A 11 11 MET CB C 11 33.121 34.456 -1.335 1
1 17 . 6 1 1 A 11 11 MET N N 11 120.743 124.830 -4.087 1
1 18 . 6 1 1 A 12 12 LYS H H 12 8.065 8.339 -0.274 1
1 19 . 6 1 1 A 12 12 LYS HA H 12 4.407 4.797 -0.390 1
1 28 . 6 1 1 A 12 12 LYS CA C 12 54.894 52.443 2.451 1
1 29 . 6 1 1 A 12 12 LYS CB C 12 31.863 32.844 -0.981 1
1 33 . 6 1 1 A 12 12 LYS N N 12 123.187 120.944 2.243 1
1 34 . 6 1 1 A 13 13 PRO HA H 13 4.347 4.458 -0.111 1
1 41 . 6 1 1 A 13 13 PRO C C 13 176.891 176.900 -0.009 1
1 42 . 6 1 1 A 13 13 PRO CA C 13 62.542 62.339 0.203 1
1 43 . 6 1 1 A 13 13 PRO CB C 13 32.663 33.722 -1.059 1
1 46 . 6 1 1 A 14 14 LEU H H 14 8.339 8.734 -0.395 1
1 47 . 6 1 1 A 14 14 LEU HA H 14 3.373 3.767 -0.394 1
1 57 . 6 1 1 A 14 14 LEU C C 14 176.683 178.285 -1.602 1
1 58 . 6 1 1 A 14 14 LEU CA C 14 58.555 57.226 1.329 1
1 59 . 6 1 1 A 14 14 LEU CB C 14 41.828 40.955 0.873 1
1 63 . 6 1 1 A 14 14 LEU N N 14 123.191 122.957 0.234 1
1 64 . 6 1 1 A 15 15 ALA H H 15 8.175 7.856 0.319 1
1 65 . 6 1 1 A 15 15 ALA HA H 15 3.983 4.060 -0.077 1
1 69 . 6 1 1 A 15 15 ALA C C 15 178.697 178.584 0.113 1
1 70 . 6 1 1 A 15 15 ALA CA C 15 54.164 54.360 -0.196 1
1 71 . 6 1 1 A 15 15 ALA CB C 15 18.771 18.197 0.574 1
1 72 . 6 1 1 A 15 15 ALA N N 15 113.594 119.871 -6.277 1
1 73 . 6 1 1 A 16 16 GLU H H 16 7.458 7.488 -0.030 1
1 74 . 6 1 1 A 16 16 GLU HA H 16 4.266 4.329 -0.063 1
1 79 . 6 1 1 A 16 16 GLU C C 16 176.510 176.635 -0.125 1
1 80 . 6 1 1 A 16 16 GLU CA C 16 55.196 56.896 -1.700 1
1 81 . 6 1 1 A 16 16 GLU CB C 16 30.907 29.572 1.335 1
1 83 . 6 1 1 A 16 16 GLU N N 16 113.348 114.920 -1.572 1
1 84 . 6 1 1 A 17 17 GLN H H 17 7.501 7.189 0.312 1
1 85 . 6 1 1 A 17 17 GLN HA H 17 3.683 4.131 -0.448 1
1 92 . 6 1 1 A 17 17 GLN C C 17 178.053 176.001 2.052 1
1 93 . 6 1 1 A 17 17 GLN CA C 17 54.606 54.876 -0.270 1
1 94 . 6 1 1 A 17 17 GLN CB C 17 25.758 28.658 -2.900 1
1 96 . 6 1 1 A 17 17 GLN N N 17 119.411 119.653 -0.242 1
1 98 . 6 1 1 A 18 18 ASP H H 18 8.949 8.721 0.228 1
1 99 . 6 1 1 A 18 18 ASP HA H 18 4.184 4.224 -0.040 1
1 102 . 6 1 1 A 18 18 ASP C C 18 175.263 177.491 -2.228 1
1 103 . 6 1 1 A 18 18 ASP CA C 18 57.275 56.388 0.887 1
1 104 . 6 1 1 A 18 18 ASP CB C 18 40.620 39.748 0.872 1
1 105 . 6 1 1 A 18 18 ASP N N 18 124.676 123.599 1.077 1
1 106 . 6 1 1 A 19 19 TRP H H 19 6.068 7.391 -1.323 1
1 107 . 6 1 1 A 19 19 TRP HA H 19 5.045 4.824 0.221 1
1 116 . 6 1 1 A 19 19 TRP C C 19 175.902 176.394 -0.492 1
1 117 . 6 1 1 A 19 19 TRP CA C 19 53.542 57.628 -4.086 1
1 118 . 6 1 1 A 19 19 TRP CB C 19 29.179 28.579 0.600 1
1 124 . 6 1 1 A 19 19 TRP N N 19 107.757 116.607 -8.850 1
1 126 . 6 1 1 A 20 20 TYR H H 20 7.430 7.209 0.221 1
1 127 . 6 1 1 A 20 20 TYR HA H 20 5.601 5.261 0.340 1
1 132 . 6 1 1 A 20 20 TYR C C 20 175.498 175.674 -0.176 1
1 133 . 6 1 1 A 20 20 TYR CA C 20 56.967 56.997 -0.030 1
1 134 . 6 1 1 A 20 20 TYR CB C 20 39.083 38.485 0.598 1
1 137 . 6 1 1 A 20 20 TYR N N 20 123.173 121.708 1.465 1
1 138 . 6 1 1 A 21 21 HIS H H 21 8.934 8.850 0.084 1
1 139 . 6 1 1 A 21 21 HIS HA H 21 4.295 4.217 0.078 1
1 144 . 6 1 1 A 21 21 HIS C C 21 175.177 175.105 0.072 1
1 145 . 6 1 1 A 21 21 HIS CA C 21 56.572 56.384 0.188 1
1 146 . 6 1 1 A 21 21 HIS CB C 21 33.365 31.293 2.072 1
1 149 . 6 1 1 A 21 21 HIS N N 21 125.732 127.443 -1.711 1
1 150 . 6 1 1 A 22 22 GLY H H 22 5.280 6.854 -1.574 1
1 151 . 6 1 1 A 22 22 GLY HA2 H 22 3.905 3.424 0.481 1
1 152 . 6 1 1 A 22 22 GLY HA3 H 22 3.585 3.654 -0.069 1
1 153 . 6 1 1 A 22 22 GLY C C 22 174.411 173.718 0.693 1
1 154 . 6 1 1 A 22 22 GLY CA C 22 46.402 45.627 0.775 1
1 155 . 6 1 1 A 22 22 GLY N N 22 104.568 106.689 -2.121 1
1 156 . 6 1 1 A 23 23 ALA H H 23 8.768 8.188 0.580 1
1 157 . 6 1 1 A 23 23 ALA HA H 23 5.171 5.009 0.162 1
1 161 . 6 1 1 A 23 23 ALA C C 23 177.180 176.984 0.196 1
1 162 . 6 1 1 A 23 23 ALA CA C 23 51.153 51.030 0.123 1
1 163 . 6 1 1 A 23 23 ALA CB C 23 16.999 19.941 -2.942 1
1 164 . 6 1 1 A 23 23 ALA N N 23 130.297 125.284 5.013 1
1 165 . 6 1 1 A 24 24 ILE H H 24 7.267 8.675 -1.408 1
1 166 . 6 1 1 A 24 24 ILE HA H 24 4.460 4.832 -0.372 1
1 176 . 6 1 1 A 24 24 ILE CA C 24 58.529 57.179 1.350 1
1 177 . 6 1 1 A 24 24 ILE CB C 24 38.763 39.471 -0.708 1
1 181 . 6 1 1 A 24 24 ILE N N 24 118.903 119.342 -0.439 1
1 182 . 6 1 1 A 25 25 PRO HA H 25 4.224 4.461 -0.237 1
1 189 . 6 1 1 A 25 25 PRO C C 25 176.918 177.942 -1.024 1
1 190 . 6 1 1 A 25 25 PRO CA C 25 62.907 62.831 0.076 1
1 191 . 6 1 1 A 25 25 PRO CB C 25 32.671 32.571 0.100 1
1 194 . 6 1 1 A 26 26 ARG H H 26 8.781 9.001 -0.220 1
1 195 . 6 1 1 A 26 26 ARG HA H 26 3.472 3.875 -0.403 1
1 202 . 6 1 1 A 26 26 ARG C C 26 178.112 177.939 0.173 1
1 203 . 6 1 1 A 26 26 ARG CA C 26 60.863 59.482 1.381 1
1 204 . 6 1 1 A 26 26 ARG CB C 26 30.314 29.772 0.542 1
1 207 . 6 1 1 A 26 26 ARG N N 26 124.635 123.108 1.527 1
1 208 . 6 1 1 A 27 27 ILE H H 27 8.540 8.139 0.401 1
1 209 . 6 1 1 A 27 27 ILE HA H 27 3.787 3.622 0.165 1
1 219 . 6 1 1 A 27 27 ILE C C 27 177.390 177.782 -0.392 1
1 220 . 6 1 1 A 27 27 ILE CA C 27 64.329 65.272 -0.943 1
1 221 . 6 1 1 A 27 27 ILE CB C 27 37.413 37.939 -0.526 1
1 225 . 6 1 1 A 27 27 ILE N N 27 115.859 119.865 -4.006 1
1 226 . 6 1 1 A 28 28 GLU H H 28 6.953 8.478 -1.525 1
1 227 . 6 1 1 A 28 28 GLU HA H 28 4.067 3.964 0.103 1
1 232 . 6 1 1 A 28 28 GLU C C 28 179.006 178.978 0.028 1
1 233 . 6 1 1 A 28 28 GLU CA C 28 58.985 59.367 -0.382 1
1 234 . 6 1 1 A 28 28 GLU CB C 28 29.316 29.381 -0.065 1
1 236 . 6 1 1 A 28 28 GLU N N 28 120.554 119.126 1.428 1
1 237 . 6 1 1 A 29 29 ALA H H 29 7.999 8.280 -0.281 1
1 238 . 6 1 1 A 29 29 ALA HA H 29 3.822 3.978 -0.156 1
1 242 . 6 1 1 A 29 29 ALA C C 29 178.809 179.954 -1.145 1
1 243 . 6 1 1 A 29 29 ALA CA C 29 54.698 54.766 -0.068 1
1 244 . 6 1 1 A 29 29 ALA CB C 29 18.059 18.350 -0.291 1
1 245 . 6 1 1 A 29 29 ALA N N 29 120.122 122.367 -2.245 1
1 246 . 6 1 1 A 30 30 GLN H H 30 8.168 7.995 0.173 1
1 247 . 6 1 1 A 30 30 GLN HA H 30 3.811 4.191 -0.380 1
1 254 . 6 1 1 A 30 30 GLN C C 30 177.578 178.126 -0.548 1
1 255 . 6 1 1 A 30 30 GLN CA C 30 59.731 58.289 1.442 1
1 256 . 6 1 1 A 30 30 GLN CB C 30 28.161 29.059 -0.898 1
1 258 . 6 1 1 A 30 30 GLN N N 30 112.109 115.759 -3.650 1
1 260 . 6 1 1 A 31 31 GLU H H 31 7.248 8.334 -1.086 1
1 261 . 6 1 1 A 31 31 GLU HA H 31 4.063 4.059 0.004 1
1 266 . 6 1 1 A 31 31 GLU C C 31 177.423 179.227 -1.804 1
1 267 . 6 1 1 A 31 31 GLU CA C 31 57.650 59.052 -1.402 1
1 268 . 6 1 1 A 31 31 GLU CB C 31 29.757 29.178 0.579 1
1 270 . 6 1 1 A 31 31 GLU N N 31 115.340 119.397 -4.057 1
1 271 . 6 1 1 A 32 32 LEU H H 32 7.169 7.371 -0.202 1
1 272 . 6 1 1 A 32 32 LEU HA H 32 4.087 4.059 0.028 1
1 282 . 6 1 1 A 32 32 LEU C C 32 175.850 177.142 -1.292 1
1 283 . 6 1 1 A 32 32 LEU CA C 32 55.580 57.537 -1.957 1
1 284 . 6 1 1 A 32 32 LEU CB C 32 42.910 41.242 1.668 1
1 288 . 6 1 1 A 32 32 LEU N N 32 116.367 115.875 0.492 1
1 289 . 6 1 1 A 33 33 LEU H H 33 7.062 7.654 -0.592 1
1 290 . 6 1 1 A 33 33 LEU HA H 33 4.431 4.374 0.057 1
1 300 . 6 1 1 A 33 33 LEU C C 33 174.837 177.005 -2.168 1
1 301 . 6 1 1 A 33 33 LEU CA C 33 53.521 54.986 -1.465 1
1 302 . 6 1 1 A 33 33 LEU CB C 33 43.301 40.816 2.485 1
1 306 . 6 1 1 A 33 33 LEU N N 33 118.568 122.733 -4.165 1
1 307 . 6 1 1 A 34 34 LYS H H 34 8.749 8.442 0.307 1
1 308 . 6 1 1 A 34 34 LYS HA H 34 4.162 4.329 -0.167 1
1 317 . 6 1 1 A 34 34 LYS C C 34 174.378 174.927 -0.549 1
1 318 . 6 1 1 A 34 34 LYS CA C 34 56.575 56.203 0.372 1
1 319 . 6 1 1 A 34 34 LYS CB C 34 36.918 34.556 2.362 1
1 323 . 6 1 1 A 34 34 LYS N N 34 121.659 118.641 3.018 1
1 324 . 6 1 1 A 35 35 LYS H H 35 8.137 7.493 0.644 1
1 325 . 6 1 1 A 35 35 LYS HA H 35 4.011 4.652 -0.641 1
1 334 . 6 1 1 A 35 35 LYS C C 35 174.343 174.838 -0.495 1
1 335 . 6 1 1 A 35 35 LYS CA C 35 53.960 54.090 -0.130 1
1 336 . 6 1 1 A 35 35 LYS CB C 35 35.587 35.607 -0.020 1
1 340 . 6 1 1 A 35 35 LYS N N 35 119.354 115.913 3.441 1
1 341 . 6 1 1 A 36 36 GLN H H 36 8.394 8.553 -0.159 1
1 342 . 6 1 1 A 36 36 GLN HA H 36 4.187 4.185 0.002 1
1 349 . 6 1 1 A 36 36 GLN C C 36 177.012 176.854 0.158 1
1 350 . 6 1 1 A 36 36 GLN CA C 36 57.750 57.826 -0.076 1
1 351 . 6 1 1 A 36 36 GLN CB C 36 28.433 28.497 -0.064 1
1 353 . 6 1 1 A 36 36 GLN N N 36 120.248 121.946 -1.698 1
1 355 . 6 1 1 A 37 37 GLY H H 37 9.597 8.807 0.790 1
1 356 . 6 1 1 A 37 37 GLY HA2 H 37 4.486 4.112 0.374 1
1 357 . 6 1 1 A 37 37 GLY HA3 H 37 3.926 4.119 -0.193 1
1 358 . 6 1 1 A 37 37 GLY C C 37 176.285 174.120 2.165 1
1 359 . 6 1 1 A 37 37 GLY CA C 37 46.146 45.151 0.995 1
1 360 . 6 1 1 A 37 37 GLY N N 37 116.637 115.191 1.446 1
1 361 . 6 1 1 A 38 38 ASP H H 38 8.925 8.198 0.727 1
1 362 . 6 1 1 A 38 38 ASP HA H 38 5.697 4.652 1.045 1
1 365 . 6 1 1 A 38 38 ASP C C 38 176.181 175.789 0.392 1
1 366 . 6 1 1 A 38 38 ASP CA C 38 55.066 55.459 -0.393 1
1 367 . 6 1 1 A 38 38 ASP CB C 38 42.933 41.208 1.725 1
1 368 . 6 1 1 A 38 38 ASP N N 38 127.293 122.193 5.100 1
1 369 . 6 1 1 A 39 39 PHE H H 39 8.647 8.479 0.168 1
1 370 . 6 1 1 A 39 39 PHE HA H 39 6.025 5.948 0.077 1
1 378 . 6 1 1 A 39 39 PHE C C 39 170.948 173.016 -2.068 1
1 379 . 6 1 1 A 39 39 PHE CA C 39 56.376 56.098 0.278 1
1 380 . 6 1 1 A 39 39 PHE CB C 39 44.583 42.918 1.665 1
1 386 . 6 1 1 A 39 39 PHE N N 39 117.102 119.539 -2.437 1
1 387 . 6 1 1 A 40 40 LEU H H 40 9.186 8.941 0.245 1
1 388 . 6 1 1 A 40 40 LEU HA H 40 4.983 5.033 -0.050 1
1 398 . 6 1 1 A 40 40 LEU C C 40 174.787 174.455 0.332 1
1 399 . 6 1 1 A 40 40 LEU CA C 40 54.610 54.045 0.565 1
1 400 . 6 1 1 A 40 40 LEU CB C 40 44.330 45.643 -1.313 1
1 404 . 6 1 1 A 40 40 LEU N N 40 114.388 117.176 -2.788 1
1 405 . 6 1 1 A 41 41 VAL H H 41 9.390 9.240 0.150 1
1 406 . 6 1 1 A 41 41 VAL HA H 41 5.742 5.145 0.597 1
1 414 . 6 1 1 A 41 41 VAL C C 41 172.760 175.099 -2.339 1
1 415 . 6 1 1 A 41 41 VAL CA C 41 60.814 61.469 -0.655 1
1 416 . 6 1 1 A 41 41 VAL CB C 41 34.908 33.578 1.330 1
1 419 . 6 1 1 A 41 41 VAL N N 41 119.873 121.656 -1.783 1
1 420 . 6 1 1 A 42 42 ARG H H 42 9.598 9.169 0.429 1
1 421 . 6 1 1 A 42 42 ARG HA H 42 5.247 5.243 0.004 1
1 429 . 6 1 1 A 42 42 ARG C C 42 173.379 174.388 -1.009 1
1 430 . 6 1 1 A 42 42 ARG CA C 42 53.202 53.713 -0.511 1
1 431 . 6 1 1 A 42 42 ARG CB C 42 33.507 34.168 -0.661 1
1 434 . 6 1 1 A 42 42 ARG N N 42 124.179 124.740 -0.561 1
1 436 . 6 1 1 A 43 43 GLU H H 43 8.234 8.890 -0.656 1
1 437 . 6 1 1 A 43 43 GLU HA H 43 4.890 4.427 0.463 1
1 442 . 6 1 1 A 43 43 GLU C C 43 176.929 176.535 0.394 1
1 443 . 6 1 1 A 43 43 GLU CA C 43 54.846 55.563 -0.717 1
1 444 . 6 1 1 A 43 43 GLU CB C 43 31.599 30.980 0.619 1
1 446 . 6 1 1 A 43 43 GLU N N 43 124.103 122.574 1.529 1
1 447 . 6 1 1 A 44 44 SER H H 44 9.033 9.113 -0.080 1
1 448 . 6 1 1 A 44 44 SER HA H 44 3.957 4.562 -0.605 1
1 451 . 6 1 1 A 44 44 SER C C 44 175.005 174.181 0.824 1
1 452 . 6 1 1 A 44 44 SER CA C 44 59.393 58.241 1.152 1
1 453 . 6 1 1 A 44 44 SER CB C 44 63.619 63.393 0.226 1
1 454 . 6 1 1 A 44 44 SER N N 44 124.316 120.697 3.619 1
1 455 . 6 1 1 A 45 45 HIS H H 45 8.461 8.574 -0.113 1
1 456 . 6 1 1 A 45 45 HIS HA H 45 4.132 4.247 -0.115 1
1 460 . 6 1 1 A 45 45 HIS C C 45 176.480 176.225 0.255 1
1 461 . 6 1 1 A 45 45 HIS CA C 45 58.887 57.514 1.373 1
1 462 . 6 1 1 A 45 45 HIS CB C 45 30.180 29.461 0.719 1
1 464 . 6 1 1 A 45 45 HIS N N 45 127.694 125.677 2.017 1
1 465 . 6 1 1 A 46 46 GLY H H 46 8.513 8.773 -0.260 1
1 466 . 6 1 1 A 46 46 GLY HA2 H 46 3.827 3.715 0.112 1
1 467 . 6 1 1 A 46 46 GLY HA3 H 46 3.827 3.767 0.060 1
1 468 . 6 1 1 A 46 46 GLY C C 46 173.630 173.697 -0.067 1
1 469 . 6 1 1 A 46 46 GLY CA C 46 45.188 45.288 -0.100 1
1 470 . 6 1 1 A 46 46 GLY N N 46 110.761 114.896 -4.135 1
1 471 . 6 1 1 A 47 47 LYS H H 47 7.216 7.940 -0.724 1
1 472 . 6 1 1 A 47 47 LYS HA H 47 4.540 4.726 -0.186 1
1 481 . 6 1 1 A 47 47 LYS CA C 47 53.475 52.858 0.617 1
1 482 . 6 1 1 A 47 47 LYS CB C 47 33.325 33.943 -0.618 1
1 486 . 6 1 1 A 47 47 LYS N N 47 121.356 121.698 -0.342 1
1 487 . 6 1 1 A 48 48 PRO HA H 48 4.181 4.250 -0.069 1
1 494 . 6 1 1 A 48 48 PRO C C 48 178.920 177.660 1.260 1
1 495 . 6 1 1 A 48 48 PRO CA C 48 63.239 63.796 -0.557 1
1 496 . 6 1 1 A 48 48 PRO CB C 48 31.523 31.395 0.128 1
1 499 . 6 1 1 A 49 49 GLY H H 49 9.752 8.728 1.024 1
1 500 . 6 1 1 A 49 49 GLY HA2 H 49 4.053 3.873 0.180 1
1 501 . 6 1 1 A 49 49 GLY HA3 H 49 3.374 4.034 -0.660 1
1 502 . 6 1 1 A 49 49 GLY C C 49 172.093 173.825 -1.732 1
1 503 . 6 1 1 A 49 49 GLY CA C 49 45.041 45.257 -0.216 1
1 504 . 6 1 1 A 49 49 GLY N N 49 112.415 112.773 -0.358 1
1 505 . 6 1 1 A 50 50 GLU H H 50 7.623 7.623 0.000 1
1 506 . 6 1 1 A 50 50 GLU HA H 50 4.537 4.638 -0.101 1
1 511 . 6 1 1 A 50 50 GLU C C 50 173.297 174.705 -1.408 1
1 512 . 6 1 1 A 50 50 GLU CA C 50 55.174 55.456 -0.282 1
1 513 . 6 1 1 A 50 50 GLU CB C 50 31.651 30.046 1.605 1
1 515 . 6 1 1 A 50 50 GLU N N 50 121.600 121.691 -0.091 1
1 516 . 6 1 1 A 51 51 TYR H H 51 9.452 9.229 0.223 1
1 517 . 6 1 1 A 51 51 TYR HA H 51 5.382 5.365 0.017 1
1 524 . 6 1 1 A 51 51 TYR C C 51 174.387 175.398 -1.011 1
1 525 . 6 1 1 A 51 51 TYR CA C 51 57.592 57.188 0.404 1
1 526 . 6 1 1 A 51 51 TYR CB C 51 41.820 41.004 0.816 1
1 531 . 6 1 1 A 51 51 TYR N N 51 125.790 126.775 -0.985 1
1 532 . 6 1 1 A 52 52 VAL H H 52 9.471 9.356 0.115 1
1 533 . 6 1 1 A 52 52 VAL HA H 52 4.840 4.959 -0.119 1
1 541 . 6 1 1 A 52 52 VAL C C 52 174.947 174.431 0.516 1
1 542 . 6 1 1 A 52 52 VAL CA C 52 60.991 60.875 0.116 1
1 543 . 6 1 1 A 52 52 VAL CB C 52 36.829 35.117 1.712 1
1 546 . 6 1 1 A 52 52 VAL N N 52 120.617 122.113 -1.496 1
1 547 . 6 1 1 A 53 53 LEU H H 53 9.457 9.230 0.227 1
1 548 . 6 1 1 A 53 53 LEU HA H 53 5.294 5.101 0.193 1
1 558 . 6 1 1 A 53 53 LEU C C 53 175.024 174.888 0.136 1
1 559 . 6 1 1 A 53 53 LEU CA C 53 53.904 54.675 -0.771 1
1 560 . 6 1 1 A 53 53 LEU CB C 53 44.756 44.378 0.378 1
1 564 . 6 1 1 A 53 53 LEU N N 53 127.725 131.311 -3.586 1
1 565 . 6 1 1 A 54 54 SER H H 54 9.461 9.130 0.331 1
1 566 . 6 1 1 A 54 54 SER HA H 54 5.691 5.342 0.349 1
1 569 . 6 1 1 A 54 54 SER C C 54 172.227 173.346 -1.119 1
1 570 . 6 1 1 A 54 54 SER CA C 54 58.551 57.856 0.695 1
1 571 . 6 1 1 A 54 54 SER CB C 54 65.738 64.885 0.853 1
1 572 . 6 1 1 A 54 54 SER N N 54 127.178 124.432 2.746 1
1 573 . 6 1 1 A 55 55 VAL H H 55 9.049 8.963 0.086 1
1 574 . 6 1 1 A 55 55 VAL HA H 55 5.691 5.370 0.321 1
1 582 . 6 1 1 A 55 55 VAL C C 55 173.959 172.894 1.065 1
1 583 . 6 1 1 A 55 55 VAL CA C 55 58.398 59.854 -1.456 1
1 584 . 6 1 1 A 55 55 VAL CB C 55 36.262 35.948 0.314 1
1 587 . 6 1 1 A 55 55 VAL N N 55 120.619 123.528 -2.909 1
1 588 . 6 1 1 A 56 56 TYR H H 56 8.629 9.050 -0.421 1
1 589 . 6 1 1 A 56 56 TYR HA H 56 4.951 4.879 0.072 1
1 596 . 6 1 1 A 56 56 TYR C C 56 175.224 174.667 0.557 1
1 597 . 6 1 1 A 56 56 TYR CA C 56 56.684 56.564 0.120 1
1 598 . 6 1 1 A 56 56 TYR CB C 56 39.646 38.973 0.673 1
1 603 . 6 1 1 A 56 56 TYR N N 56 127.444 129.884 -2.440 1
1 604 . 6 1 1 A 57 57 SER H H 57 8.869 8.760 0.109 1
1 605 . 6 1 1 A 57 57 SER HA H 57 4.739 4.802 -0.063 1
1 608 . 6 1 1 A 57 57 SER C C 57 174.492 172.705 1.787 1
1 609 . 6 1 1 A 57 57 SER CA C 57 57.591 56.967 0.624 1
1 610 . 6 1 1 A 57 57 SER CB C 57 64.281 66.397 -2.116 1
1 611 . 6 1 1 A 57 57 SER N N 57 122.165 123.009 -0.844 1
1 612 . 6 1 1 A 58 58 ASP H H 58 10.446 9.326 1.120 1
1 613 . 6 1 1 A 58 58 ASP HA H 58 4.382 4.315 0.067 1
1 616 . 6 1 1 A 58 58 ASP C C 58 176.398 176.229 0.169 1
1 617 . 6 1 1 A 58 58 ASP CA C 58 55.215 55.275 -0.060 1
1 618 . 6 1 1 A 58 58 ASP CB C 58 39.513 39.307 0.206 1
1 619 . 6 1 1 A 58 58 ASP N N 58 132.098 128.125 3.973 1
1 620 . 6 1 1 A 59 59 GLY H H 59 7.861 8.477 -0.616 1
1 621 . 6 1 1 A 59 59 GLY HA2 H 59 3.817 3.706 0.111 1
1 622 . 6 1 1 A 59 59 GLY HA3 H 59 4.086 3.758 0.328 1
1 623 . 6 1 1 A 59 59 GLY C C 59 173.111 173.453 -0.342 1
1 624 . 6 1 1 A 59 59 GLY CA C 59 45.486 45.231 0.255 1
1 625 . 6 1 1 A 59 59 GLY N N 59 102.674 104.447 -1.773 1
1 626 . 6 1 1 A 60 60 GLN H H 60 7.137 7.514 -0.377 1
1 627 . 6 1 1 A 60 60 GLN HA H 60 4.455 4.626 -0.171 1
1 634 . 6 1 1 A 60 60 GLN C C 60 173.549 174.538 -0.989 1
1 635 . 6 1 1 A 60 60 GLN CA C 60 53.388 53.419 -0.031 1
1 636 . 6 1 1 A 60 60 GLN CB C 60 32.373 31.865 0.508 1
1 638 . 6 1 1 A 60 60 GLN N N 60 116.206 118.879 -2.673 1
1 640 . 6 1 1 A 61 61 ARG H H 61 8.589 8.356 0.233 1
1 641 . 6 1 1 A 61 61 ARG HA H 61 4.740 4.403 0.337 1
1 649 . 6 1 1 A 61 61 ARG C C 61 174.458 174.679 -0.221 1
1 650 . 6 1 1 A 61 61 ARG CA C 61 57.116 55.814 1.302 1
1 651 . 6 1 1 A 61 61 ARG CB C 61 29.615 30.728 -1.113 1
1 654 . 6 1 1 A 61 61 ARG N N 61 120.467 121.957 -1.490 1
1 656 . 6 1 1 A 62 62 ARG H H 62 8.867 8.941 -0.074 1
1 657 . 6 1 1 A 62 62 ARG HA H 62 4.297 4.491 -0.194 1
1 665 . 6 1 1 A 62 62 ARG C C 62 173.485 174.824 -1.339 1
1 666 . 6 1 1 A 62 62 ARG CA C 62 53.355 54.898 -1.543 1
1 667 . 6 1 1 A 62 62 ARG CB C 62 33.028 32.155 0.873 1
1 670 . 6 1 1 A 62 62 ARG N N 62 122.641 124.601 -1.960 1
1 672 . 6 1 1 A 63 63 HIS H H 63 7.997 8.553 -0.556 1
1 673 . 6 1 1 A 63 63 HIS HA H 63 5.427 5.494 -0.067 1
1 678 . 6 1 1 A 63 63 HIS C C 63 174.946 173.839 1.107 1
1 679 . 6 1 1 A 63 63 HIS CA C 63 54.689 53.864 0.825 1
1 680 . 6 1 1 A 63 63 HIS CB C 63 33.008 32.242 0.766 1
1 683 . 6 1 1 A 63 63 HIS N N 63 119.064 120.135 -1.071 1
1 684 . 6 1 1 A 64 64 PHE H H 64 9.880 9.329 0.551 1
1 685 . 6 1 1 A 64 64 PHE HA H 64 4.824 5.099 -0.275 1
1 693 . 6 1 1 A 64 64 PHE C C 64 174.882 175.379 -0.497 1
1 694 . 6 1 1 A 64 64 PHE CA C 64 56.489 56.675 -0.186 1
1 695 . 6 1 1 A 64 64 PHE CB C 64 41.405 40.786 0.619 1
1 701 . 6 1 1 A 64 64 PHE N N 64 123.961 122.315 1.646 1
1 702 . 6 1 1 A 65 65 ILE H H 65 8.982 9.012 -0.030 1
1 703 . 6 1 1 A 65 65 ILE HA H 65 4.273 4.420 -0.147 1
1 713 . 6 1 1 A 65 65 ILE C C 65 176.556 175.988 0.568 1
1 714 . 6 1 1 A 65 65 ILE CA C 65 62.649 62.083 0.566 1
1 715 . 6 1 1 A 65 65 ILE CB C 65 38.296 37.989 0.307 1
1 719 . 6 1 1 A 65 65 ILE N N 65 126.601 125.279 1.322 1
1 720 . 6 1 1 A 66 66 ILE H H 66 8.947 8.862 0.085 1
1 721 . 6 1 1 A 66 66 ILE HA H 66 3.780 4.231 -0.451 1
1 731 . 6 1 1 A 66 66 ILE C C 66 175.721 175.751 -0.030 1
1 732 . 6 1 1 A 66 66 ILE CA C 66 62.960 60.842 2.118 1
1 733 . 6 1 1 A 66 66 ILE CB C 66 37.209 38.192 -0.983 1
1 737 . 6 1 1 A 66 66 ILE N N 66 130.139 129.141 0.998 1
1 738 . 6 1 1 A 67 67 GLN H H 67 8.410 8.620 -0.210 1
1 739 . 6 1 1 A 67 67 GLN HA H 67 4.422 4.764 -0.342 1
1 746 . 6 1 1 A 67 67 GLN C C 67 174.347 174.707 -0.360 1
1 747 . 6 1 1 A 67 67 GLN CA C 67 55.867 55.763 0.104 1
1 748 . 6 1 1 A 67 67 GLN CB C 67 29.950 29.442 0.508 1
1 750 . 6 1 1 A 67 67 GLN N N 67 128.872 127.201 1.671 1
1 752 . 6 1 1 A 68 68 TYR H H 68 8.619 8.984 -0.365 1
1 753 . 6 1 1 A 68 68 TYR HA H 68 5.300 4.801 0.499 1
1 760 . 6 1 1 A 68 68 TYR C C 68 174.695 174.271 0.424 1
1 761 . 6 1 1 A 68 68 TYR CA C 68 55.579 56.418 -0.839 1
1 762 . 6 1 1 A 68 68 TYR CB C 68 39.479 38.654 0.825 1
1 767 . 6 1 1 A 68 68 TYR N N 68 124.772 126.185 -1.413 1
1 768 . 6 1 1 A 69 69 VAL H H 69 8.539 8.582 -0.043 1
1 769 . 6 1 1 A 69 69 VAL HA H 69 4.046 4.376 -0.330 1
1 777 . 6 1 1 A 69 69 VAL C C 69 175.010 175.360 -0.350 1
1 778 . 6 1 1 A 69 69 VAL CA C 69 60.611 60.958 -0.347 1
1 779 . 6 1 1 A 69 69 VAL CB C 69 35.358 34.332 1.026 1
1 782 . 6 1 1 A 69 69 VAL N N 69 126.652 127.610 -0.958 1
1 783 . 6 1 1 A 70 70 ASP H H 70 9.089 9.318 -0.229 1
1 784 . 6 1 1 A 70 70 ASP HA H 70 4.025 4.206 -0.181 1
1 787 . 6 1 1 A 70 70 ASP C C 70 174.813 175.030 -0.217 1
1 788 . 6 1 1 A 70 70 ASP CA C 70 55.623 55.516 0.107 1
1 789 . 6 1 1 A 70 70 ASP CB C 70 39.081 39.221 -0.140 1
1 790 . 6 1 1 A 70 70 ASP N N 70 128.327 128.985 -0.658 1
1 791 . 6 1 1 A 71 71 ASN H H 71 8.128 8.095 0.033 1
1 792 . 6 1 1 A 71 71 ASN HA H 71 3.597 3.433 0.164 1
1 797 . 6 1 1 A 71 71 ASN C C 71 173.250 173.563 -0.313 1
1 798 . 6 1 1 A 71 71 ASN CA C 71 54.728 54.206 0.522 1
1 799 . 6 1 1 A 71 71 ASN CB C 71 37.601 37.063 0.538 1
1 800 . 6 1 1 A 71 71 ASN N N 71 107.230 107.873 -0.643 1
1 802 . 6 1 1 A 72 72 MET H H 72 7.256 7.295 -0.039 1
1 803 . 6 1 1 A 72 72 MET HA H 72 4.740 4.702 0.038 1
1 808 . 6 1 1 A 72 72 MET C C 72 173.780 174.845 -1.065 1
1 809 . 6 1 1 A 72 72 MET CA C 72 53.703 53.994 -0.291 1
1 810 . 6 1 1 A 72 72 MET CB C 72 36.570 34.835 1.735 1
1 812 . 6 1 1 A 72 72 MET N N 72 117.117 116.791 0.326 1
1 813 . 6 1 1 A 73 73 TYR H H 73 9.430 9.210 0.220 1
1 814 . 6 1 1 A 73 73 TYR HA H 73 5.718 5.177 0.541 1
1 821 . 6 1 1 A 73 73 TYR C C 73 176.140 175.699 0.441 1
1 822 . 6 1 1 A 73 73 TYR CA C 73 57.290 57.209 0.081 1
1 823 . 6 1 1 A 73 73 TYR CB C 73 40.013 39.542 0.471 1
1 828 . 6 1 1 A 73 73 TYR N N 73 119.856 121.100 -1.244 1
1 829 . 6 1 1 A 74 74 ARG H H 74 9.038 8.604 0.434 1
1 830 . 6 1 1 A 74 74 ARG HA H 74 4.867 4.971 -0.104 1
1 838 . 6 1 1 A 74 74 ARG C C 74 173.954 174.714 -0.760 1
1 839 . 6 1 1 A 74 74 ARG CA C 74 54.887 54.108 0.779 1
1 840 . 6 1 1 A 74 74 ARG CB C 74 34.484 34.398 0.086 1
1 843 . 6 1 1 A 74 74 ARG N N 74 117.344 121.428 -4.084 1
1 845 . 6 1 1 A 75 75 PHE H H 75 9.005 8.796 0.209 1
1 846 . 6 1 1 A 75 75 PHE HA H 75 5.046 4.849 0.197 1
1 854 . 6 1 1 A 75 75 PHE C C 75 176.186 177.097 -0.911 1
1 855 . 6 1 1 A 75 75 PHE CA C 75 59.658 59.201 0.457 1
1 856 . 6 1 1 A 75 75 PHE CB C 75 39.356 40.015 -0.659 1
1 862 . 6 1 1 A 75 75 PHE N N 75 117.865 118.467 -0.602 1
1 863 . 6 1 1 A 76 76 GLU H H 76 8.213 8.046 0.167 1
1 864 . 6 1 1 A 76 76 GLU HA H 76 4.586 4.161 0.425 1
1 869 . 6 1 1 A 76 76 GLU C C 76 175.238 177.823 -2.585 1
1 870 . 6 1 1 A 76 76 GLU CA C 76 55.994 59.340 -3.346 1
1 871 . 6 1 1 A 76 76 GLU CB C 76 31.805 30.336 1.469 1
1 873 . 6 1 1 A 76 76 GLU N N 76 116.834 118.935 -2.101 1
1 874 . 6 1 1 A 77 77 GLY H H 77 8.692 7.738 0.954 1
1 875 . 6 1 1 A 77 77 GLY HA2 H 77 4.166 4.082 0.084 1
1 876 . 6 1 1 A 77 77 GLY HA3 H 77 4.015 4.082 -0.067 1
1 877 . 6 1 1 A 77 77 GLY C C 77 173.784 173.979 -0.195 1
1 878 . 6 1 1 A 77 77 GLY CA C 77 45.505 45.682 -0.177 1
1 879 . 6 1 1 A 77 77 GLY N N 77 111.937 106.663 5.274 1
1 880 . 6 1 1 A 78 78 THR H H 78 8.332 7.733 0.599 1
1 881 . 6 1 1 A 78 78 THR HA H 78 3.900 4.365 -0.465 1
1 886 . 6 1 1 A 78 78 THR C C 78 173.591 174.345 -0.754 1
1 887 . 6 1 1 A 78 78 THR CA C 78 63.653 62.542 1.111 1
1 888 . 6 1 1 A 78 78 THR CB C 78 69.649 69.588 0.061 1
1 890 . 6 1 1 A 78 78 THR N N 78 120.765 115.786 4.979 1
1 891 . 6 1 1 A 79 79 GLY H H 79 8.038 8.357 -0.319 1
1 892 . 6 1 1 A 79 79 GLY HA2 H 79 4.748 4.298 0.450 1
1 893 . 6 1 1 A 79 79 GLY HA3 H 79 3.546 4.410 -0.864 1
1 894 . 6 1 1 A 79 79 GLY C C 79 172.580 171.755 0.825 1
1 895 . 6 1 1 A 79 79 GLY CA C 79 44.661 45.848 -1.187 1
1 896 . 6 1 1 A 79 79 GLY N N 79 109.887 112.795 -2.908 1
1 897 . 6 1 1 A 80 80 PHE H H 80 9.064 8.317 0.747 1
1 898 . 6 1 1 A 80 80 PHE HA H 80 4.886 5.039 -0.153 1
1 906 . 6 1 1 A 80 80 PHE C C 80 176.507 176.140 0.367 1
1 907 . 6 1 1 A 80 80 PHE CA C 80 57.257 56.738 0.519 1
1 908 . 6 1 1 A 80 80 PHE CB C 80 44.655 42.860 1.795 1
1 914 . 6 1 1 A 80 80 PHE N N 80 116.862 119.702 -2.840 1
1 915 . 6 1 1 A 81 81 SER H H 81 9.413 8.737 0.676 1
1 916 . 6 1 1 A 81 81 SER HA H 81 4.622 4.425 0.197 1
1 919 . 6 1 1 A 81 81 SER C C 81 173.735 174.860 -1.125 1
1 920 . 6 1 1 A 81 81 SER CA C 81 61.410 61.584 -0.174 1
1 921 . 6 1 1 A 81 81 SER CB C 81 64.165 63.547 0.618 1
1 922 . 6 1 1 A 81 81 SER N N 81 116.467 116.227 0.240 1
1 923 . 6 1 1 A 82 82 ASN H H 82 7.688 8.191 -0.503 1
1 924 . 6 1 1 A 82 82 ASN HA H 82 4.952 5.200 -0.248 1
1 929 . 6 1 1 A 82 82 ASN C C 82 173.303 175.640 -2.337 1
1 930 . 6 1 1 A 82 82 ASN CA C 82 52.086 52.272 -0.186 1
1 931 . 6 1 1 A 82 82 ASN CB C 82 41.258 40.829 0.429 1
1 932 . 6 1 1 A 82 82 ASN N N 82 113.355 117.370 -4.015 1
1 934 . 6 1 1 A 83 83 ILE H H 83 8.858 8.717 0.141 1
1 935 . 6 1 1 A 83 83 ILE HA H 83 3.571 3.712 -0.141 1
1 945 . 6 1 1 A 83 83 ILE CA C 83 66.416 65.424 0.992 1
1 946 . 6 1 1 A 83 83 ILE CB C 83 35.074 34.700 0.374 1
1 950 . 6 1 1 A 83 83 ILE N N 83 118.908 122.574 -3.666 1
1 951 . 6 1 1 A 84 84 PRO HA H 84 4.411 4.655 -0.244 1
1 958 . 6 1 1 A 84 84 PRO C C 84 177.616 179.531 -1.915 1
1 959 . 6 1 1 A 84 84 PRO CA C 84 67.525 66.532 0.993 1
1 960 . 6 1 1 A 84 84 PRO CB C 84 31.029 30.887 0.142 1
1 963 . 6 1 1 A 85 85 GLN H H 85 8.405 8.225 0.180 1
1 964 . 6 1 1 A 85 85 GLN HA H 85 3.874 3.987 -0.113 1
1 971 . 6 1 1 A 85 85 GLN C C 85 178.213 178.138 0.075 1
1 972 . 6 1 1 A 85 85 GLN CA C 85 59.495 58.726 0.769 1
1 973 . 6 1 1 A 85 85 GLN CB C 85 29.270 28.212 1.058 1
1 975 . 6 1 1 A 85 85 GLN N N 85 115.597 117.313 -1.716 1
1 977 . 6 1 1 A 86 86 LEU H H 86 7.136 8.048 -0.912 1
1 978 . 6 1 1 A 86 86 LEU HA H 86 3.589 3.787 -0.198 1
1 988 . 6 1 1 A 86 86 LEU C C 86 177.728 178.504 -0.776 1
1 989 . 6 1 1 A 86 86 LEU CA C 86 58.136 58.340 -0.204 1
1 990 . 6 1 1 A 86 86 LEU CB C 86 42.290 41.824 0.466 1
1 994 . 6 1 1 A 86 86 LEU N N 86 121.840 121.807 0.033 1
1 995 . 6 1 1 A 87 87 ILE H H 87 8.323 8.120 0.203 1
1 996 . 6 1 1 A 87 87 ILE HA H 87 3.415 3.316 0.099 1
1 1006 . 6 1 1 A 87 87 ILE C C 87 178.064 177.579 0.485 1
1 1007 . 6 1 1 A 87 87 ILE CA C 87 61.458 65.385 -3.927 1
1 1008 . 6 1 1 A 87 87 ILE CB C 87 34.561 37.671 -3.110 1
1 1012 . 6 1 1 A 87 87 ILE N N 87 118.117 119.587 -1.470 1
1 1013 . 6 1 1 A 88 88 ASP H H 88 8.805 8.425 0.380 1
1 1014 . 6 1 1 A 88 88 ASP HA H 88 4.548 4.275 0.273 1
1 1017 . 6 1 1 A 88 88 ASP C C 88 179.265 178.062 1.203 1
1 1018 . 6 1 1 A 88 88 ASP CA C 88 58.099 57.295 0.804 1
1 1019 . 6 1 1 A 88 88 ASP CB C 88 42.166 41.694 0.472 1
1 1020 . 6 1 1 A 88 88 ASP N N 88 119.143 120.532 -1.389 1
1 1021 . 6 1 1 A 89 89 HIS H H 89 8.113 7.982 0.131 1
1 1022 . 6 1 1 A 89 89 HIS HA H 89 4.225 4.281 -0.056 1
1 1026 . 6 1 1 A 89 89 HIS C C 89 179.261 176.968 2.293 1
1 1027 . 6 1 1 A 89 89 HIS CA C 89 60.647 59.151 1.496 1
1 1028 . 6 1 1 A 89 89 HIS CB C 89 30.801 30.284 0.517 1
1 1030 . 6 1 1 A 89 89 HIS N N 89 119.595 119.248 0.347 1
1 1031 . 6 1 1 A 90 90 HIS H H 90 7.685 7.984 -0.299 1
1 1032 . 6 1 1 A 90 90 HIS HA H 90 3.628 4.077 -0.449 1
1 1036 . 6 1 1 A 90 90 HIS C C 90 178.454 177.339 1.115 1
1 1037 . 6 1 1 A 90 90 HIS CA C 90 61.797 60.569 1.228 1
1 1038 . 6 1 1 A 90 90 HIS CB C 90 28.165 30.669 -2.504 1
1 1040 . 6 1 1 A 90 90 HIS N N 90 120.061 116.941 3.120 1
1 1041 . 6 1 1 A 91 91 TYR H H 91 9.394 8.361 1.033 1
1 1042 . 6 1 1 A 91 91 TYR HA H 91 4.238 3.880 0.358 1
1 1049 . 6 1 1 A 91 91 TYR C C 91 176.443 177.611 -1.168 1
1 1050 . 6 1 1 A 91 91 TYR CA C 91 60.669 61.873 -1.204 1
1 1051 . 6 1 1 A 91 91 TYR CB C 91 39.169 38.627 0.542 1
1 1056 . 6 1 1 A 91 91 TYR N N 91 123.532 120.111 3.421 1
1 1057 . 6 1 1 A 92 92 THR H H 92 8.774 8.465 0.309 1
1 1058 . 6 1 1 A 92 92 THR HA H 92 3.866 3.924 -0.058 1
1 1063 . 6 1 1 A 92 92 THR C C 92 177.050 176.250 0.800 1
1 1064 . 6 1 1 A 92 92 THR CA C 92 65.240 65.419 -0.179 1
1 1065 . 6 1 1 A 92 92 THR CB C 92 69.298 68.016 1.282 1
1 1067 . 6 1 1 A 92 92 THR N N 92 112.000 112.870 -0.870 1
1 1068 . 6 1 1 A 93 93 THR H H 93 7.617 7.740 -0.123 1
1 1069 . 6 1 1 A 93 93 THR HA H 93 4.133 4.114 0.019 1
1 1074 . 6 1 1 A 93 93 THR C C 93 176.234 174.817 1.417 1
1 1075 . 6 1 1 A 93 93 THR CA C 93 63.527 62.554 0.973 1
1 1076 . 6 1 1 A 93 93 THR CB C 93 71.234 69.686 1.548 1
1 1078 . 6 1 1 A 93 93 THR N N 93 109.883 113.151 -3.268 1
1 1079 . 6 1 1 A 94 94 LYS H H 94 7.210 7.790 -0.580 1
1 1080 . 6 1 1 A 94 94 LYS HA H 94 3.830 3.773 0.057 1
1 1089 . 6 1 1 A 94 94 LYS C C 94 174.331 175.017 -0.686 1
1 1090 . 6 1 1 A 94 94 LYS CA C 94 56.776 57.365 -0.589 1
1 1091 . 6 1 1 A 94 94 LYS CB C 94 28.095 31.002 -2.907 1
1 1095 . 6 1 1 A 94 94 LYS N N 94 112.818 121.340 -8.522 1
1 1096 . 6 1 1 A 95 95 GLN H H 95 7.439 7.720 -0.281 1
1 1097 . 6 1 1 A 95 95 GLN HA H 95 4.216 4.465 -0.249 1
1 1104 . 6 1 1 A 95 95 GLN C C 95 179.087 175.983 3.104 1
1 1105 . 6 1 1 A 95 95 GLN CA C 95 56.378 55.271 1.107 1
1 1106 . 6 1 1 A 95 95 GLN CB C 95 28.542 29.863 -1.321 1
1 1108 . 6 1 1 A 95 95 GLN N N 95 117.860 119.022 -1.162 1
1 1110 . 6 1 1 A 96 96 VAL H H 96 8.520 8.582 -0.062 1
1 1111 . 6 1 1 A 96 96 VAL HA H 96 4.297 4.645 -0.348 1
1 1119 . 6 1 1 A 96 96 VAL C C 96 177.329 176.958 0.371 1
1 1120 . 6 1 1 A 96 96 VAL CA C 96 61.196 61.664 -0.468 1
1 1121 . 6 1 1 A 96 96 VAL CB C 96 32.735 33.497 -0.762 1
1 1124 . 6 1 1 A 96 96 VAL N N 96 124.208 120.181 4.027 1
1 1125 . 6 1 1 A 97 97 ILE H H 97 8.491 8.341 0.150 1
1 1126 . 6 1 1 A 97 97 ILE HA H 97 2.995 3.675 -0.680 1
1 1136 . 6 1 1 A 97 97 ILE CA C 97 62.066 63.043 -0.977 1
1 1137 . 6 1 1 A 97 97 ILE CB C 97 36.117 38.024 -1.907 1
1 1141 . 6 1 1 A 97 97 ILE N N 97 119.561 123.495 -3.934 1
1 1142 . 6 1 1 A 98 98 THR HA H 98 4.460 4.693 -0.233 1
1 1147 . 6 1 1 A 98 98 THR C C 98 174.335 174.579 -0.244 1
1 1148 . 6 1 1 A 98 98 THR CA C 98 58.244 59.332 -1.088 1
1 1149 . 6 1 1 A 98 98 THR CB C 98 73.056 72.482 0.574 1
1 1151 . 6 1 1 A 99 99 LYS H H 99 9.761 8.847 0.914 1
1 1152 . 6 1 1 A 99 99 LYS HA H 99 3.911 3.982 -0.071 1
1 1161 . 6 1 1 A 99 99 LYS C C 99 179.594 178.828 0.766 1
1 1162 . 6 1 1 A 99 99 LYS CA C 99 59.661 58.897 0.764 1
1 1163 . 6 1 1 A 99 99 LYS CB C 99 31.978 32.082 -0.104 1
1 1167 . 6 1 1 A 99 99 LYS N N 99 125.750 121.579 4.171 1
1 1168 . 6 1 1 A 100 100 LYS H H 100 8.910 7.618 1.292 1
1 1169 . 6 1 1 A 100 100 LYS HA H 100 4.024 4.067 -0.043 1
1 1178 . 6 1 1 A 100 100 LYS C C 100 178.060 178.093 -0.033 1
1 1179 . 6 1 1 A 100 100 LYS CA C 100 58.642 58.553 0.089 1
1 1180 . 6 1 1 A 100 100 LYS CB C 100 32.750 32.080 0.670 1
1 1184 . 6 1 1 A 100 100 LYS N N 100 117.112 120.622 -3.510 1
1 1185 . 6 1 1 A 101 101 SER H H 101 7.721 7.620 0.101 1
1 1186 . 6 1 1 A 101 101 SER HA H 101 4.282 4.653 -0.371 1
1 1189 . 6 1 1 A 101 101 SER C C 101 176.403 175.924 0.479 1
1 1190 . 6 1 1 A 101 101 SER CA C 101 60.442 58.668 1.774 1
1 1191 . 6 1 1 A 101 101 SER CB C 101 63.775 65.070 -1.295 1
1 1192 . 6 1 1 A 101 101 SER N N 101 112.069 111.216 0.853 1
1 1193 . 6 1 1 A 102 102 GLY H H 102 8.038 8.469 -0.431 1
1 1194 . 6 1 1 A 102 102 GLY HA2 H 102 4.024 3.908 0.116 1
1 1195 . 6 1 1 A 102 102 GLY HA3 H 102 3.713 3.925 -0.212 1
1 1196 . 6 1 1 A 102 102 GLY C C 102 173.991 174.784 -0.793 1
1 1197 . 6 1 1 A 102 102 GLY CA C 102 46.458 46.117 0.341 1
1 1198 . 6 1 1 A 102 102 GLY N N 102 111.144 111.158 -0.014 1
1 1199 . 6 1 1 A 103 103 VAL H H 103 7.155 7.589 -0.434 1
1 1200 . 6 1 1 A 103 103 VAL HA H 103 3.652 3.940 -0.288 1
1 1208 . 6 1 1 A 103 103 VAL C C 103 173.805 175.352 -1.547 1
1 1209 . 6 1 1 A 103 103 VAL CA C 103 64.310 62.858 1.452 1
1 1210 . 6 1 1 A 103 103 VAL CB C 103 32.254 31.761 0.493 1
1 1213 . 6 1 1 A 103 103 VAL N N 103 119.836 122.400 -2.564 1
1 1214 . 6 1 1 A 104 104 VAL H H 104 7.653 9.008 -1.355 1
1 1215 . 6 1 1 A 104 104 VAL HA H 104 4.048 4.469 -0.421 1
1 1223 . 6 1 1 A 104 104 VAL C C 104 175.708 174.454 1.254 1
1 1224 . 6 1 1 A 104 104 VAL CA C 104 60.275 60.963 -0.688 1
1 1225 . 6 1 1 A 104 104 VAL CB C 104 35.112 34.254 0.858 1
1 1228 . 6 1 1 A 104 104 VAL N N 104 125.859 128.077 -2.218 1
1 1229 . 6 1 1 A 105 105 LEU H H 105 8.616 8.471 0.145 1
1 1230 . 6 1 1 A 105 105 LEU HA H 105 3.905 4.662 -0.757 1
1 1240 . 6 1 1 A 105 105 LEU C C 105 175.380 175.791 -0.411 1
1 1241 . 6 1 1 A 105 105 LEU CA C 105 54.471 53.744 0.727 1
1 1242 . 6 1 1 A 105 105 LEU CB C 105 39.821 41.142 -1.321 1
1 1246 . 6 1 1 A 105 105 LEU N N 105 123.839 126.827 -2.988 1
1 1247 . 6 1 1 A 106 106 LEU H H 106 8.894 8.510 0.384 1
1 1248 . 6 1 1 A 106 106 LEU HA H 106 4.839 5.099 -0.260 1
1 1258 . 6 1 1 A 106 106 LEU C C 106 176.930 176.292 0.638 1
1 1259 . 6 1 1 A 106 106 LEU CA C 106 56.288 53.190 3.098 1
1 1260 . 6 1 1 A 106 106 LEU CB C 106 45.237 45.540 -0.303 1
1 1264 . 6 1 1 A 106 106 LEU N N 106 120.590 121.706 -1.116 1
1 1265 . 6 1 1 A 107 107 ASN H H 107 8.124 9.012 -0.888 1
1 1266 . 6 1 1 A 107 107 ASN HA H 107 5.650 4.604 1.046 1
1 1271 . 6 1 1 A 107 107 ASN CA C 107 50.293 53.949 -3.656 1
1 1272 . 6 1 1 A 107 107 ASN CB C 107 41.223 36.180 5.043 1
1 1273 . 6 1 1 A 107 107 ASN N N 107 116.866 118.606 -1.740 1
1 1275 . 6 1 1 A 108 108 PRO HA H 108 2.926 3.791 -0.865 1
1 1282 . 6 1 1 A 108 108 PRO C C 108 176.671 175.468 1.203 1
1 1283 . 6 1 1 A 108 108 PRO CA C 108 60.804 62.410 -1.606 1
1 1284 . 6 1 1 A 108 108 PRO CB C 108 31.774 32.059 -0.285 1
1 1287 . 6 1 1 A 109 109 ILE H H 109 8.648 7.837 0.811 1
1 1288 . 6 1 1 A 109 109 ILE HA H 109 4.519 4.530 -0.011 1
1 1298 . 6 1 1 A 109 109 ILE CA C 109 55.070 58.224 -3.154 1
1 1299 . 6 1 1 A 109 109 ILE CB C 109 36.068 38.466 -2.398 1
1 1303 . 6 1 1 A 109 109 ILE N N 109 128.817 123.220 5.597 1
1 1304 . 6 1 1 A 110 110 PRO HA H 110 4.587 4.539 0.048 1
1 1311 . 6 1 1 A 110 110 PRO C C 110 177.013 175.651 1.362 1
1 1312 . 6 1 1 A 110 110 PRO CA C 110 61.850 62.141 -0.291 1
1 1313 . 6 1 1 A 110 110 PRO CB C 110 32.507 32.957 -0.450 1
1 1316 . 6 1 1 A 111 111 LYS H H 111 8.038 8.341 -0.303 1
1 1317 . 6 1 1 A 111 111 LYS HA H 111 3.553 5.142 -1.589 1
1 1326 . 6 1 1 A 111 111 LYS C C 111 176.123 174.164 1.959 1
1 1327 . 6 1 1 A 111 111 LYS CA C 111 56.220 53.772 2.448 1
1 1328 . 6 1 1 A 111 111 LYS CB C 111 32.373 36.601 -4.228 1
1 1332 . 6 1 1 A 111 111 LYS N N 111 120.147 115.863 4.284 1
1 1333 . 6 1 1 A 112 112 ASP H H 112 8.463 8.600 -0.137 1
1 1334 . 6 1 1 A 112 112 ASP HA H 112 4.523 4.933 -0.410 1
1 1337 . 6 1 1 A 112 112 ASP C C 112 175.986 174.397 1.589 1
1 1338 . 6 1 1 A 112 112 ASP CA C 112 54.256 52.782 1.474 1
1 1339 . 6 1 1 A 112 112 ASP CB C 112 41.563 44.779 -3.216 1
1 1340 . 6 1 1 A 112 112 ASP N N 112 121.863 119.115 2.748 1
1 1341 . 6 1 1 A 113 113 LYS H H 113 8.059 8.490 -0.431 1
1 1342 . 6 1 1 A 113 113 LYS HA H 113 4.136 4.462 -0.326 1
1 1351 . 6 1 1 A 113 113 LYS C C 113 176.010 176.615 -0.605 1
1 1352 . 6 1 1 A 113 113 LYS CA C 113 56.253 55.742 0.511 1
1 1353 . 6 1 1 A 113 113 LYS CB C 113 32.754 33.213 -0.459 1
1 1357 . 6 1 1 A 113 113 LYS N N 113 121.725 120.578 1.147 1
1 1358 . 6 1 1 A 114 114 LYS H H 114 8.225 7.322 0.903 1
1 1359 . 6 1 1 A 114 114 LYS HA H 114 4.169 4.474 -0.305 1
1 1368 . 6 1 1 A 114 114 LYS C C 114 176.198 176.232 -0.034 1
1 1369 . 6 1 1 A 114 114 LYS CA C 114 56.413 55.560 0.853 1
1 1370 . 6 1 1 A 114 114 LYS CB C 114 32.725 33.036 -0.311 1
1 1374 . 6 1 1 A 114 114 LYS N N 114 121.857 120.555 1.302 1
1 1375 . 6 1 1 A 115 115 TRP H H 115 8.078 9.129 -1.051 1
1 1376 . 6 1 1 A 115 115 TRP HA H 115 4.709 4.823 -0.114 1
1 1385 . 6 1 1 A 115 115 TRP C C 115 175.119 175.456 -0.337 1
1 1386 . 6 1 1 A 115 115 TRP CA C 115 56.856 55.864 0.992 1
1 1387 . 6 1 1 A 115 115 TRP CB C 115 29.474 27.067 2.407 1
1 1393 . 6 1 1 A 115 115 TRP N N 115 122.068 126.101 -4.033 1
1 1 . 7 1 1 A 10 10 HIS HA H 10 4.616 4.748 -0.132 1
1 4 . 7 1 1 A 10 10 HIS C C 10 174.981 175.357 -0.376 1
1 5 . 7 1 1 A 10 10 HIS CA C 10 56.555 56.906 -0.351 1
1 6 . 7 1 1 A 10 10 HIS CB C 10 30.231 30.502 -0.271 1
1 7 . 7 1 1 A 11 11 MET H H 11 8.103 8.578 -0.475 1
1 8 . 7 1 1 A 11 11 MET HA H 11 4.439 4.285 0.154 1
1 13 . 7 1 1 A 11 11 MET C C 11 175.888 176.062 -0.174 1
1 14 . 7 1 1 A 11 11 MET CA C 11 55.090 56.186 -1.096 1
1 15 . 7 1 1 A 11 11 MET CB C 11 33.121 33.513 -0.392 1
1 17 . 7 1 1 A 11 11 MET N N 11 120.743 121.722 -0.979 1
1 18 . 7 1 1 A 12 12 LYS H H 12 8.065 8.421 -0.356 1
1 19 . 7 1 1 A 12 12 LYS HA H 12 4.407 4.473 -0.066 1
1 28 . 7 1 1 A 12 12 LYS CA C 12 54.894 54.531 0.363 1
1 29 . 7 1 1 A 12 12 LYS CB C 12 31.863 31.845 0.018 1
1 33 . 7 1 1 A 12 12 LYS N N 12 123.187 126.570 -3.383 1
1 34 . 7 1 1 A 13 13 PRO HA H 13 4.347 4.446 -0.099 1
1 41 . 7 1 1 A 13 13 PRO C C 13 176.891 177.252 -0.361 1
1 42 . 7 1 1 A 13 13 PRO CA C 13 62.542 62.263 0.279 1
1 43 . 7 1 1 A 13 13 PRO CB C 13 32.663 33.460 -0.797 1
1 46 . 7 1 1 A 14 14 LEU H H 14 8.339 8.746 -0.407 1
1 47 . 7 1 1 A 14 14 LEU HA H 14 3.373 3.776 -0.403 1
1 57 . 7 1 1 A 14 14 LEU C C 14 176.683 178.224 -1.541 1
1 58 . 7 1 1 A 14 14 LEU CA C 14 58.555 57.497 1.058 1
1 59 . 7 1 1 A 14 14 LEU CB C 14 41.828 40.945 0.883 1
1 63 . 7 1 1 A 14 14 LEU N N 14 123.191 122.987 0.204 1
1 64 . 7 1 1 A 15 15 ALA H H 15 8.175 7.884 0.291 1
1 65 . 7 1 1 A 15 15 ALA HA H 15 3.983 4.021 -0.038 1
1 69 . 7 1 1 A 15 15 ALA C C 15 178.697 178.937 -0.240 1
1 70 . 7 1 1 A 15 15 ALA CA C 15 54.164 54.751 -0.587 1
1 71 . 7 1 1 A 15 15 ALA CB C 15 18.771 18.302 0.469 1
1 72 . 7 1 1 A 15 15 ALA N N 15 113.594 120.079 -6.485 1
1 73 . 7 1 1 A 16 16 GLU H H 16 7.458 7.513 -0.055 1
1 74 . 7 1 1 A 16 16 GLU HA H 16 4.266 4.348 -0.082 1
1 79 . 7 1 1 A 16 16 GLU C C 16 176.510 176.503 0.007 1
1 80 . 7 1 1 A 16 16 GLU CA C 16 55.196 56.648 -1.452 1
1 81 . 7 1 1 A 16 16 GLU CB C 16 30.907 29.955 0.952 1
1 83 . 7 1 1 A 16 16 GLU N N 16 113.348 114.836 -1.488 1
1 84 . 7 1 1 A 17 17 GLN H H 17 7.501 7.084 0.417 1
1 85 . 7 1 1 A 17 17 GLN HA H 17 3.683 4.157 -0.474 1
1 92 . 7 1 1 A 17 17 GLN C C 17 178.053 176.274 1.779 1
1 93 . 7 1 1 A 17 17 GLN CA C 17 54.606 54.742 -0.136 1
1 94 . 7 1 1 A 17 17 GLN CB C 17 25.758 28.765 -3.007 1
1 96 . 7 1 1 A 17 17 GLN N N 17 119.411 119.421 -0.010 1
1 98 . 7 1 1 A 18 18 ASP H H 18 8.949 8.628 0.321 1
1 99 . 7 1 1 A 18 18 ASP HA H 18 4.184 4.155 0.029 1
1 102 . 7 1 1 A 18 18 ASP C C 18 175.263 178.220 -2.957 1
1 103 . 7 1 1 A 18 18 ASP CA C 18 57.275 57.004 0.271 1
1 104 . 7 1 1 A 18 18 ASP CB C 18 40.620 40.419 0.201 1
1 105 . 7 1 1 A 18 18 ASP N N 18 124.676 122.195 2.481 1
1 106 . 7 1 1 A 19 19 TRP H H 19 6.068 7.336 -1.268 1
1 107 . 7 1 1 A 19 19 TRP HA H 19 5.045 4.639 0.406 1
1 116 . 7 1 1 A 19 19 TRP C C 19 175.902 176.319 -0.417 1
1 117 . 7 1 1 A 19 19 TRP CA C 19 53.542 57.633 -4.091 1
1 118 . 7 1 1 A 19 19 TRP CB C 19 29.179 28.818 0.361 1
1 124 . 7 1 1 A 19 19 TRP N N 19 107.757 118.208 -10.451 1
1 126 . 7 1 1 A 20 20 TYR H H 20 7.430 7.284 0.146 1
1 127 . 7 1 1 A 20 20 TYR HA H 20 5.601 5.129 0.472 1
1 132 . 7 1 1 A 20 20 TYR C C 20 175.498 175.599 -0.101 1
1 133 . 7 1 1 A 20 20 TYR CA C 20 56.967 56.699 0.268 1
1 134 . 7 1 1 A 20 20 TYR CB C 20 39.083 38.457 0.626 1
1 137 . 7 1 1 A 20 20 TYR N N 20 123.173 121.725 1.448 1
1 138 . 7 1 1 A 21 21 HIS H H 21 8.934 8.743 0.191 1
1 139 . 7 1 1 A 21 21 HIS HA H 21 4.295 4.476 -0.181 1
1 144 . 7 1 1 A 21 21 HIS C C 21 175.177 175.145 0.032 1
1 145 . 7 1 1 A 21 21 HIS CA C 21 56.572 56.104 0.468 1
1 146 . 7 1 1 A 21 21 HIS CB C 21 33.365 30.413 2.952 1
1 149 . 7 1 1 A 21 21 HIS N N 21 125.732 127.127 -1.395 1
1 150 . 7 1 1 A 22 22 GLY H H 22 5.280 7.091 -1.811 1
1 151 . 7 1 1 A 22 22 GLY HA2 H 22 3.905 3.331 0.574 1
1 152 . 7 1 1 A 22 22 GLY HA3 H 22 3.585 3.733 -0.148 1
1 153 . 7 1 1 A 22 22 GLY C C 22 174.411 173.706 0.705 1
1 154 . 7 1 1 A 22 22 GLY CA C 22 46.402 43.956 2.446 1
1 155 . 7 1 1 A 22 22 GLY N N 22 104.568 106.442 -1.874 1
1 156 . 7 1 1 A 23 23 ALA H H 23 8.768 8.064 0.704 1
1 157 . 7 1 1 A 23 23 ALA HA H 23 5.171 4.686 0.485 1
1 161 . 7 1 1 A 23 23 ALA C C 23 177.180 176.468 0.712 1
1 162 . 7 1 1 A 23 23 ALA CA C 23 51.153 51.294 -0.141 1
1 163 . 7 1 1 A 23 23 ALA CB C 23 16.999 17.493 -0.494 1
1 164 . 7 1 1 A 23 23 ALA N N 23 130.297 123.644 6.653 1
1 165 . 7 1 1 A 24 24 ILE H H 24 7.267 8.047 -0.780 1
1 166 . 7 1 1 A 24 24 ILE HA H 24 4.460 4.921 -0.461 1
1 176 . 7 1 1 A 24 24 ILE CA C 24 58.529 57.691 0.838 1
1 177 . 7 1 1 A 24 24 ILE CB C 24 38.763 39.412 -0.649 1
1 181 . 7 1 1 A 24 24 ILE N N 24 118.903 117.934 0.969 1
1 182 . 7 1 1 A 25 25 PRO HA H 25 4.224 4.559 -0.335 1
1 189 . 7 1 1 A 25 25 PRO C C 25 176.918 177.538 -0.620 1
1 190 . 7 1 1 A 25 25 PRO CA C 25 62.907 62.530 0.377 1
1 191 . 7 1 1 A 25 25 PRO CB C 25 32.671 32.572 0.099 1
1 194 . 7 1 1 A 26 26 ARG H H 26 8.781 9.109 -0.328 1
1 195 . 7 1 1 A 26 26 ARG HA H 26 3.472 3.903 -0.431 1
1 202 . 7 1 1 A 26 26 ARG C C 26 178.112 177.933 0.179 1
1 203 . 7 1 1 A 26 26 ARG CA C 26 60.863 59.424 1.439 1
1 204 . 7 1 1 A 26 26 ARG CB C 26 30.314 29.950 0.364 1
1 207 . 7 1 1 A 26 26 ARG N N 26 124.635 121.922 2.713 1
1 208 . 7 1 1 A 27 27 ILE H H 27 8.540 8.111 0.429 1
1 209 . 7 1 1 A 27 27 ILE HA H 27 3.787 3.628 0.159 1
1 219 . 7 1 1 A 27 27 ILE C C 27 177.390 177.532 -0.142 1
1 220 . 7 1 1 A 27 27 ILE CA C 27 64.329 65.013 -0.684 1
1 221 . 7 1 1 A 27 27 ILE CB C 27 37.413 37.906 -0.493 1
1 225 . 7 1 1 A 27 27 ILE N N 27 115.859 120.146 -4.287 1
1 226 . 7 1 1 A 28 28 GLU H H 28 6.953 8.412 -1.459 1
1 227 . 7 1 1 A 28 28 GLU HA H 28 4.067 4.026 0.041 1
1 232 . 7 1 1 A 28 28 GLU C C 28 179.006 179.421 -0.415 1
1 233 . 7 1 1 A 28 28 GLU CA C 28 58.985 59.472 -0.487 1
1 234 . 7 1 1 A 28 28 GLU CB C 28 29.316 29.080 0.236 1
1 236 . 7 1 1 A 28 28 GLU N N 28 120.554 119.463 1.091 1
1 237 . 7 1 1 A 29 29 ALA H H 29 7.999 7.867 0.132 1
1 238 . 7 1 1 A 29 29 ALA HA H 29 3.822 4.005 -0.183 1
1 242 . 7 1 1 A 29 29 ALA C C 29 178.809 179.981 -1.172 1
1 243 . 7 1 1 A 29 29 ALA CA C 29 54.698 54.844 -0.146 1
1 244 . 7 1 1 A 29 29 ALA CB C 29 18.059 18.317 -0.258 1
1 245 . 7 1 1 A 29 29 ALA N N 29 120.122 122.856 -2.734 1
1 246 . 7 1 1 A 30 30 GLN H H 30 8.168 7.852 0.316 1
1 247 . 7 1 1 A 30 30 GLN HA H 30 3.811 4.176 -0.365 1
1 254 . 7 1 1 A 30 30 GLN C C 30 177.578 177.865 -0.287 1
1 255 . 7 1 1 A 30 30 GLN CA C 30 59.731 58.582 1.149 1
1 256 . 7 1 1 A 30 30 GLN CB C 30 28.161 28.698 -0.537 1
1 258 . 7 1 1 A 30 30 GLN N N 30 112.109 115.778 -3.669 1
1 260 . 7 1 1 A 31 31 GLU H H 31 7.248 8.203 -0.955 1
1 261 . 7 1 1 A 31 31 GLU HA H 31 4.063 4.079 -0.016 1
1 266 . 7 1 1 A 31 31 GLU C C 31 177.423 178.693 -1.270 1
1 267 . 7 1 1 A 31 31 GLU CA C 31 57.650 58.934 -1.284 1
1 268 . 7 1 1 A 31 31 GLU CB C 31 29.757 29.370 0.387 1
1 270 . 7 1 1 A 31 31 GLU N N 31 115.340 119.563 -4.223 1
1 271 . 7 1 1 A 32 32 LEU H H 32 7.169 7.692 -0.523 1
1 272 . 7 1 1 A 32 32 LEU HA H 32 4.087 4.488 -0.401 1
1 282 . 7 1 1 A 32 32 LEU C C 32 175.850 176.824 -0.974 1
1 283 . 7 1 1 A 32 32 LEU CA C 32 55.580 55.483 0.097 1
1 284 . 7 1 1 A 32 32 LEU CB C 32 42.910 42.298 0.612 1
1 288 . 7 1 1 A 32 32 LEU N N 32 116.367 113.802 2.565 1
1 289 . 7 1 1 A 33 33 LEU H H 33 7.062 7.626 -0.564 1
1 290 . 7 1 1 A 33 33 LEU HA H 33 4.431 4.395 0.036 1
1 300 . 7 1 1 A 33 33 LEU C C 33 174.837 176.859 -2.022 1
1 301 . 7 1 1 A 33 33 LEU CA C 33 53.521 54.582 -1.061 1
1 302 . 7 1 1 A 33 33 LEU CB C 33 43.301 41.374 1.927 1
1 306 . 7 1 1 A 33 33 LEU N N 33 118.568 122.394 -3.826 1
1 307 . 7 1 1 A 34 34 LYS H H 34 8.749 8.507 0.242 1
1 308 . 7 1 1 A 34 34 LYS HA H 34 4.162 4.271 -0.109 1
1 317 . 7 1 1 A 34 34 LYS C C 34 174.378 175.562 -1.184 1
1 318 . 7 1 1 A 34 34 LYS CA C 34 56.575 56.345 0.230 1
1 319 . 7 1 1 A 34 34 LYS CB C 34 36.918 34.245 2.673 1
1 323 . 7 1 1 A 34 34 LYS N N 34 121.659 118.533 3.126 1
1 324 . 7 1 1 A 35 35 LYS H H 35 8.137 7.550 0.587 1
1 325 . 7 1 1 A 35 35 LYS HA H 35 4.011 4.903 -0.892 1
1 334 . 7 1 1 A 35 35 LYS C C 35 174.343 175.794 -1.451 1
1 335 . 7 1 1 A 35 35 LYS CA C 35 53.960 54.629 -0.669 1
1 336 . 7 1 1 A 35 35 LYS CB C 35 35.587 35.212 0.375 1
1 340 . 7 1 1 A 35 35 LYS N N 35 119.354 116.277 3.077 1
1 341 . 7 1 1 A 36 36 GLN H H 36 8.394 8.729 -0.335 1
1 342 . 7 1 1 A 36 36 GLN HA H 36 4.187 4.766 -0.579 1
1 349 . 7 1 1 A 36 36 GLN C C 36 177.012 176.553 0.459 1
1 350 . 7 1 1 A 36 36 GLN CA C 36 57.750 57.637 0.113 1
1 351 . 7 1 1 A 36 36 GLN CB C 36 28.433 28.605 -0.172 1
1 353 . 7 1 1 A 36 36 GLN N N 36 120.248 123.063 -2.815 1
1 355 . 7 1 1 A 37 37 GLY H H 37 9.597 9.025 0.572 1
1 356 . 7 1 1 A 37 37 GLY HA2 H 37 4.486 4.147 0.339 1
1 357 . 7 1 1 A 37 37 GLY HA3 H 37 3.926 4.149 -0.223 1
1 358 . 7 1 1 A 37 37 GLY C C 37 176.285 174.680 1.605 1
1 359 . 7 1 1 A 37 37 GLY CA C 37 46.146 45.463 0.683 1
1 360 . 7 1 1 A 37 37 GLY N N 37 116.637 113.664 2.973 1
1 361 . 7 1 1 A 38 38 ASP H H 38 8.925 7.935 0.990 1
1 362 . 7 1 1 A 38 38 ASP HA H 38 5.697 4.776 0.921 1
1 365 . 7 1 1 A 38 38 ASP C C 38 176.181 175.741 0.440 1
1 366 . 7 1 1 A 38 38 ASP CA C 38 55.066 55.600 -0.534 1
1 367 . 7 1 1 A 38 38 ASP CB C 38 42.933 41.488 1.445 1
1 368 . 7 1 1 A 38 38 ASP N N 38 127.293 121.820 5.473 1
1 369 . 7 1 1 A 39 39 PHE H H 39 8.647 8.505 0.142 1
1 370 . 7 1 1 A 39 39 PHE HA H 39 6.025 6.002 0.023 1
1 378 . 7 1 1 A 39 39 PHE C C 39 170.948 173.081 -2.133 1
1 379 . 7 1 1 A 39 39 PHE CA C 39 56.376 56.129 0.247 1
1 380 . 7 1 1 A 39 39 PHE CB C 39 44.583 42.987 1.596 1
1 386 . 7 1 1 A 39 39 PHE N N 39 117.102 119.169 -2.067 1
1 387 . 7 1 1 A 40 40 LEU H H 40 9.186 9.009 0.177 1
1 388 . 7 1 1 A 40 40 LEU HA H 40 4.983 5.347 -0.364 1
1 398 . 7 1 1 A 40 40 LEU C C 40 174.787 174.638 0.149 1
1 399 . 7 1 1 A 40 40 LEU CA C 40 54.610 53.755 0.855 1
1 400 . 7 1 1 A 40 40 LEU CB C 40 44.330 45.919 -1.589 1
1 404 . 7 1 1 A 40 40 LEU N N 40 114.388 117.906 -3.518 1
1 405 . 7 1 1 A 41 41 VAL H H 41 9.390 9.346 0.044 1
1 406 . 7 1 1 A 41 41 VAL HA H 41 5.742 5.364 0.378 1
1 414 . 7 1 1 A 41 41 VAL C C 41 172.760 175.091 -2.331 1
1 415 . 7 1 1 A 41 41 VAL CA C 41 60.814 61.350 -0.536 1
1 416 . 7 1 1 A 41 41 VAL CB C 41 34.908 34.006 0.902 1
1 419 . 7 1 1 A 41 41 VAL N N 41 119.873 121.291 -1.418 1
1 420 . 7 1 1 A 42 42 ARG H H 42 9.598 9.281 0.317 1
1 421 . 7 1 1 A 42 42 ARG HA H 42 5.247 5.355 -0.108 1
1 429 . 7 1 1 A 42 42 ARG C C 42 173.379 174.145 -0.766 1
1 430 . 7 1 1 A 42 42 ARG CA C 42 53.202 53.860 -0.658 1
1 431 . 7 1 1 A 42 42 ARG CB C 42 33.507 34.239 -0.732 1
1 434 . 7 1 1 A 42 42 ARG N N 42 124.179 124.868 -0.689 1
1 436 . 7 1 1 A 43 43 GLU H H 43 8.234 8.749 -0.515 1
1 437 . 7 1 1 A 43 43 GLU HA H 43 4.890 5.027 -0.137 1
1 442 . 7 1 1 A 43 43 GLU C C 43 176.929 175.902 1.027 1
1 443 . 7 1 1 A 43 43 GLU CA C 43 54.846 54.741 0.105 1
1 444 . 7 1 1 A 43 43 GLU CB C 43 31.599 32.724 -1.125 1
1 446 . 7 1 1 A 43 43 GLU N N 43 124.103 121.822 2.281 1
1 447 . 7 1 1 A 44 44 SER H H 44 9.033 9.094 -0.061 1
1 448 . 7 1 1 A 44 44 SER HA H 44 3.957 4.653 -0.696 1
1 451 . 7 1 1 A 44 44 SER C C 44 175.005 174.678 0.327 1
1 452 . 7 1 1 A 44 44 SER CA C 44 59.393 57.914 1.479 1
1 453 . 7 1 1 A 44 44 SER CB C 44 63.619 63.863 -0.244 1
1 454 . 7 1 1 A 44 44 SER N N 44 124.316 121.365 2.951 1
1 455 . 7 1 1 A 45 45 HIS H H 45 8.461 9.055 -0.594 1
1 456 . 7 1 1 A 45 45 HIS HA H 45 4.132 4.459 -0.327 1
1 460 . 7 1 1 A 45 45 HIS C C 45 176.480 178.301 -1.821 1
1 461 . 7 1 1 A 45 45 HIS CA C 45 58.887 58.921 -0.034 1
1 462 . 7 1 1 A 45 45 HIS CB C 45 30.180 30.632 -0.452 1
1 464 . 7 1 1 A 45 45 HIS N N 45 127.694 126.600 1.094 1
1 465 . 7 1 1 A 46 46 GLY H H 46 8.513 8.322 0.191 1
1 466 . 7 1 1 A 46 46 GLY HA2 H 46 3.827 3.825 0.002 1
1 467 . 7 1 1 A 46 46 GLY HA3 H 46 3.827 3.831 -0.004 1
1 468 . 7 1 1 A 46 46 GLY C C 46 173.630 174.544 -0.914 1
1 469 . 7 1 1 A 46 46 GLY CA C 46 45.188 46.999 -1.811 1
1 470 . 7 1 1 A 46 46 GLY N N 46 110.761 107.165 3.596 1
1 471 . 7 1 1 A 47 47 LYS H H 47 7.216 7.641 -0.425 1
1 472 . 7 1 1 A 47 47 LYS HA H 47 4.540 4.632 -0.092 1
1 481 . 7 1 1 A 47 47 LYS CA C 47 53.475 52.686 0.789 1
1 482 . 7 1 1 A 47 47 LYS CB C 47 33.325 33.741 -0.416 1
1 486 . 7 1 1 A 47 47 LYS N N 47 121.356 120.144 1.212 1
1 487 . 7 1 1 A 48 48 PRO HA H 48 4.181 4.228 -0.047 1
1 494 . 7 1 1 A 48 48 PRO C C 48 178.920 177.495 1.425 1
1 495 . 7 1 1 A 48 48 PRO CA C 48 63.239 63.779 -0.540 1
1 496 . 7 1 1 A 48 48 PRO CB C 48 31.523 31.317 0.206 1
1 499 . 7 1 1 A 49 49 GLY H H 49 9.752 8.751 1.001 1
1 500 . 7 1 1 A 49 49 GLY HA2 H 49 4.053 3.842 0.211 1
1 501 . 7 1 1 A 49 49 GLY HA3 H 49 3.374 3.897 -0.523 1
1 502 . 7 1 1 A 49 49 GLY C C 49 172.093 174.291 -2.198 1
1 503 . 7 1 1 A 49 49 GLY CA C 49 45.041 45.084 -0.043 1
1 504 . 7 1 1 A 49 49 GLY N N 49 112.415 112.615 -0.200 1
1 505 . 7 1 1 A 50 50 GLU H H 50 7.623 8.014 -0.391 1
1 506 . 7 1 1 A 50 50 GLU HA H 50 4.537 4.473 0.064 1
1 511 . 7 1 1 A 50 50 GLU C C 50 173.297 175.667 -2.370 1
1 512 . 7 1 1 A 50 50 GLU CA C 50 55.174 56.078 -0.904 1
1 513 . 7 1 1 A 50 50 GLU CB C 50 31.651 30.076 1.575 1
1 515 . 7 1 1 A 50 50 GLU N N 50 121.600 121.862 -0.262 1
1 516 . 7 1 1 A 51 51 TYR H H 51 9.452 9.171 0.281 1
1 517 . 7 1 1 A 51 51 TYR HA H 51 5.382 5.590 -0.208 1
1 524 . 7 1 1 A 51 51 TYR C C 51 174.387 174.724 -0.337 1
1 525 . 7 1 1 A 51 51 TYR CA C 51 57.592 57.415 0.177 1
1 526 . 7 1 1 A 51 51 TYR CB C 51 41.820 40.390 1.430 1
1 531 . 7 1 1 A 51 51 TYR N N 51 125.790 127.357 -1.567 1
1 532 . 7 1 1 A 52 52 VAL H H 52 9.471 9.476 -0.005 1
1 533 . 7 1 1 A 52 52 VAL HA H 52 4.840 4.953 -0.113 1
1 541 . 7 1 1 A 52 52 VAL C C 52 174.947 175.112 -0.165 1
1 542 . 7 1 1 A 52 52 VAL CA C 52 60.991 61.386 -0.395 1
1 543 . 7 1 1 A 52 52 VAL CB C 52 36.829 33.844 2.985 1
1 546 . 7 1 1 A 52 52 VAL N N 52 120.617 123.624 -3.007 1
1 547 . 7 1 1 A 53 53 LEU H H 53 9.457 9.312 0.145 1
1 548 . 7 1 1 A 53 53 LEU HA H 53 5.294 5.191 0.103 1
1 558 . 7 1 1 A 53 53 LEU C C 53 175.024 174.818 0.206 1
1 559 . 7 1 1 A 53 53 LEU CA C 53 53.904 54.536 -0.632 1
1 560 . 7 1 1 A 53 53 LEU CB C 53 44.756 44.253 0.503 1
1 564 . 7 1 1 A 53 53 LEU N N 53 127.725 131.346 -3.621 1
1 565 . 7 1 1 A 54 54 SER H H 54 9.461 9.495 -0.034 1
1 566 . 7 1 1 A 54 54 SER HA H 54 5.691 5.230 0.461 1
1 569 . 7 1 1 A 54 54 SER C C 54 172.227 172.935 -0.708 1
1 570 . 7 1 1 A 54 54 SER CA C 54 58.551 57.876 0.675 1
1 571 . 7 1 1 A 54 54 SER CB C 54 65.738 64.644 1.094 1
1 572 . 7 1 1 A 54 54 SER N N 54 127.178 124.333 2.845 1
1 573 . 7 1 1 A 55 55 VAL H H 55 9.049 9.073 -0.024 1
1 574 . 7 1 1 A 55 55 VAL HA H 55 5.691 5.470 0.221 1
1 582 . 7 1 1 A 55 55 VAL C C 55 173.959 173.067 0.892 1
1 583 . 7 1 1 A 55 55 VAL CA C 55 58.398 59.438 -1.040 1
1 584 . 7 1 1 A 55 55 VAL CB C 55 36.262 34.690 1.572 1
1 587 . 7 1 1 A 55 55 VAL N N 55 120.619 126.206 -5.587 1
1 588 . 7 1 1 A 56 56 TYR H H 56 8.629 9.342 -0.713 1
1 589 . 7 1 1 A 56 56 TYR HA H 56 4.951 5.034 -0.083 1
1 596 . 7 1 1 A 56 56 TYR C C 56 175.224 174.797 0.427 1
1 597 . 7 1 1 A 56 56 TYR CA C 56 56.684 56.715 -0.031 1
1 598 . 7 1 1 A 56 56 TYR CB C 56 39.646 39.066 0.580 1
1 603 . 7 1 1 A 56 56 TYR N N 56 127.444 131.080 -3.636 1
1 604 . 7 1 1 A 57 57 SER H H 57 8.869 8.675 0.194 1
1 605 . 7 1 1 A 57 57 SER HA H 57 4.739 4.801 -0.062 1
1 608 . 7 1 1 A 57 57 SER C C 57 174.492 173.364 1.128 1
1 609 . 7 1 1 A 57 57 SER CA C 57 57.591 57.226 0.365 1
1 610 . 7 1 1 A 57 57 SER CB C 57 64.281 66.342 -2.061 1
1 611 . 7 1 1 A 57 57 SER N N 57 122.165 123.029 -0.864 1
1 612 . 7 1 1 A 58 58 ASP H H 58 10.446 9.397 1.049 1
1 613 . 7 1 1 A 58 58 ASP HA H 58 4.382 4.242 0.140 1
1 616 . 7 1 1 A 58 58 ASP C C 58 176.398 175.303 1.095 1
1 617 . 7 1 1 A 58 58 ASP CA C 58 55.215 54.934 0.281 1
1 618 . 7 1 1 A 58 58 ASP CB C 58 39.513 39.662 -0.149 1
1 619 . 7 1 1 A 58 58 ASP N N 58 132.098 127.652 4.446 1
1 620 . 7 1 1 A 59 59 GLY H H 59 7.861 8.438 -0.577 1
1 621 . 7 1 1 A 59 59 GLY HA2 H 59 3.817 3.708 0.109 1
1 622 . 7 1 1 A 59 59 GLY HA3 H 59 4.086 3.782 0.304 1
1 623 . 7 1 1 A 59 59 GLY C C 59 173.111 173.535 -0.424 1
1 624 . 7 1 1 A 59 59 GLY CA C 59 45.486 45.202 0.284 1
1 625 . 7 1 1 A 59 59 GLY N N 59 102.674 103.432 -0.758 1
1 626 . 7 1 1 A 60 60 GLN H H 60 7.137 7.372 -0.235 1
1 627 . 7 1 1 A 60 60 GLN HA H 60 4.455 4.716 -0.261 1
1 634 . 7 1 1 A 60 60 GLN C C 60 173.549 174.525 -0.976 1
1 635 . 7 1 1 A 60 60 GLN CA C 60 53.388 53.599 -0.211 1
1 636 . 7 1 1 A 60 60 GLN CB C 60 32.373 32.013 0.360 1
1 638 . 7 1 1 A 60 60 GLN N N 60 116.206 118.887 -2.681 1
1 640 . 7 1 1 A 61 61 ARG H H 61 8.589 8.429 0.160 1
1 641 . 7 1 1 A 61 61 ARG HA H 61 4.740 4.435 0.305 1
1 649 . 7 1 1 A 61 61 ARG C C 61 174.458 174.635 -0.177 1
1 650 . 7 1 1 A 61 61 ARG CA C 61 57.116 55.472 1.644 1
1 651 . 7 1 1 A 61 61 ARG CB C 61 29.615 30.648 -1.033 1
1 654 . 7 1 1 A 61 61 ARG N N 61 120.467 122.041 -1.574 1
1 656 . 7 1 1 A 62 62 ARG H H 62 8.867 8.915 -0.048 1
1 657 . 7 1 1 A 62 62 ARG HA H 62 4.297 4.413 -0.116 1
1 665 . 7 1 1 A 62 62 ARG C C 62 173.485 175.031 -1.546 1
1 666 . 7 1 1 A 62 62 ARG CA C 62 53.355 55.168 -1.813 1
1 667 . 7 1 1 A 62 62 ARG CB C 62 33.028 30.827 2.201 1
1 670 . 7 1 1 A 62 62 ARG N N 62 122.641 124.585 -1.944 1
1 672 . 7 1 1 A 63 63 HIS H H 63 7.997 8.634 -0.637 1
1 673 . 7 1 1 A 63 63 HIS HA H 63 5.427 5.596 -0.169 1
1 678 . 7 1 1 A 63 63 HIS C C 63 174.946 173.830 1.116 1
1 679 . 7 1 1 A 63 63 HIS CA C 63 54.689 53.840 0.849 1
1 680 . 7 1 1 A 63 63 HIS CB C 63 33.008 32.053 0.955 1
1 683 . 7 1 1 A 63 63 HIS N N 63 119.064 121.584 -2.520 1
1 684 . 7 1 1 A 64 64 PHE H H 64 9.880 9.266 0.614 1
1 685 . 7 1 1 A 64 64 PHE HA H 64 4.824 5.025 -0.201 1
1 693 . 7 1 1 A 64 64 PHE C C 64 174.882 175.284 -0.402 1
1 694 . 7 1 1 A 64 64 PHE CA C 64 56.489 56.303 0.186 1
1 695 . 7 1 1 A 64 64 PHE CB C 64 41.405 41.565 -0.160 1
1 701 . 7 1 1 A 64 64 PHE N N 64 123.961 122.182 1.779 1
1 702 . 7 1 1 A 65 65 ILE H H 65 8.982 9.071 -0.089 1
1 703 . 7 1 1 A 65 65 ILE HA H 65 4.273 4.556 -0.283 1
1 713 . 7 1 1 A 65 65 ILE C C 65 176.556 176.019 0.537 1
1 714 . 7 1 1 A 65 65 ILE CA C 65 62.649 60.922 1.727 1
1 715 . 7 1 1 A 65 65 ILE CB C 65 38.296 38.289 0.007 1
1 719 . 7 1 1 A 65 65 ILE N N 65 126.601 124.068 2.533 1
1 720 . 7 1 1 A 66 66 ILE H H 66 8.947 8.704 0.243 1
1 721 . 7 1 1 A 66 66 ILE HA H 66 3.780 4.144 -0.364 1
1 731 . 7 1 1 A 66 66 ILE C C 66 175.721 175.925 -0.204 1
1 732 . 7 1 1 A 66 66 ILE CA C 66 62.960 61.063 1.897 1
1 733 . 7 1 1 A 66 66 ILE CB C 66 37.209 38.128 -0.919 1
1 737 . 7 1 1 A 66 66 ILE N N 66 130.139 129.164 0.975 1
1 738 . 7 1 1 A 67 67 GLN H H 67 8.410 8.819 -0.409 1
1 739 . 7 1 1 A 67 67 GLN HA H 67 4.422 4.792 -0.370 1
1 746 . 7 1 1 A 67 67 GLN C C 67 174.347 174.352 -0.005 1
1 747 . 7 1 1 A 67 67 GLN CA C 67 55.867 55.708 0.159 1
1 748 . 7 1 1 A 67 67 GLN CB C 67 29.950 30.248 -0.298 1
1 750 . 7 1 1 A 67 67 GLN N N 67 128.872 127.208 1.664 1
1 752 . 7 1 1 A 68 68 TYR H H 68 8.619 8.796 -0.177 1
1 753 . 7 1 1 A 68 68 TYR HA H 68 5.300 5.021 0.279 1
1 760 . 7 1 1 A 68 68 TYR C C 68 174.695 174.270 0.425 1
1 761 . 7 1 1 A 68 68 TYR CA C 68 55.579 56.171 -0.592 1
1 762 . 7 1 1 A 68 68 TYR CB C 68 39.479 39.835 -0.356 1
1 767 . 7 1 1 A 68 68 TYR N N 68 124.772 124.677 0.095 1
1 768 . 7 1 1 A 69 69 VAL H H 69 8.539 8.650 -0.111 1
1 769 . 7 1 1 A 69 69 VAL HA H 69 4.046 4.349 -0.303 1
1 777 . 7 1 1 A 69 69 VAL C C 69 175.010 175.413 -0.403 1
1 778 . 7 1 1 A 69 69 VAL CA C 69 60.611 60.930 -0.319 1
1 779 . 7 1 1 A 69 69 VAL CB C 69 35.358 34.315 1.043 1
1 782 . 7 1 1 A 69 69 VAL N N 69 126.652 127.929 -1.277 1
1 783 . 7 1 1 A 70 70 ASP H H 70 9.089 9.321 -0.232 1
1 784 . 7 1 1 A 70 70 ASP HA H 70 4.025 4.197 -0.172 1
1 787 . 7 1 1 A 70 70 ASP C C 70 174.813 175.018 -0.205 1
1 788 . 7 1 1 A 70 70 ASP CA C 70 55.623 55.488 0.135 1
1 789 . 7 1 1 A 70 70 ASP CB C 70 39.081 39.124 -0.043 1
1 790 . 7 1 1 A 70 70 ASP N N 70 128.327 129.179 -0.852 1
1 791 . 7 1 1 A 71 71 ASN H H 71 8.128 8.022 0.106 1
1 792 . 7 1 1 A 71 71 ASN HA H 71 3.597 3.423 0.174 1
1 797 . 7 1 1 A 71 71 ASN C C 71 173.250 173.743 -0.493 1
1 798 . 7 1 1 A 71 71 ASN CA C 71 54.728 54.324 0.404 1
1 799 . 7 1 1 A 71 71 ASN CB C 71 37.601 37.120 0.481 1
1 800 . 7 1 1 A 71 71 ASN N N 71 107.230 107.746 -0.516 1
1 802 . 7 1 1 A 72 72 MET H H 72 7.256 7.503 -0.247 1
1 803 . 7 1 1 A 72 72 MET HA H 72 4.740 4.731 0.009 1
1 808 . 7 1 1 A 72 72 MET C C 72 173.780 174.501 -0.721 1
1 809 . 7 1 1 A 72 72 MET CA C 72 53.703 54.068 -0.365 1
1 810 . 7 1 1 A 72 72 MET CB C 72 36.570 34.802 1.768 1
1 812 . 7 1 1 A 72 72 MET N N 72 117.117 117.430 -0.313 1
1 813 . 7 1 1 A 73 73 TYR H H 73 9.430 9.147 0.283 1
1 814 . 7 1 1 A 73 73 TYR HA H 73 5.718 5.129 0.589 1
1 821 . 7 1 1 A 73 73 TYR C C 73 176.140 175.754 0.386 1
1 822 . 7 1 1 A 73 73 TYR CA C 73 57.290 57.681 -0.391 1
1 823 . 7 1 1 A 73 73 TYR CB C 73 40.013 39.458 0.555 1
1 828 . 7 1 1 A 73 73 TYR N N 73 119.856 122.145 -2.289 1
1 829 . 7 1 1 A 74 74 ARG H H 74 9.038 9.128 -0.090 1
1 830 . 7 1 1 A 74 74 ARG HA H 74 4.867 4.990 -0.123 1
1 838 . 7 1 1 A 74 74 ARG C C 74 173.954 175.114 -1.160 1
1 839 . 7 1 1 A 74 74 ARG CA C 74 54.887 54.388 0.499 1
1 840 . 7 1 1 A 74 74 ARG CB C 74 34.484 33.736 0.748 1
1 843 . 7 1 1 A 74 74 ARG N N 74 117.344 120.993 -3.649 1
1 845 . 7 1 1 A 75 75 PHE H H 75 9.005 9.011 -0.006 1
1 846 . 7 1 1 A 75 75 PHE HA H 75 5.046 4.473 0.573 1
1 854 . 7 1 1 A 75 75 PHE C C 75 176.186 177.872 -1.686 1
1 855 . 7 1 1 A 75 75 PHE CA C 75 59.658 60.538 -0.880 1
1 856 . 7 1 1 A 75 75 PHE CB C 75 39.356 39.736 -0.380 1
1 862 . 7 1 1 A 75 75 PHE N N 75 117.865 122.024 -4.159 1
1 863 . 7 1 1 A 76 76 GLU H H 76 8.213 8.072 0.141 1
1 864 . 7 1 1 A 76 76 GLU HA H 76 4.586 4.238 0.348 1
1 869 . 7 1 1 A 76 76 GLU C C 76 175.238 178.007 -2.769 1
1 870 . 7 1 1 A 76 76 GLU CA C 76 55.994 58.905 -2.911 1
1 871 . 7 1 1 A 76 76 GLU CB C 76 31.805 30.710 1.095 1
1 873 . 7 1 1 A 76 76 GLU N N 76 116.834 119.038 -2.204 1
1 874 . 7 1 1 A 77 77 GLY H H 77 8.692 7.882 0.810 1
1 875 . 7 1 1 A 77 77 GLY HA2 H 77 4.166 4.114 0.052 1
1 876 . 7 1 1 A 77 77 GLY HA3 H 77 4.015 4.114 -0.099 1
1 877 . 7 1 1 A 77 77 GLY C C 77 173.784 173.830 -0.046 1
1 878 . 7 1 1 A 77 77 GLY CA C 77 45.505 45.736 -0.231 1
1 879 . 7 1 1 A 77 77 GLY N N 77 111.937 107.192 4.745 1
1 880 . 7 1 1 A 78 78 THR H H 78 8.332 7.814 0.518 1
1 881 . 7 1 1 A 78 78 THR HA H 78 3.900 4.401 -0.501 1
1 886 . 7 1 1 A 78 78 THR C C 78 173.591 174.179 -0.588 1
1 887 . 7 1 1 A 78 78 THR CA C 78 63.653 62.512 1.141 1
1 888 . 7 1 1 A 78 78 THR CB C 78 69.649 69.726 -0.077 1
1 890 . 7 1 1 A 78 78 THR N N 78 120.765 115.798 4.967 1
1 891 . 7 1 1 A 79 79 GLY H H 79 8.038 8.370 -0.332 1
1 892 . 7 1 1 A 79 79 GLY HA2 H 79 4.748 4.350 0.398 1
1 893 . 7 1 1 A 79 79 GLY HA3 H 79 3.546 4.489 -0.943 1
1 894 . 7 1 1 A 79 79 GLY C C 79 172.580 171.977 0.603 1
1 895 . 7 1 1 A 79 79 GLY CA C 79 44.661 45.492 -0.831 1
1 896 . 7 1 1 A 79 79 GLY N N 79 109.887 113.241 -3.354 1
1 897 . 7 1 1 A 80 80 PHE H H 80 9.064 8.609 0.455 1
1 898 . 7 1 1 A 80 80 PHE HA H 80 4.886 4.993 -0.107 1
1 906 . 7 1 1 A 80 80 PHE C C 80 176.507 176.470 0.037 1
1 907 . 7 1 1 A 80 80 PHE CA C 80 57.257 56.612 0.645 1
1 908 . 7 1 1 A 80 80 PHE CB C 80 44.655 43.257 1.398 1
1 914 . 7 1 1 A 80 80 PHE N N 80 116.862 119.366 -2.504 1
1 915 . 7 1 1 A 81 81 SER H H 81 9.413 8.995 0.418 1
1 916 . 7 1 1 A 81 81 SER HA H 81 4.622 4.341 0.281 1
1 919 . 7 1 1 A 81 81 SER C C 81 173.735 174.537 -0.802 1
1 920 . 7 1 1 A 81 81 SER CA C 81 61.410 60.482 0.928 1
1 921 . 7 1 1 A 81 81 SER CB C 81 64.165 63.319 0.846 1
1 922 . 7 1 1 A 81 81 SER N N 81 116.467 115.715 0.752 1
1 923 . 7 1 1 A 82 82 ASN H H 82 7.688 7.979 -0.291 1
1 924 . 7 1 1 A 82 82 ASN HA H 82 4.952 5.253 -0.301 1
1 929 . 7 1 1 A 82 82 ASN C C 82 173.303 175.516 -2.213 1
1 930 . 7 1 1 A 82 82 ASN CA C 82 52.086 52.250 -0.164 1
1 931 . 7 1 1 A 82 82 ASN CB C 82 41.258 40.835 0.423 1
1 932 . 7 1 1 A 82 82 ASN N N 82 113.355 118.499 -5.144 1
1 934 . 7 1 1 A 83 83 ILE H H 83 8.858 8.795 0.063 1
1 935 . 7 1 1 A 83 83 ILE HA H 83 3.571 3.740 -0.169 1
1 945 . 7 1 1 A 83 83 ILE CA C 83 66.416 65.573 0.843 1
1 946 . 7 1 1 A 83 83 ILE CB C 83 35.074 34.959 0.115 1
1 950 . 7 1 1 A 83 83 ILE N N 83 118.908 123.105 -4.197 1
1 951 . 7 1 1 A 84 84 PRO HA H 84 4.411 4.738 -0.327 1
1 958 . 7 1 1 A 84 84 PRO C C 84 177.616 179.372 -1.756 1
1 959 . 7 1 1 A 84 84 PRO CA C 84 67.525 66.384 1.141 1
1 960 . 7 1 1 A 84 84 PRO CB C 84 31.029 30.699 0.330 1
1 963 . 7 1 1 A 85 85 GLN H H 85 8.405 8.214 0.191 1
1 964 . 7 1 1 A 85 85 GLN HA H 85 3.874 4.036 -0.162 1
1 971 . 7 1 1 A 85 85 GLN C C 85 178.213 178.199 0.014 1
1 972 . 7 1 1 A 85 85 GLN CA C 85 59.495 58.747 0.748 1
1 973 . 7 1 1 A 85 85 GLN CB C 85 29.270 28.274 0.996 1
1 975 . 7 1 1 A 85 85 GLN N N 85 115.597 117.658 -2.061 1
1 977 . 7 1 1 A 86 86 LEU H H 86 7.136 8.227 -1.091 1
1 978 . 7 1 1 A 86 86 LEU HA H 86 3.589 3.828 -0.239 1
1 988 . 7 1 1 A 86 86 LEU C C 86 177.728 178.553 -0.825 1
1 989 . 7 1 1 A 86 86 LEU CA C 86 58.136 58.406 -0.270 1
1 990 . 7 1 1 A 86 86 LEU CB C 86 42.290 41.864 0.426 1
1 994 . 7 1 1 A 86 86 LEU N N 86 121.840 121.912 -0.072 1
1 995 . 7 1 1 A 87 87 ILE H H 87 8.323 8.165 0.158 1
1 996 . 7 1 1 A 87 87 ILE HA H 87 3.415 3.360 0.055 1
1 1006 . 7 1 1 A 87 87 ILE C C 87 178.064 177.668 0.396 1
1 1007 . 7 1 1 A 87 87 ILE CA C 87 61.458 65.599 -4.141 1
1 1008 . 7 1 1 A 87 87 ILE CB C 87 34.561 37.745 -3.184 1
1 1012 . 7 1 1 A 87 87 ILE N N 87 118.117 119.799 -1.682 1
1 1013 . 7 1 1 A 88 88 ASP H H 88 8.805 8.399 0.406 1
1 1014 . 7 1 1 A 88 88 ASP HA H 88 4.548 4.292 0.256 1
1 1017 . 7 1 1 A 88 88 ASP C C 88 179.265 178.192 1.073 1
1 1018 . 7 1 1 A 88 88 ASP CA C 88 58.099 57.378 0.721 1
1 1019 . 7 1 1 A 88 88 ASP CB C 88 42.166 41.805 0.361 1
1 1020 . 7 1 1 A 88 88 ASP N N 88 119.143 120.489 -1.346 1
1 1021 . 7 1 1 A 89 89 HIS H H 89 8.113 8.191 -0.078 1
1 1022 . 7 1 1 A 89 89 HIS HA H 89 4.225 4.274 -0.049 1
1 1026 . 7 1 1 A 89 89 HIS C C 89 179.261 176.994 2.267 1
1 1027 . 7 1 1 A 89 89 HIS CA C 89 60.647 58.980 1.667 1
1 1028 . 7 1 1 A 89 89 HIS CB C 89 30.801 29.344 1.457 1
1 1030 . 7 1 1 A 89 89 HIS N N 89 119.595 118.951 0.644 1
1 1031 . 7 1 1 A 90 90 HIS H H 90 7.685 7.847 -0.162 1
1 1032 . 7 1 1 A 90 90 HIS HA H 90 3.628 4.094 -0.466 1
1 1036 . 7 1 1 A 90 90 HIS C C 90 178.454 177.602 0.852 1
1 1037 . 7 1 1 A 90 90 HIS CA C 90 61.797 59.841 1.956 1
1 1038 . 7 1 1 A 90 90 HIS CB C 90 28.165 30.474 -2.309 1
1 1040 . 7 1 1 A 90 90 HIS N N 90 120.061 116.548 3.513 1
1 1041 . 7 1 1 A 91 91 TYR H H 91 9.394 8.131 1.263 1
1 1042 . 7 1 1 A 91 91 TYR HA H 91 4.238 3.872 0.366 1
1 1049 . 7 1 1 A 91 91 TYR C C 91 176.443 177.401 -0.958 1
1 1050 . 7 1 1 A 91 91 TYR CA C 91 60.669 61.796 -1.127 1
1 1051 . 7 1 1 A 91 91 TYR CB C 91 39.169 38.925 0.244 1
1 1056 . 7 1 1 A 91 91 TYR N N 91 123.532 120.078 3.454 1
1 1057 . 7 1 1 A 92 92 THR H H 92 8.774 8.618 0.156 1
1 1058 . 7 1 1 A 92 92 THR HA H 92 3.866 4.054 -0.188 1
1 1063 . 7 1 1 A 92 92 THR C C 92 177.050 176.411 0.639 1
1 1064 . 7 1 1 A 92 92 THR CA C 92 65.240 65.330 -0.090 1
1 1065 . 7 1 1 A 92 92 THR CB C 92 69.298 68.010 1.288 1
1 1067 . 7 1 1 A 92 92 THR N N 92 112.000 112.910 -0.910 1
1 1068 . 7 1 1 A 93 93 THR H H 93 7.617 7.424 0.193 1
1 1069 . 7 1 1 A 93 93 THR HA H 93 4.133 4.094 0.039 1
1 1074 . 7 1 1 A 93 93 THR C C 93 176.234 174.981 1.253 1
1 1075 . 7 1 1 A 93 93 THR CA C 93 63.527 62.845 0.682 1
1 1076 . 7 1 1 A 93 93 THR CB C 93 71.234 69.784 1.450 1
1 1078 . 7 1 1 A 93 93 THR N N 93 109.883 112.696 -2.813 1
1 1079 . 7 1 1 A 94 94 LYS H H 94 7.210 7.585 -0.375 1
1 1080 . 7 1 1 A 94 94 LYS HA H 94 3.830 3.748 0.082 1
1 1089 . 7 1 1 A 94 94 LYS C C 94 174.331 174.999 -0.668 1
1 1090 . 7 1 1 A 94 94 LYS CA C 94 56.776 57.371 -0.595 1
1 1091 . 7 1 1 A 94 94 LYS CB C 94 28.095 30.974 -2.879 1
1 1095 . 7 1 1 A 94 94 LYS N N 94 112.818 121.523 -8.705 1
1 1096 . 7 1 1 A 95 95 GLN H H 95 7.439 7.458 -0.019 1
1 1097 . 7 1 1 A 95 95 GLN HA H 95 4.216 4.615 -0.399 1
1 1104 . 7 1 1 A 95 95 GLN C C 95 179.087 175.918 3.169 1
1 1105 . 7 1 1 A 95 95 GLN CA C 95 56.378 54.160 2.218 1
1 1106 . 7 1 1 A 95 95 GLN CB C 95 28.542 30.034 -1.492 1
1 1108 . 7 1 1 A 95 95 GLN N N 95 117.860 118.805 -0.945 1
1 1110 . 7 1 1 A 96 96 VAL H H 96 8.520 8.379 0.141 1
1 1111 . 7 1 1 A 96 96 VAL HA H 96 4.297 4.380 -0.083 1
1 1119 . 7 1 1 A 96 96 VAL C C 96 177.329 176.552 0.777 1
1 1120 . 7 1 1 A 96 96 VAL CA C 96 61.196 61.899 -0.703 1
1 1121 . 7 1 1 A 96 96 VAL CB C 96 32.735 33.303 -0.568 1
1 1124 . 7 1 1 A 96 96 VAL N N 96 124.208 119.393 4.815 1
1 1125 . 7 1 1 A 97 97 ILE H H 97 8.491 8.896 -0.405 1
1 1126 . 7 1 1 A 97 97 ILE HA H 97 2.995 3.820 -0.825 1
1 1136 . 7 1 1 A 97 97 ILE CA C 97 62.066 62.547 -0.481 1
1 1137 . 7 1 1 A 97 97 ILE CB C 97 36.117 37.973 -1.856 1
1 1141 . 7 1 1 A 97 97 ILE N N 97 119.561 123.400 -3.839 1
1 1142 . 7 1 1 A 98 98 THR HA H 98 4.460 4.582 -0.122 1
1 1147 . 7 1 1 A 98 98 THR C C 98 174.335 174.731 -0.396 1
1 1148 . 7 1 1 A 98 98 THR CA C 98 58.244 59.764 -1.520 1
1 1149 . 7 1 1 A 98 98 THR CB C 98 73.056 71.569 1.487 1
1 1151 . 7 1 1 A 99 99 LYS H H 99 9.761 8.967 0.794 1
1 1152 . 7 1 1 A 99 99 LYS HA H 99 3.911 4.054 -0.143 1
1 1161 . 7 1 1 A 99 99 LYS C C 99 179.594 178.588 1.006 1
1 1162 . 7 1 1 A 99 99 LYS CA C 99 59.661 58.622 1.039 1
1 1163 . 7 1 1 A 99 99 LYS CB C 99 31.978 32.078 -0.100 1
1 1167 . 7 1 1 A 99 99 LYS N N 99 125.750 122.383 3.367 1
1 1168 . 7 1 1 A 100 100 LYS H H 100 8.910 7.742 1.168 1
1 1169 . 7 1 1 A 100 100 LYS HA H 100 4.024 4.101 -0.077 1
1 1178 . 7 1 1 A 100 100 LYS C C 100 178.060 177.972 0.088 1
1 1179 . 7 1 1 A 100 100 LYS CA C 100 58.642 59.198 -0.556 1
1 1180 . 7 1 1 A 100 100 LYS CB C 100 32.750 32.483 0.267 1
1 1184 . 7 1 1 A 100 100 LYS N N 100 117.112 120.021 -2.909 1
1 1185 . 7 1 1 A 101 101 SER H H 101 7.721 7.528 0.193 1
1 1186 . 7 1 1 A 101 101 SER HA H 101 4.282 4.650 -0.368 1
1 1189 . 7 1 1 A 101 101 SER C C 101 176.403 174.888 1.515 1
1 1190 . 7 1 1 A 101 101 SER CA C 101 60.442 58.953 1.489 1
1 1191 . 7 1 1 A 101 101 SER CB C 101 63.775 65.494 -1.719 1
1 1192 . 7 1 1 A 101 101 SER N N 101 112.069 111.101 0.968 1
1 1193 . 7 1 1 A 102 102 GLY H H 102 8.038 8.422 -0.384 1
1 1194 . 7 1 1 A 102 102 GLY HA2 H 102 4.024 3.919 0.105 1
1 1195 . 7 1 1 A 102 102 GLY HA3 H 102 3.713 3.939 -0.226 1
1 1196 . 7 1 1 A 102 102 GLY C C 102 173.991 174.565 -0.574 1
1 1197 . 7 1 1 A 102 102 GLY CA C 102 46.458 46.545 -0.087 1
1 1198 . 7 1 1 A 102 102 GLY N N 102 111.144 111.056 0.088 1
1 1199 . 7 1 1 A 103 103 VAL H H 103 7.155 7.945 -0.790 1
1 1200 . 7 1 1 A 103 103 VAL HA H 103 3.652 4.225 -0.573 1
1 1208 . 7 1 1 A 103 103 VAL C C 103 173.805 174.928 -1.123 1
1 1209 . 7 1 1 A 103 103 VAL CA C 103 64.310 62.129 2.181 1
1 1210 . 7 1 1 A 103 103 VAL CB C 103 32.254 32.815 -0.561 1
1 1213 . 7 1 1 A 103 103 VAL N N 103 119.836 120.039 -0.203 1
1 1214 . 7 1 1 A 104 104 VAL H H 104 7.653 9.052 -1.399 1
1 1215 . 7 1 1 A 104 104 VAL HA H 104 4.048 4.684 -0.636 1
1 1223 . 7 1 1 A 104 104 VAL C C 104 175.708 174.021 1.687 1
1 1224 . 7 1 1 A 104 104 VAL CA C 104 60.275 60.577 -0.302 1
1 1225 . 7 1 1 A 104 104 VAL CB C 104 35.112 35.307 -0.195 1
1 1228 . 7 1 1 A 104 104 VAL N N 104 125.859 127.491 -1.632 1
1 1229 . 7 1 1 A 105 105 LEU H H 105 8.616 8.285 0.331 1
1 1230 . 7 1 1 A 105 105 LEU HA H 105 3.905 4.653 -0.748 1
1 1240 . 7 1 1 A 105 105 LEU C C 105 175.380 176.024 -0.644 1
1 1241 . 7 1 1 A 105 105 LEU CA C 105 54.471 53.727 0.744 1
1 1242 . 7 1 1 A 105 105 LEU CB C 105 39.821 42.168 -2.347 1
1 1246 . 7 1 1 A 105 105 LEU N N 105 123.839 126.178 -2.339 1
1 1247 . 7 1 1 A 106 106 LEU H H 106 8.894 8.623 0.271 1
1 1248 . 7 1 1 A 106 106 LEU HA H 106 4.839 4.928 -0.089 1
1 1258 . 7 1 1 A 106 106 LEU C C 106 176.930 176.572 0.358 1
1 1259 . 7 1 1 A 106 106 LEU CA C 106 56.288 53.234 3.054 1
1 1260 . 7 1 1 A 106 106 LEU CB C 106 45.237 45.584 -0.347 1
1 1264 . 7 1 1 A 106 106 LEU N N 106 120.590 121.278 -0.688 1
1 1265 . 7 1 1 A 107 107 ASN H H 107 8.124 9.175 -1.051 1
1 1266 . 7 1 1 A 107 107 ASN HA H 107 5.650 4.665 0.985 1
1 1271 . 7 1 1 A 107 107 ASN CA C 107 50.293 53.996 -3.703 1
1 1272 . 7 1 1 A 107 107 ASN CB C 107 41.223 36.185 5.038 1
1 1273 . 7 1 1 A 107 107 ASN N N 107 116.866 119.461 -2.595 1
1 1275 . 7 1 1 A 108 108 PRO HA H 108 2.926 3.813 -0.887 1
1 1282 . 7 1 1 A 108 108 PRO C C 108 176.671 175.340 1.331 1
1 1283 . 7 1 1 A 108 108 PRO CA C 108 60.804 62.256 -1.452 1
1 1284 . 7 1 1 A 108 108 PRO CB C 108 31.774 32.191 -0.417 1
1 1287 . 7 1 1 A 109 109 ILE H H 109 8.648 7.784 0.864 1
1 1288 . 7 1 1 A 109 109 ILE HA H 109 4.519 4.567 -0.048 1
1 1298 . 7 1 1 A 109 109 ILE CA C 109 55.070 58.105 -3.035 1
1 1299 . 7 1 1 A 109 109 ILE CB C 109 36.068 38.894 -2.826 1
1 1303 . 7 1 1 A 109 109 ILE N N 109 128.817 121.487 7.330 1
1 1304 . 7 1 1 A 110 110 PRO HA H 110 4.587 4.460 0.127 1
1 1311 . 7 1 1 A 110 110 PRO C C 110 177.013 176.195 0.818 1
1 1312 . 7 1 1 A 110 110 PRO CA C 110 61.850 62.868 -1.018 1
1 1313 . 7 1 1 A 110 110 PRO CB C 110 32.507 32.066 0.441 1
1 1316 . 7 1 1 A 111 111 LYS H H 111 8.038 8.137 -0.099 1
1 1317 . 7 1 1 A 111 111 LYS HA H 111 3.553 3.543 0.010 1
1 1326 . 7 1 1 A 111 111 LYS C C 111 176.123 175.626 0.497 1
1 1327 . 7 1 1 A 111 111 LYS CA C 111 56.220 54.703 1.517 1
1 1328 . 7 1 1 A 111 111 LYS CB C 111 32.373 33.588 -1.215 1
1 1332 . 7 1 1 A 111 111 LYS N N 111 120.147 117.698 2.449 1
1 1333 . 7 1 1 A 112 112 ASP H H 112 8.463 8.573 -0.110 1
1 1334 . 7 1 1 A 112 112 ASP HA H 112 4.523 4.608 -0.085 1
1 1337 . 7 1 1 A 112 112 ASP C C 112 175.986 176.263 -0.277 1
1 1338 . 7 1 1 A 112 112 ASP CA C 112 54.256 54.494 -0.238 1
1 1339 . 7 1 1 A 112 112 ASP CB C 112 41.563 40.965 0.598 1
1 1340 . 7 1 1 A 112 112 ASP N N 112 121.863 120.646 1.217 1
1 1341 . 7 1 1 A 113 113 LYS H H 113 8.059 8.750 -0.691 1
1 1342 . 7 1 1 A 113 113 LYS HA H 113 4.136 4.345 -0.209 1
1 1351 . 7 1 1 A 113 113 LYS C C 113 176.010 176.547 -0.537 1
1 1352 . 7 1 1 A 113 113 LYS CA C 113 56.253 57.290 -1.037 1
1 1353 . 7 1 1 A 113 113 LYS CB C 113 32.754 32.458 0.296 1
1 1357 . 7 1 1 A 113 113 LYS N N 113 121.725 124.992 -3.267 1
1 1358 . 7 1 1 A 114 114 LYS H H 114 8.225 7.432 0.793 1
1 1359 . 7 1 1 A 114 114 LYS HA H 114 4.169 4.382 -0.213 1
1 1368 . 7 1 1 A 114 114 LYS C C 114 176.198 177.411 -1.213 1
1 1369 . 7 1 1 A 114 114 LYS CA C 114 56.413 54.947 1.466 1
1 1370 . 7 1 1 A 114 114 LYS CB C 114 32.725 31.080 1.645 1
1 1374 . 7 1 1 A 114 114 LYS N N 114 121.857 120.339 1.518 1
1 1375 . 7 1 1 A 115 115 TRP H H 115 8.078 7.738 0.340 1
1 1376 . 7 1 1 A 115 115 TRP HA H 115 4.709 4.598 0.111 1
1 1385 . 7 1 1 A 115 115 TRP C C 115 175.119 177.097 -1.978 1
1 1386 . 7 1 1 A 115 115 TRP CA C 115 56.856 58.414 -1.558 1
1 1387 . 7 1 1 A 115 115 TRP CB C 115 29.474 28.288 1.186 1
1 1393 . 7 1 1 A 115 115 TRP N N 115 122.068 123.118 -1.050 1
1 1 . 8 1 1 A 10 10 HIS HA H 10 4.616 5.350 -0.734 1
1 4 . 8 1 1 A 10 10 HIS C C 10 174.981 174.202 0.779 1
1 5 . 8 1 1 A 10 10 HIS CA C 10 56.555 53.308 3.247 1
1 6 . 8 1 1 A 10 10 HIS CB C 10 30.231 32.811 -2.580 1
1 7 . 8 1 1 A 11 11 MET H H 11 8.103 8.818 -0.715 1
1 8 . 8 1 1 A 11 11 MET HA H 11 4.439 4.318 0.121 1
1 13 . 8 1 1 A 11 11 MET C C 11 175.888 176.481 -0.593 1
1 14 . 8 1 1 A 11 11 MET CA C 11 55.090 55.827 -0.737 1
1 15 . 8 1 1 A 11 11 MET CB C 11 33.121 32.881 0.240 1
1 17 . 8 1 1 A 11 11 MET N N 11 120.743 118.612 2.131 1
1 18 . 8 1 1 A 12 12 LYS H H 12 8.065 8.495 -0.430 1
1 19 . 8 1 1 A 12 12 LYS HA H 12 4.407 4.675 -0.268 1
1 28 . 8 1 1 A 12 12 LYS CA C 12 54.894 53.532 1.362 1
1 29 . 8 1 1 A 12 12 LYS CB C 12 31.863 32.114 -0.251 1
1 33 . 8 1 1 A 12 12 LYS N N 12 123.187 124.101 -0.914 1
1 34 . 8 1 1 A 13 13 PRO HA H 13 4.347 4.471 -0.124 1
1 41 . 8 1 1 A 13 13 PRO C C 13 176.891 177.380 -0.489 1
1 42 . 8 1 1 A 13 13 PRO CA C 13 62.542 62.376 0.166 1
1 43 . 8 1 1 A 13 13 PRO CB C 13 32.663 32.746 -0.083 1
1 46 . 8 1 1 A 14 14 LEU H H 14 8.339 8.759 -0.420 1
1 47 . 8 1 1 A 14 14 LEU HA H 14 3.373 3.782 -0.409 1
1 57 . 8 1 1 A 14 14 LEU C C 14 176.683 178.175 -1.492 1
1 58 . 8 1 1 A 14 14 LEU CA C 14 58.555 57.513 1.042 1
1 59 . 8 1 1 A 14 14 LEU CB C 14 41.828 41.063 0.765 1
1 63 . 8 1 1 A 14 14 LEU N N 14 123.191 123.814 -0.623 1
1 64 . 8 1 1 A 15 15 ALA H H 15 8.175 7.817 0.358 1
1 65 . 8 1 1 A 15 15 ALA HA H 15 3.983 4.021 -0.038 1
1 69 . 8 1 1 A 15 15 ALA C C 15 178.697 178.645 0.052 1
1 70 . 8 1 1 A 15 15 ALA CA C 15 54.164 54.545 -0.381 1
1 71 . 8 1 1 A 15 15 ALA CB C 15 18.771 18.087 0.684 1
1 72 . 8 1 1 A 15 15 ALA N N 15 113.594 119.860 -6.266 1
1 73 . 8 1 1 A 16 16 GLU H H 16 7.458 7.380 0.078 1
1 74 . 8 1 1 A 16 16 GLU HA H 16 4.266 4.322 -0.056 1
1 79 . 8 1 1 A 16 16 GLU C C 16 176.510 176.590 -0.080 1
1 80 . 8 1 1 A 16 16 GLU CA C 16 55.196 56.243 -1.047 1
1 81 . 8 1 1 A 16 16 GLU CB C 16 30.907 29.929 0.978 1
1 83 . 8 1 1 A 16 16 GLU N N 16 113.348 115.168 -1.820 1
1 84 . 8 1 1 A 17 17 GLN H H 17 7.501 6.983 0.518 1
1 85 . 8 1 1 A 17 17 GLN HA H 17 3.683 3.959 -0.276 1
1 92 . 8 1 1 A 17 17 GLN C C 17 178.053 176.137 1.916 1
1 93 . 8 1 1 A 17 17 GLN CA C 17 54.606 55.419 -0.813 1
1 94 . 8 1 1 A 17 17 GLN CB C 17 25.758 28.235 -2.477 1
1 96 . 8 1 1 A 17 17 GLN N N 17 119.411 119.629 -0.218 1
1 98 . 8 1 1 A 18 18 ASP H H 18 8.949 8.657 0.292 1
1 99 . 8 1 1 A 18 18 ASP HA H 18 4.184 4.172 0.012 1
1 102 . 8 1 1 A 18 18 ASP C C 18 175.263 176.498 -1.235 1
1 103 . 8 1 1 A 18 18 ASP CA C 18 57.275 56.015 1.260 1
1 104 . 8 1 1 A 18 18 ASP CB C 18 40.620 39.938 0.682 1
1 105 . 8 1 1 A 18 18 ASP N N 18 124.676 124.084 0.592 1
1 106 . 8 1 1 A 19 19 TRP H H 19 6.068 7.091 -1.023 1
1 107 . 8 1 1 A 19 19 TRP HA H 19 5.045 4.569 0.476 1
1 116 . 8 1 1 A 19 19 TRP C C 19 175.902 175.776 0.126 1
1 117 . 8 1 1 A 19 19 TRP CA C 19 53.542 57.067 -3.525 1
1 118 . 8 1 1 A 19 19 TRP CB C 19 29.179 29.684 -0.505 1
1 124 . 8 1 1 A 19 19 TRP N N 19 107.757 116.610 -8.853 1
1 126 . 8 1 1 A 20 20 TYR H H 20 7.430 7.671 -0.241 1
1 127 . 8 1 1 A 20 20 TYR HA H 20 5.601 5.396 0.205 1
1 132 . 8 1 1 A 20 20 TYR C C 20 175.498 173.950 1.548 1
1 133 . 8 1 1 A 20 20 TYR CA C 20 56.967 56.731 0.236 1
1 134 . 8 1 1 A 20 20 TYR CB C 20 39.083 41.053 -1.970 1
1 137 . 8 1 1 A 20 20 TYR N N 20 123.173 121.715 1.458 1
1 138 . 8 1 1 A 21 21 HIS H H 21 8.934 8.909 0.025 1
1 139 . 8 1 1 A 21 21 HIS HA H 21 4.295 4.955 -0.660 1
1 144 . 8 1 1 A 21 21 HIS C C 21 175.177 174.077 1.100 1
1 145 . 8 1 1 A 21 21 HIS CA C 21 56.572 52.841 3.731 1
1 146 . 8 1 1 A 21 21 HIS CB C 21 33.365 30.960 2.405 1
1 149 . 8 1 1 A 21 21 HIS N N 21 125.732 125.747 -0.015 1
1 150 . 8 1 1 A 22 22 GLY H H 22 5.280 8.499 -3.219 1
1 151 . 8 1 1 A 22 22 GLY HA2 H 22 3.905 3.545 0.360 1
1 152 . 8 1 1 A 22 22 GLY HA3 H 22 3.585 3.818 -0.233 1
1 153 . 8 1 1 A 22 22 GLY C C 22 174.411 175.018 -0.607 1
1 154 . 8 1 1 A 22 22 GLY CA C 22 46.402 45.867 0.535 1
1 155 . 8 1 1 A 22 22 GLY N N 22 104.568 110.713 -6.145 1
1 156 . 8 1 1 A 23 23 ALA H H 23 8.768 8.776 -0.008 1
1 157 . 8 1 1 A 23 23 ALA HA H 23 5.171 4.318 0.853 1
1 161 . 8 1 1 A 23 23 ALA C C 23 177.180 176.476 0.704 1
1 162 . 8 1 1 A 23 23 ALA CA C 23 51.153 53.034 -1.881 1
1 163 . 8 1 1 A 23 23 ALA CB C 23 16.999 17.559 -0.560 1
1 164 . 8 1 1 A 23 23 ALA N N 23 130.297 122.339 7.958 1
1 165 . 8 1 1 A 24 24 ILE H H 24 7.267 7.696 -0.429 1
1 166 . 8 1 1 A 24 24 ILE HA H 24 4.460 4.531 -0.071 1
1 176 . 8 1 1 A 24 24 ILE CA C 24 58.529 59.203 -0.674 1
1 177 . 8 1 1 A 24 24 ILE CB C 24 38.763 38.219 0.544 1
1 181 . 8 1 1 A 24 24 ILE N N 24 118.903 113.714 5.189 1
1 182 . 8 1 1 A 25 25 PRO HA H 25 4.224 4.503 -0.279 1
1 189 . 8 1 1 A 25 25 PRO C C 25 176.918 177.897 -0.979 1
1 190 . 8 1 1 A 25 25 PRO CA C 25 62.907 62.832 0.075 1
1 191 . 8 1 1 A 25 25 PRO CB C 25 32.671 32.615 0.056 1
1 194 . 8 1 1 A 26 26 ARG H H 26 8.781 9.031 -0.250 1
1 195 . 8 1 1 A 26 26 ARG HA H 26 3.472 3.907 -0.435 1
1 202 . 8 1 1 A 26 26 ARG C C 26 178.112 177.924 0.188 1
1 203 . 8 1 1 A 26 26 ARG CA C 26 60.863 59.480 1.383 1
1 204 . 8 1 1 A 26 26 ARG CB C 26 30.314 29.858 0.456 1
1 207 . 8 1 1 A 26 26 ARG N N 26 124.635 123.218 1.417 1
1 208 . 8 1 1 A 27 27 ILE H H 27 8.540 8.150 0.390 1
1 209 . 8 1 1 A 27 27 ILE HA H 27 3.787 3.676 0.111 1
1 219 . 8 1 1 A 27 27 ILE C C 27 177.390 177.587 -0.197 1
1 220 . 8 1 1 A 27 27 ILE CA C 27 64.329 64.762 -0.433 1
1 221 . 8 1 1 A 27 27 ILE CB C 27 37.413 37.981 -0.568 1
1 225 . 8 1 1 A 27 27 ILE N N 27 115.859 120.025 -4.166 1
1 226 . 8 1 1 A 28 28 GLU H H 28 6.953 8.570 -1.617 1
1 227 . 8 1 1 A 28 28 GLU HA H 28 4.067 4.003 0.064 1
1 232 . 8 1 1 A 28 28 GLU C C 28 179.006 179.157 -0.151 1
1 233 . 8 1 1 A 28 28 GLU CA C 28 58.985 59.645 -0.660 1
1 234 . 8 1 1 A 28 28 GLU CB C 28 29.316 29.320 -0.004 1
1 236 . 8 1 1 A 28 28 GLU N N 28 120.554 119.203 1.351 1
1 237 . 8 1 1 A 29 29 ALA H H 29 7.999 7.996 0.003 1
1 238 . 8 1 1 A 29 29 ALA HA H 29 3.822 4.065 -0.243 1
1 242 . 8 1 1 A 29 29 ALA C C 29 178.809 179.928 -1.119 1
1 243 . 8 1 1 A 29 29 ALA CA C 29 54.698 54.779 -0.081 1
1 244 . 8 1 1 A 29 29 ALA CB C 29 18.059 18.355 -0.296 1
1 245 . 8 1 1 A 29 29 ALA N N 29 120.122 122.598 -2.476 1
1 246 . 8 1 1 A 30 30 GLN H H 30 8.168 8.089 0.079 1
1 247 . 8 1 1 A 30 30 GLN HA H 30 3.811 4.219 -0.408 1
1 254 . 8 1 1 A 30 30 GLN C C 30 177.578 178.234 -0.656 1
1 255 . 8 1 1 A 30 30 GLN CA C 30 59.731 58.637 1.094 1
1 256 . 8 1 1 A 30 30 GLN CB C 30 28.161 28.756 -0.595 1
1 258 . 8 1 1 A 30 30 GLN N N 30 112.109 115.935 -3.826 1
1 260 . 8 1 1 A 31 31 GLU H H 31 7.248 8.436 -1.188 1
1 261 . 8 1 1 A 31 31 GLU HA H 31 4.063 4.076 -0.013 1
1 266 . 8 1 1 A 31 31 GLU C C 31 177.423 179.627 -2.204 1
1 267 . 8 1 1 A 31 31 GLU CA C 31 57.650 59.071 -1.421 1
1 268 . 8 1 1 A 31 31 GLU CB C 31 29.757 29.453 0.304 1
1 270 . 8 1 1 A 31 31 GLU N N 31 115.340 119.842 -4.502 1
1 271 . 8 1 1 A 32 32 LEU H H 32 7.169 7.782 -0.613 1
1 272 . 8 1 1 A 32 32 LEU HA H 32 4.087 4.043 0.044 1
1 282 . 8 1 1 A 32 32 LEU C C 32 175.850 177.146 -1.296 1
1 283 . 8 1 1 A 32 32 LEU CA C 32 55.580 57.433 -1.853 1
1 284 . 8 1 1 A 32 32 LEU CB C 32 42.910 41.196 1.714 1
1 288 . 8 1 1 A 32 32 LEU N N 32 116.367 116.334 0.033 1
1 289 . 8 1 1 A 33 33 LEU H H 33 7.062 7.737 -0.675 1
1 290 . 8 1 1 A 33 33 LEU HA H 33 4.431 4.269 0.162 1
1 300 . 8 1 1 A 33 33 LEU C C 33 174.837 176.980 -2.143 1
1 301 . 8 1 1 A 33 33 LEU CA C 33 53.521 55.172 -1.651 1
1 302 . 8 1 1 A 33 33 LEU CB C 33 43.301 41.070 2.231 1
1 306 . 8 1 1 A 33 33 LEU N N 33 118.568 122.726 -4.158 1
1 307 . 8 1 1 A 34 34 LYS H H 34 8.749 8.638 0.111 1
1 308 . 8 1 1 A 34 34 LYS HA H 34 4.162 4.331 -0.169 1
1 317 . 8 1 1 A 34 34 LYS C C 34 174.378 175.388 -1.010 1
1 318 . 8 1 1 A 34 34 LYS CA C 34 56.575 56.235 0.340 1
1 319 . 8 1 1 A 34 34 LYS CB C 34 36.918 34.533 2.385 1
1 323 . 8 1 1 A 34 34 LYS N N 34 121.659 118.786 2.873 1
1 324 . 8 1 1 A 35 35 LYS H H 35 8.137 7.332 0.805 1
1 325 . 8 1 1 A 35 35 LYS HA H 35 4.011 4.788 -0.777 1
1 334 . 8 1 1 A 35 35 LYS C C 35 174.343 175.263 -0.920 1
1 335 . 8 1 1 A 35 35 LYS CA C 35 53.960 54.353 -0.393 1
1 336 . 8 1 1 A 35 35 LYS CB C 35 35.587 35.520 0.067 1
1 340 . 8 1 1 A 35 35 LYS N N 35 119.354 115.798 3.556 1
1 341 . 8 1 1 A 36 36 GLN H H 36 8.394 8.703 -0.309 1
1 342 . 8 1 1 A 36 36 GLN HA H 36 4.187 4.477 -0.290 1
1 349 . 8 1 1 A 36 36 GLN C C 36 177.012 176.682 0.330 1
1 350 . 8 1 1 A 36 36 GLN CA C 36 57.750 57.934 -0.184 1
1 351 . 8 1 1 A 36 36 GLN CB C 36 28.433 28.454 -0.021 1
1 353 . 8 1 1 A 36 36 GLN N N 36 120.248 123.305 -3.057 1
1 355 . 8 1 1 A 37 37 GLY H H 37 9.597 8.950 0.647 1
1 356 . 8 1 1 A 37 37 GLY HA2 H 37 4.486 4.099 0.387 1
1 357 . 8 1 1 A 37 37 GLY HA3 H 37 3.926 4.109 -0.183 1
1 358 . 8 1 1 A 37 37 GLY C C 37 176.285 174.559 1.726 1
1 359 . 8 1 1 A 37 37 GLY CA C 37 46.146 45.465 0.681 1
1 360 . 8 1 1 A 37 37 GLY N N 37 116.637 114.696 1.941 1
1 361 . 8 1 1 A 38 38 ASP H H 38 8.925 7.909 1.016 1
1 362 . 8 1 1 A 38 38 ASP HA H 38 5.697 4.673 1.024 1
1 365 . 8 1 1 A 38 38 ASP C C 38 176.181 175.672 0.509 1
1 366 . 8 1 1 A 38 38 ASP CA C 38 55.066 55.456 -0.390 1
1 367 . 8 1 1 A 38 38 ASP CB C 38 42.933 41.130 1.803 1
1 368 . 8 1 1 A 38 38 ASP N N 38 127.293 121.932 5.361 1
1 369 . 8 1 1 A 39 39 PHE H H 39 8.647 8.603 0.044 1
1 370 . 8 1 1 A 39 39 PHE HA H 39 6.025 6.083 -0.058 1
1 378 . 8 1 1 A 39 39 PHE C C 39 170.948 173.052 -2.104 1
1 379 . 8 1 1 A 39 39 PHE CA C 39 56.376 56.213 0.163 1
1 380 . 8 1 1 A 39 39 PHE CB C 39 44.583 43.246 1.337 1
1 386 . 8 1 1 A 39 39 PHE N N 39 117.102 119.908 -2.806 1
1 387 . 8 1 1 A 40 40 LEU H H 40 9.186 8.992 0.194 1
1 388 . 8 1 1 A 40 40 LEU HA H 40 4.983 5.090 -0.107 1
1 398 . 8 1 1 A 40 40 LEU C C 40 174.787 174.377 0.410 1
1 399 . 8 1 1 A 40 40 LEU CA C 40 54.610 53.976 0.634 1
1 400 . 8 1 1 A 40 40 LEU CB C 40 44.330 46.000 -1.670 1
1 404 . 8 1 1 A 40 40 LEU N N 40 114.388 117.968 -3.580 1
1 405 . 8 1 1 A 41 41 VAL H H 41 9.390 9.436 -0.046 1
1 406 . 8 1 1 A 41 41 VAL HA H 41 5.742 4.999 0.743 1
1 414 . 8 1 1 A 41 41 VAL C C 41 172.760 175.611 -2.851 1
1 415 . 8 1 1 A 41 41 VAL CA C 41 60.814 61.874 -1.060 1
1 416 . 8 1 1 A 41 41 VAL CB C 41 34.908 33.156 1.752 1
1 419 . 8 1 1 A 41 41 VAL N N 41 119.873 122.638 -2.765 1
1 420 . 8 1 1 A 42 42 ARG H H 42 9.598 9.284 0.314 1
1 421 . 8 1 1 A 42 42 ARG HA H 42 5.247 5.165 0.082 1
1 429 . 8 1 1 A 42 42 ARG C C 42 173.379 174.524 -1.145 1
1 430 . 8 1 1 A 42 42 ARG CA C 42 53.202 54.147 -0.945 1
1 431 . 8 1 1 A 42 42 ARG CB C 42 33.507 33.905 -0.398 1
1 434 . 8 1 1 A 42 42 ARG N N 42 124.179 124.705 -0.526 1
1 436 . 8 1 1 A 43 43 GLU H H 43 8.234 8.753 -0.519 1
1 437 . 8 1 1 A 43 43 GLU HA H 43 4.890 4.894 -0.004 1
1 442 . 8 1 1 A 43 43 GLU C C 43 176.929 176.322 0.607 1
1 443 . 8 1 1 A 43 43 GLU CA C 43 54.846 55.090 -0.244 1
1 444 . 8 1 1 A 43 43 GLU CB C 43 31.599 31.531 0.068 1
1 446 . 8 1 1 A 43 43 GLU N N 43 124.103 123.106 0.997 1
1 447 . 8 1 1 A 44 44 SER H H 44 9.033 8.951 0.082 1
1 448 . 8 1 1 A 44 44 SER HA H 44 3.957 4.380 -0.423 1
1 451 . 8 1 1 A 44 44 SER C C 44 175.005 174.909 0.096 1
1 452 . 8 1 1 A 44 44 SER CA C 44 59.393 60.298 -0.905 1
1 453 . 8 1 1 A 44 44 SER CB C 44 63.619 63.103 0.516 1
1 454 . 8 1 1 A 44 44 SER N N 44 124.316 121.959 2.357 1
1 455 . 8 1 1 A 45 45 HIS H H 45 8.461 8.958 -0.497 1
1 456 . 8 1 1 A 45 45 HIS HA H 45 4.132 4.129 0.003 1
1 460 . 8 1 1 A 45 45 HIS C C 45 176.480 176.689 -0.209 1
1 461 . 8 1 1 A 45 45 HIS CA C 45 58.887 59.485 -0.598 1
1 462 . 8 1 1 A 45 45 HIS CB C 45 30.180 30.038 0.142 1
1 464 . 8 1 1 A 45 45 HIS N N 45 127.694 126.074 1.620 1
1 465 . 8 1 1 A 46 46 GLY H H 46 8.513 8.148 0.365 1
1 466 . 8 1 1 A 46 46 GLY HA2 H 46 3.827 3.806 0.021 1
1 467 . 8 1 1 A 46 46 GLY HA3 H 46 3.827 3.881 -0.054 1
1 468 . 8 1 1 A 46 46 GLY C C 46 173.630 173.561 0.069 1
1 469 . 8 1 1 A 46 46 GLY CA C 46 45.188 45.289 -0.101 1
1 470 . 8 1 1 A 46 46 GLY N N 46 110.761 104.985 5.776 1
1 471 . 8 1 1 A 47 47 LYS H H 47 7.216 7.449 -0.233 1
1 472 . 8 1 1 A 47 47 LYS HA H 47 4.540 4.814 -0.274 1
1 481 . 8 1 1 A 47 47 LYS CA C 47 53.475 52.781 0.694 1
1 482 . 8 1 1 A 47 47 LYS CB C 47 33.325 34.273 -0.948 1
1 486 . 8 1 1 A 47 47 LYS N N 47 121.356 120.110 1.246 1
1 487 . 8 1 1 A 48 48 PRO HA H 48 4.181 4.243 -0.062 1
1 494 . 8 1 1 A 48 48 PRO C C 48 178.920 177.647 1.273 1
1 495 . 8 1 1 A 48 48 PRO CA C 48 63.239 63.859 -0.620 1
1 496 . 8 1 1 A 48 48 PRO CB C 48 31.523 31.384 0.139 1
1 499 . 8 1 1 A 49 49 GLY H H 49 9.752 8.338 1.414 1
1 500 . 8 1 1 A 49 49 GLY HA2 H 49 4.053 3.949 0.104 1
1 501 . 8 1 1 A 49 49 GLY HA3 H 49 3.374 3.951 -0.577 1
1 502 . 8 1 1 A 49 49 GLY C C 49 172.093 173.627 -1.534 1
1 503 . 8 1 1 A 49 49 GLY CA C 49 45.041 45.481 -0.440 1
1 504 . 8 1 1 A 49 49 GLY N N 49 112.415 112.692 -0.277 1
1 505 . 8 1 1 A 50 50 GLU H H 50 7.623 7.316 0.307 1
1 506 . 8 1 1 A 50 50 GLU HA H 50 4.537 4.781 -0.244 1
1 511 . 8 1 1 A 50 50 GLU C C 50 173.297 174.767 -1.470 1
1 512 . 8 1 1 A 50 50 GLU CA C 50 55.174 55.095 0.079 1
1 513 . 8 1 1 A 50 50 GLU CB C 50 31.651 32.126 -0.475 1
1 515 . 8 1 1 A 50 50 GLU N N 50 121.600 120.887 0.713 1
1 516 . 8 1 1 A 51 51 TYR H H 51 9.452 9.291 0.161 1
1 517 . 8 1 1 A 51 51 TYR HA H 51 5.382 5.600 -0.218 1
1 524 . 8 1 1 A 51 51 TYR C C 51 174.387 175.347 -0.960 1
1 525 . 8 1 1 A 51 51 TYR CA C 51 57.592 56.391 1.201 1
1 526 . 8 1 1 A 51 51 TYR CB C 51 41.820 41.373 0.447 1
1 531 . 8 1 1 A 51 51 TYR N N 51 125.790 126.322 -0.532 1
1 532 . 8 1 1 A 52 52 VAL H H 52 9.471 9.583 -0.112 1
1 533 . 8 1 1 A 52 52 VAL HA H 52 4.840 5.067 -0.227 1
1 541 . 8 1 1 A 52 52 VAL C C 52 174.947 174.735 0.212 1
1 542 . 8 1 1 A 52 52 VAL CA C 52 60.991 61.217 -0.226 1
1 543 . 8 1 1 A 52 52 VAL CB C 52 36.829 34.742 2.087 1
1 546 . 8 1 1 A 52 52 VAL N N 52 120.617 123.211 -2.594 1
1 547 . 8 1 1 A 53 53 LEU H H 53 9.457 9.380 0.077 1
1 548 . 8 1 1 A 53 53 LEU HA H 53 5.294 5.244 0.050 1
1 558 . 8 1 1 A 53 53 LEU C C 53 175.024 174.762 0.262 1
1 559 . 8 1 1 A 53 53 LEU CA C 53 53.904 54.410 -0.506 1
1 560 . 8 1 1 A 53 53 LEU CB C 53 44.756 44.177 0.579 1
1 564 . 8 1 1 A 53 53 LEU N N 53 127.725 131.314 -3.589 1
1 565 . 8 1 1 A 54 54 SER H H 54 9.461 9.541 -0.080 1
1 566 . 8 1 1 A 54 54 SER HA H 54 5.691 5.309 0.382 1
1 569 . 8 1 1 A 54 54 SER C C 54 172.227 173.052 -0.825 1
1 570 . 8 1 1 A 54 54 SER CA C 54 58.551 58.020 0.531 1
1 571 . 8 1 1 A 54 54 SER CB C 54 65.738 64.255 1.483 1
1 572 . 8 1 1 A 54 54 SER N N 54 127.178 124.999 2.179 1
1 573 . 8 1 1 A 55 55 VAL H H 55 9.049 9.055 -0.006 1
1 574 . 8 1 1 A 55 55 VAL HA H 55 5.691 5.527 0.164 1
1 582 . 8 1 1 A 55 55 VAL C C 55 173.959 172.821 1.138 1
1 583 . 8 1 1 A 55 55 VAL CA C 55 58.398 59.730 -1.332 1
1 584 . 8 1 1 A 55 55 VAL CB C 55 36.262 35.373 0.889 1
1 587 . 8 1 1 A 55 55 VAL N N 55 120.619 125.550 -4.931 1
1 588 . 8 1 1 A 56 56 TYR H H 56 8.629 9.266 -0.637 1
1 589 . 8 1 1 A 56 56 TYR HA H 56 4.951 4.874 0.077 1
1 596 . 8 1 1 A 56 56 TYR C C 56 175.224 174.778 0.446 1
1 597 . 8 1 1 A 56 56 TYR CA C 56 56.684 56.782 -0.098 1
1 598 . 8 1 1 A 56 56 TYR CB C 56 39.646 39.190 0.456 1
1 603 . 8 1 1 A 56 56 TYR N N 56 127.444 130.454 -3.010 1
1 604 . 8 1 1 A 57 57 SER H H 57 8.869 8.674 0.195 1
1 605 . 8 1 1 A 57 57 SER HA H 57 4.739 4.857 -0.118 1
1 608 . 8 1 1 A 57 57 SER C C 57 174.492 173.521 0.971 1
1 609 . 8 1 1 A 57 57 SER CA C 57 57.591 57.241 0.350 1
1 610 . 8 1 1 A 57 57 SER CB C 57 64.281 66.016 -1.735 1
1 611 . 8 1 1 A 57 57 SER N N 57 122.165 123.104 -0.939 1
1 612 . 8 1 1 A 58 58 ASP H H 58 10.446 9.357 1.089 1
1 613 . 8 1 1 A 58 58 ASP HA H 58 4.382 4.262 0.120 1
1 616 . 8 1 1 A 58 58 ASP C C 58 176.398 175.076 1.322 1
1 617 . 8 1 1 A 58 58 ASP CA C 58 55.215 54.950 0.265 1
1 618 . 8 1 1 A 58 58 ASP CB C 58 39.513 39.744 -0.231 1
1 619 . 8 1 1 A 58 58 ASP N N 58 132.098 128.969 3.129 1
1 620 . 8 1 1 A 59 59 GLY H H 59 7.861 8.258 -0.397 1
1 621 . 8 1 1 A 59 59 GLY HA2 H 59 3.817 3.746 0.071 1
1 622 . 8 1 1 A 59 59 GLY HA3 H 59 4.086 3.774 0.312 1
1 623 . 8 1 1 A 59 59 GLY C C 59 173.111 173.440 -0.329 1
1 624 . 8 1 1 A 59 59 GLY CA C 59 45.486 45.187 0.299 1
1 625 . 8 1 1 A 59 59 GLY N N 59 102.674 103.975 -1.301 1
1 626 . 8 1 1 A 60 60 GLN H H 60 7.137 7.425 -0.288 1
1 627 . 8 1 1 A 60 60 GLN HA H 60 4.455 4.427 0.028 1
1 634 . 8 1 1 A 60 60 GLN C C 60 173.549 175.261 -1.712 1
1 635 . 8 1 1 A 60 60 GLN CA C 60 53.388 54.501 -1.113 1
1 636 . 8 1 1 A 60 60 GLN CB C 60 32.373 30.060 2.313 1
1 638 . 8 1 1 A 60 60 GLN N N 60 116.206 119.426 -3.220 1
1 640 . 8 1 1 A 61 61 ARG H H 61 8.589 8.377 0.212 1
1 641 . 8 1 1 A 61 61 ARG HA H 61 4.740 4.402 0.338 1
1 649 . 8 1 1 A 61 61 ARG C C 61 174.458 174.496 -0.038 1
1 650 . 8 1 1 A 61 61 ARG CA C 61 57.116 55.594 1.522 1
1 651 . 8 1 1 A 61 61 ARG CB C 61 29.615 30.566 -0.951 1
1 654 . 8 1 1 A 61 61 ARG N N 61 120.467 121.965 -1.498 1
1 656 . 8 1 1 A 62 62 ARG H H 62 8.867 8.814 0.053 1
1 657 . 8 1 1 A 62 62 ARG HA H 62 4.297 4.396 -0.099 1
1 665 . 8 1 1 A 62 62 ARG C C 62 173.485 175.342 -1.857 1
1 666 . 8 1 1 A 62 62 ARG CA C 62 53.355 55.143 -1.788 1
1 667 . 8 1 1 A 62 62 ARG CB C 62 33.028 30.844 2.184 1
1 670 . 8 1 1 A 62 62 ARG N N 62 122.641 124.655 -2.014 1
1 672 . 8 1 1 A 63 63 HIS H H 63 7.997 8.545 -0.548 1
1 673 . 8 1 1 A 63 63 HIS HA H 63 5.427 5.718 -0.291 1
1 678 . 8 1 1 A 63 63 HIS C C 63 174.946 173.759 1.187 1
1 679 . 8 1 1 A 63 63 HIS CA C 63 54.689 53.544 1.145 1
1 680 . 8 1 1 A 63 63 HIS CB C 63 33.008 32.526 0.482 1
1 683 . 8 1 1 A 63 63 HIS N N 63 119.064 120.689 -1.625 1
1 684 . 8 1 1 A 64 64 PHE H H 64 9.880 9.326 0.554 1
1 685 . 8 1 1 A 64 64 PHE HA H 64 4.824 5.059 -0.235 1
1 693 . 8 1 1 A 64 64 PHE C C 64 174.882 175.207 -0.325 1
1 694 . 8 1 1 A 64 64 PHE CA C 64 56.489 56.409 0.080 1
1 695 . 8 1 1 A 64 64 PHE CB C 64 41.405 41.612 -0.207 1
1 701 . 8 1 1 A 64 64 PHE N N 64 123.961 122.211 1.750 1
1 702 . 8 1 1 A 65 65 ILE H H 65 8.982 9.153 -0.171 1
1 703 . 8 1 1 A 65 65 ILE HA H 65 4.273 4.770 -0.497 1
1 713 . 8 1 1 A 65 65 ILE C C 65 176.556 175.890 0.666 1
1 714 . 8 1 1 A 65 65 ILE CA C 65 62.649 61.005 1.644 1
1 715 . 8 1 1 A 65 65 ILE CB C 65 38.296 38.645 -0.349 1
1 719 . 8 1 1 A 65 65 ILE N N 65 126.601 123.615 2.986 1
1 720 . 8 1 1 A 66 66 ILE H H 66 8.947 8.953 -0.006 1
1 721 . 8 1 1 A 66 66 ILE HA H 66 3.780 4.614 -0.834 1
1 731 . 8 1 1 A 66 66 ILE C C 66 175.721 175.513 0.208 1
1 732 . 8 1 1 A 66 66 ILE CA C 66 62.960 60.776 2.184 1
1 733 . 8 1 1 A 66 66 ILE CB C 66 37.209 38.879 -1.670 1
1 737 . 8 1 1 A 66 66 ILE N N 66 130.139 128.569 1.570 1
1 738 . 8 1 1 A 67 67 GLN H H 67 8.410 9.121 -0.711 1
1 739 . 8 1 1 A 67 67 GLN HA H 67 4.422 4.936 -0.514 1
1 746 . 8 1 1 A 67 67 GLN C C 67 174.347 173.900 0.447 1
1 747 . 8 1 1 A 67 67 GLN CA C 67 55.867 55.056 0.811 1
1 748 . 8 1 1 A 67 67 GLN CB C 67 29.950 30.753 -0.803 1
1 750 . 8 1 1 A 67 67 GLN N N 67 128.872 127.191 1.681 1
1 752 . 8 1 1 A 68 68 TYR H H 68 8.619 8.893 -0.274 1
1 753 . 8 1 1 A 68 68 TYR HA H 68 5.300 4.865 0.435 1
1 760 . 8 1 1 A 68 68 TYR C C 68 174.695 174.106 0.589 1
1 761 . 8 1 1 A 68 68 TYR CA C 68 55.579 56.166 -0.587 1
1 762 . 8 1 1 A 68 68 TYR CB C 68 39.479 39.523 -0.044 1
1 767 . 8 1 1 A 68 68 TYR N N 68 124.772 124.784 -0.012 1
1 768 . 8 1 1 A 69 69 VAL H H 69 8.539 8.640 -0.101 1
1 769 . 8 1 1 A 69 69 VAL HA H 69 4.046 4.328 -0.282 1
1 777 . 8 1 1 A 69 69 VAL C C 69 175.010 175.386 -0.376 1
1 778 . 8 1 1 A 69 69 VAL CA C 69 60.611 60.881 -0.270 1
1 779 . 8 1 1 A 69 69 VAL CB C 69 35.358 34.212 1.146 1
1 782 . 8 1 1 A 69 69 VAL N N 69 126.652 127.906 -1.254 1
1 783 . 8 1 1 A 70 70 ASP H H 70 9.089 9.409 -0.320 1
1 784 . 8 1 1 A 70 70 ASP HA H 70 4.025 4.171 -0.146 1
1 787 . 8 1 1 A 70 70 ASP C C 70 174.813 174.915 -0.102 1
1 788 . 8 1 1 A 70 70 ASP CA C 70 55.623 55.695 -0.072 1
1 789 . 8 1 1 A 70 70 ASP CB C 70 39.081 39.003 0.078 1
1 790 . 8 1 1 A 70 70 ASP N N 70 128.327 129.344 -1.017 1
1 791 . 8 1 1 A 71 71 ASN H H 71 8.128 7.979 0.149 1
1 792 . 8 1 1 A 71 71 ASN HA H 71 3.597 3.706 -0.109 1
1 797 . 8 1 1 A 71 71 ASN C C 71 173.250 173.651 -0.401 1
1 798 . 8 1 1 A 71 71 ASN CA C 71 54.728 54.292 0.436 1
1 799 . 8 1 1 A 71 71 ASN CB C 71 37.601 37.239 0.362 1
1 800 . 8 1 1 A 71 71 ASN N N 71 107.230 107.695 -0.465 1
1 802 . 8 1 1 A 72 72 MET H H 72 7.256 7.329 -0.073 1
1 803 . 8 1 1 A 72 72 MET HA H 72 4.740 4.865 -0.125 1
1 808 . 8 1 1 A 72 72 MET C C 72 173.780 174.355 -0.575 1
1 809 . 8 1 1 A 72 72 MET CA C 72 53.703 54.150 -0.447 1
1 810 . 8 1 1 A 72 72 MET CB C 72 36.570 35.728 0.842 1
1 812 . 8 1 1 A 72 72 MET N N 72 117.117 116.726 0.391 1
1 813 . 8 1 1 A 73 73 TYR H H 73 9.430 9.267 0.163 1
1 814 . 8 1 1 A 73 73 TYR HA H 73 5.718 5.237 0.481 1
1 821 . 8 1 1 A 73 73 TYR C C 73 176.140 175.850 0.290 1
1 822 . 8 1 1 A 73 73 TYR CA C 73 57.290 58.178 -0.888 1
1 823 . 8 1 1 A 73 73 TYR CB C 73 40.013 39.671 0.342 1
1 828 . 8 1 1 A 73 73 TYR N N 73 119.856 122.740 -2.884 1
1 829 . 8 1 1 A 74 74 ARG H H 74 9.038 8.870 0.168 1
1 830 . 8 1 1 A 74 74 ARG HA H 74 4.867 4.847 0.020 1
1 838 . 8 1 1 A 74 74 ARG C C 74 173.954 175.155 -1.201 1
1 839 . 8 1 1 A 74 74 ARG CA C 74 54.887 54.363 0.524 1
1 840 . 8 1 1 A 74 74 ARG CB C 74 34.484 33.934 0.550 1
1 843 . 8 1 1 A 74 74 ARG N N 74 117.344 119.981 -2.637 1
1 845 . 8 1 1 A 75 75 PHE H H 75 9.005 8.830 0.175 1
1 846 . 8 1 1 A 75 75 PHE HA H 75 5.046 4.705 0.341 1
1 854 . 8 1 1 A 75 75 PHE C C 75 176.186 175.617 0.569 1
1 855 . 8 1 1 A 75 75 PHE CA C 75 59.658 59.165 0.493 1
1 856 . 8 1 1 A 75 75 PHE CB C 75 39.356 40.885 -1.529 1
1 862 . 8 1 1 A 75 75 PHE N N 75 117.865 120.231 -2.366 1
1 863 . 8 1 1 A 76 76 GLU H H 76 8.213 8.540 -0.327 1
1 864 . 8 1 1 A 76 76 GLU HA H 76 4.586 4.762 -0.176 1
1 869 . 8 1 1 A 76 76 GLU C C 76 175.238 177.545 -2.307 1
1 870 . 8 1 1 A 76 76 GLU CA C 76 55.994 57.751 -1.757 1
1 871 . 8 1 1 A 76 76 GLU CB C 76 31.805 31.011 0.794 1
1 873 . 8 1 1 A 76 76 GLU N N 76 116.834 120.110 -3.276 1
1 874 . 8 1 1 A 77 77 GLY H H 77 8.692 7.783 0.909 1
1 875 . 8 1 1 A 77 77 GLY HA2 H 77 4.166 3.937 0.229 1
1 876 . 8 1 1 A 77 77 GLY HA3 H 77 4.015 3.937 0.078 1
1 877 . 8 1 1 A 77 77 GLY C C 77 173.784 174.036 -0.252 1
1 878 . 8 1 1 A 77 77 GLY CA C 77 45.505 46.383 -0.878 1
1 879 . 8 1 1 A 77 77 GLY N N 77 111.937 107.636 4.301 1
1 880 . 8 1 1 A 78 78 THR H H 78 8.332 7.826 0.506 1
1 881 . 8 1 1 A 78 78 THR HA H 78 3.900 4.311 -0.411 1
1 886 . 8 1 1 A 78 78 THR C C 78 173.591 173.987 -0.396 1
1 887 . 8 1 1 A 78 78 THR CA C 78 63.653 62.489 1.164 1
1 888 . 8 1 1 A 78 78 THR CB C 78 69.649 69.561 0.088 1
1 890 . 8 1 1 A 78 78 THR N N 78 120.765 115.435 5.330 1
1 891 . 8 1 1 A 79 79 GLY H H 79 8.038 8.363 -0.325 1
1 892 . 8 1 1 A 79 79 GLY HA2 H 79 4.748 4.327 0.421 1
1 893 . 8 1 1 A 79 79 GLY HA3 H 79 3.546 4.459 -0.913 1
1 894 . 8 1 1 A 79 79 GLY C C 79 172.580 171.696 0.884 1
1 895 . 8 1 1 A 79 79 GLY CA C 79 44.661 45.902 -1.241 1
1 896 . 8 1 1 A 79 79 GLY N N 79 109.887 113.192 -3.305 1
1 897 . 8 1 1 A 80 80 PHE H H 80 9.064 8.655 0.409 1
1 898 . 8 1 1 A 80 80 PHE HA H 80 4.886 5.021 -0.135 1
1 906 . 8 1 1 A 80 80 PHE C C 80 176.507 176.226 0.281 1
1 907 . 8 1 1 A 80 80 PHE CA C 80 57.257 56.591 0.666 1
1 908 . 8 1 1 A 80 80 PHE CB C 80 44.655 42.806 1.849 1
1 914 . 8 1 1 A 80 80 PHE N N 80 116.862 119.318 -2.456 1
1 915 . 8 1 1 A 81 81 SER H H 81 9.413 8.795 0.618 1
1 916 . 8 1 1 A 81 81 SER HA H 81 4.622 4.771 -0.149 1
1 919 . 8 1 1 A 81 81 SER C C 81 173.735 174.788 -1.053 1
1 920 . 8 1 1 A 81 81 SER CA C 81 61.410 61.316 0.094 1
1 921 . 8 1 1 A 81 81 SER CB C 81 64.165 63.237 0.928 1
1 922 . 8 1 1 A 81 81 SER N N 81 116.467 116.942 -0.475 1
1 923 . 8 1 1 A 82 82 ASN H H 82 7.688 8.051 -0.363 1
1 924 . 8 1 1 A 82 82 ASN HA H 82 4.952 5.191 -0.239 1
1 929 . 8 1 1 A 82 82 ASN C C 82 173.303 175.544 -2.241 1
1 930 . 8 1 1 A 82 82 ASN CA C 82 52.086 52.224 -0.138 1
1 931 . 8 1 1 A 82 82 ASN CB C 82 41.258 40.888 0.370 1
1 932 . 8 1 1 A 82 82 ASN N N 82 113.355 117.348 -3.993 1
1 934 . 8 1 1 A 83 83 ILE H H 83 8.858 8.653 0.205 1
1 935 . 8 1 1 A 83 83 ILE HA H 83 3.571 3.752 -0.181 1
1 945 . 8 1 1 A 83 83 ILE CA C 83 66.416 65.144 1.272 1
1 946 . 8 1 1 A 83 83 ILE CB C 83 35.074 34.709 0.365 1
1 950 . 8 1 1 A 83 83 ILE N N 83 118.908 123.628 -4.720 1
1 951 . 8 1 1 A 84 84 PRO HA H 84 4.411 4.715 -0.304 1
1 958 . 8 1 1 A 84 84 PRO C C 84 177.616 179.477 -1.861 1
1 959 . 8 1 1 A 84 84 PRO CA C 84 67.525 66.563 0.962 1
1 960 . 8 1 1 A 84 84 PRO CB C 84 31.029 30.965 0.064 1
1 963 . 8 1 1 A 85 85 GLN H H 85 8.405 8.347 0.058 1
1 964 . 8 1 1 A 85 85 GLN HA H 85 3.874 4.029 -0.155 1
1 971 . 8 1 1 A 85 85 GLN C C 85 178.213 178.326 -0.113 1
1 972 . 8 1 1 A 85 85 GLN CA C 85 59.495 58.581 0.914 1
1 973 . 8 1 1 A 85 85 GLN CB C 85 29.270 28.066 1.204 1
1 975 . 8 1 1 A 85 85 GLN N N 85 115.597 117.231 -1.634 1
1 977 . 8 1 1 A 86 86 LEU H H 86 7.136 8.164 -1.028 1
1 978 . 8 1 1 A 86 86 LEU HA H 86 3.589 3.803 -0.214 1
1 988 . 8 1 1 A 86 86 LEU C C 86 177.728 178.385 -0.657 1
1 989 . 8 1 1 A 86 86 LEU CA C 86 58.136 58.436 -0.300 1
1 990 . 8 1 1 A 86 86 LEU CB C 86 42.290 41.732 0.558 1
1 994 . 8 1 1 A 86 86 LEU N N 86 121.840 122.062 -0.222 1
1 995 . 8 1 1 A 87 87 ILE H H 87 8.323 7.915 0.408 1
1 996 . 8 1 1 A 87 87 ILE HA H 87 3.415 3.394 0.021 1
1 1006 . 8 1 1 A 87 87 ILE C C 87 178.064 177.739 0.325 1
1 1007 . 8 1 1 A 87 87 ILE CA C 87 61.458 65.291 -3.833 1
1 1008 . 8 1 1 A 87 87 ILE CB C 87 34.561 37.077 -2.516 1
1 1012 . 8 1 1 A 87 87 ILE N N 87 118.117 119.384 -1.267 1
1 1013 . 8 1 1 A 88 88 ASP H H 88 8.805 8.379 0.426 1
1 1014 . 8 1 1 A 88 88 ASP HA H 88 4.548 4.302 0.246 1
1 1017 . 8 1 1 A 88 88 ASP C C 88 179.265 178.102 1.163 1
1 1018 . 8 1 1 A 88 88 ASP CA C 88 58.099 57.391 0.708 1
1 1019 . 8 1 1 A 88 88 ASP CB C 88 42.166 41.901 0.265 1
1 1020 . 8 1 1 A 88 88 ASP N N 88 119.143 120.590 -1.447 1
1 1021 . 8 1 1 A 89 89 HIS H H 89 8.113 8.160 -0.047 1
1 1022 . 8 1 1 A 89 89 HIS HA H 89 4.225 4.208 0.017 1
1 1026 . 8 1 1 A 89 89 HIS C C 89 179.261 177.102 2.159 1
1 1027 . 8 1 1 A 89 89 HIS CA C 89 60.647 59.047 1.600 1
1 1028 . 8 1 1 A 89 89 HIS CB C 89 30.801 29.438 1.363 1
1 1030 . 8 1 1 A 89 89 HIS N N 89 119.595 119.231 0.364 1
1 1031 . 8 1 1 A 90 90 HIS H H 90 7.685 7.872 -0.187 1
1 1032 . 8 1 1 A 90 90 HIS HA H 90 3.628 4.144 -0.516 1
1 1036 . 8 1 1 A 90 90 HIS C C 90 178.454 177.551 0.903 1
1 1037 . 8 1 1 A 90 90 HIS CA C 90 61.797 59.895 1.902 1
1 1038 . 8 1 1 A 90 90 HIS CB C 90 28.165 29.758 -1.593 1
1 1040 . 8 1 1 A 90 90 HIS N N 90 120.061 117.428 2.633 1
1 1041 . 8 1 1 A 91 91 TYR H H 91 9.394 8.369 1.025 1
1 1042 . 8 1 1 A 91 91 TYR HA H 91 4.238 3.912 0.326 1
1 1049 . 8 1 1 A 91 91 TYR C C 91 176.443 177.519 -1.076 1
1 1050 . 8 1 1 A 91 91 TYR CA C 91 60.669 61.743 -1.074 1
1 1051 . 8 1 1 A 91 91 TYR CB C 91 39.169 38.985 0.184 1
1 1056 . 8 1 1 A 91 91 TYR N N 91 123.532 119.998 3.534 1
1 1057 . 8 1 1 A 92 92 THR H H 92 8.774 8.424 0.350 1
1 1058 . 8 1 1 A 92 92 THR HA H 92 3.866 4.035 -0.169 1
1 1063 . 8 1 1 A 92 92 THR C C 92 177.050 176.317 0.733 1
1 1064 . 8 1 1 A 92 92 THR CA C 92 65.240 65.375 -0.135 1
1 1065 . 8 1 1 A 92 92 THR CB C 92 69.298 67.886 1.412 1
1 1067 . 8 1 1 A 92 92 THR N N 92 112.000 112.753 -0.753 1
1 1068 . 8 1 1 A 93 93 THR H H 93 7.617 7.485 0.132 1
1 1069 . 8 1 1 A 93 93 THR HA H 93 4.133 4.096 0.037 1
1 1074 . 8 1 1 A 93 93 THR C C 93 176.234 175.042 1.192 1
1 1075 . 8 1 1 A 93 93 THR CA C 93 63.527 62.881 0.646 1
1 1076 . 8 1 1 A 93 93 THR CB C 93 71.234 69.885 1.349 1
1 1078 . 8 1 1 A 93 93 THR N N 93 109.883 112.965 -3.082 1
1 1079 . 8 1 1 A 94 94 LYS H H 94 7.210 7.844 -0.634 1
1 1080 . 8 1 1 A 94 94 LYS HA H 94 3.830 3.766 0.064 1
1 1089 . 8 1 1 A 94 94 LYS C C 94 174.331 175.741 -1.410 1
1 1090 . 8 1 1 A 94 94 LYS CA C 94 56.776 57.375 -0.599 1
1 1091 . 8 1 1 A 94 94 LYS CB C 94 28.095 31.060 -2.965 1
1 1095 . 8 1 1 A 94 94 LYS N N 94 112.818 121.325 -8.507 1
1 1096 . 8 1 1 A 95 95 GLN H H 95 7.439 7.471 -0.032 1
1 1097 . 8 1 1 A 95 95 GLN HA H 95 4.216 4.698 -0.482 1
1 1104 . 8 1 1 A 95 95 GLN C C 95 179.087 175.571 3.516 1
1 1105 . 8 1 1 A 95 95 GLN CA C 95 56.378 54.683 1.695 1
1 1106 . 8 1 1 A 95 95 GLN CB C 95 28.542 30.454 -1.912 1
1 1108 . 8 1 1 A 95 95 GLN N N 95 117.860 119.443 -1.583 1
1 1110 . 8 1 1 A 96 96 VAL H H 96 8.520 8.423 0.097 1
1 1111 . 8 1 1 A 96 96 VAL HA H 96 4.297 4.365 -0.068 1
1 1119 . 8 1 1 A 96 96 VAL C C 96 177.329 176.829 0.500 1
1 1120 . 8 1 1 A 96 96 VAL CA C 96 61.196 62.336 -1.140 1
1 1121 . 8 1 1 A 96 96 VAL CB C 96 32.735 33.005 -0.270 1
1 1124 . 8 1 1 A 96 96 VAL N N 96 124.208 122.449 1.759 1
1 1125 . 8 1 1 A 97 97 ILE H H 97 8.491 8.506 -0.015 1
1 1126 . 8 1 1 A 97 97 ILE HA H 97 2.995 3.600 -0.605 1
1 1136 . 8 1 1 A 97 97 ILE CA C 97 62.066 63.306 -1.240 1
1 1137 . 8 1 1 A 97 97 ILE CB C 97 36.117 37.673 -1.556 1
1 1141 . 8 1 1 A 97 97 ILE N N 97 119.561 124.442 -4.881 1
1 1142 . 8 1 1 A 98 98 THR HA H 98 4.460 4.609 -0.149 1
1 1147 . 8 1 1 A 98 98 THR C C 98 174.335 174.921 -0.586 1
1 1148 . 8 1 1 A 98 98 THR CA C 98 58.244 59.376 -1.132 1
1 1149 . 8 1 1 A 98 98 THR CB C 98 73.056 71.274 1.782 1
1 1151 . 8 1 1 A 99 99 LYS H H 99 9.761 9.121 0.640 1
1 1152 . 8 1 1 A 99 99 LYS HA H 99 3.911 4.111 -0.200 1
1 1161 . 8 1 1 A 99 99 LYS C C 99 179.594 178.308 1.286 1
1 1162 . 8 1 1 A 99 99 LYS CA C 99 59.661 58.408 1.253 1
1 1163 . 8 1 1 A 99 99 LYS CB C 99 31.978 32.114 -0.136 1
1 1167 . 8 1 1 A 99 99 LYS N N 99 125.750 122.103 3.647 1
1 1168 . 8 1 1 A 100 100 LYS H H 100 8.910 7.717 1.193 1
1 1169 . 8 1 1 A 100 100 LYS HA H 100 4.024 4.203 -0.179 1
1 1178 . 8 1 1 A 100 100 LYS C C 100 178.060 177.482 0.578 1
1 1179 . 8 1 1 A 100 100 LYS CA C 100 58.642 58.566 0.076 1
1 1180 . 8 1 1 A 100 100 LYS CB C 100 32.750 32.384 0.366 1
1 1184 . 8 1 1 A 100 100 LYS N N 100 117.112 118.976 -1.864 1
1 1185 . 8 1 1 A 101 101 SER H H 101 7.721 7.829 -0.108 1
1 1186 . 8 1 1 A 101 101 SER HA H 101 4.282 4.721 -0.439 1
1 1189 . 8 1 1 A 101 101 SER C C 101 176.403 176.090 0.313 1
1 1190 . 8 1 1 A 101 101 SER CA C 101 60.442 58.682 1.760 1
1 1191 . 8 1 1 A 101 101 SER CB C 101 63.775 65.177 -1.402 1
1 1192 . 8 1 1 A 101 101 SER N N 101 112.069 111.240 0.829 1
1 1193 . 8 1 1 A 102 102 GLY H H 102 8.038 8.453 -0.415 1
1 1194 . 8 1 1 A 102 102 GLY HA2 H 102 4.024 3.872 0.152 1
1 1195 . 8 1 1 A 102 102 GLY HA3 H 102 3.713 3.892 -0.179 1
1 1196 . 8 1 1 A 102 102 GLY C C 102 173.991 174.766 -0.775 1
1 1197 . 8 1 1 A 102 102 GLY CA C 102 46.458 45.632 0.826 1
1 1198 . 8 1 1 A 102 102 GLY N N 102 111.144 110.474 0.670 1
1 1199 . 8 1 1 A 103 103 VAL H H 103 7.155 7.584 -0.429 1
1 1200 . 8 1 1 A 103 103 VAL HA H 103 3.652 3.952 -0.300 1
1 1208 . 8 1 1 A 103 103 VAL C C 103 173.805 175.312 -1.507 1
1 1209 . 8 1 1 A 103 103 VAL CA C 103 64.310 62.564 1.746 1
1 1210 . 8 1 1 A 103 103 VAL CB C 103 32.254 31.963 0.291 1
1 1213 . 8 1 1 A 103 103 VAL N N 103 119.836 122.177 -2.341 1
1 1214 . 8 1 1 A 104 104 VAL H H 104 7.653 8.903 -1.250 1
1 1215 . 8 1 1 A 104 104 VAL HA H 104 4.048 4.602 -0.554 1
1 1223 . 8 1 1 A 104 104 VAL C C 104 175.708 174.142 1.566 1
1 1224 . 8 1 1 A 104 104 VAL CA C 104 60.275 60.654 -0.379 1
1 1225 . 8 1 1 A 104 104 VAL CB C 104 35.112 34.615 0.497 1
1 1228 . 8 1 1 A 104 104 VAL N N 104 125.859 127.306 -1.447 1
1 1229 . 8 1 1 A 105 105 LEU H H 105 8.616 8.353 0.263 1
1 1230 . 8 1 1 A 105 105 LEU HA H 105 3.905 4.522 -0.617 1
1 1240 . 8 1 1 A 105 105 LEU C C 105 175.380 175.974 -0.594 1
1 1241 . 8 1 1 A 105 105 LEU CA C 105 54.471 53.718 0.753 1
1 1242 . 8 1 1 A 105 105 LEU CB C 105 39.821 41.872 -2.051 1
1 1246 . 8 1 1 A 105 105 LEU N N 105 123.839 126.547 -2.708 1
1 1247 . 8 1 1 A 106 106 LEU H H 106 8.894 8.577 0.317 1
1 1248 . 8 1 1 A 106 106 LEU HA H 106 4.839 5.110 -0.271 1
1 1258 . 8 1 1 A 106 106 LEU C C 106 176.930 176.436 0.494 1
1 1259 . 8 1 1 A 106 106 LEU CA C 106 56.288 53.305 2.983 1
1 1260 . 8 1 1 A 106 106 LEU CB C 106 45.237 45.537 -0.300 1
1 1264 . 8 1 1 A 106 106 LEU N N 106 120.590 121.428 -0.838 1
1 1265 . 8 1 1 A 107 107 ASN H H 107 8.124 9.204 -1.080 1
1 1266 . 8 1 1 A 107 107 ASN HA H 107 5.650 4.635 1.015 1
1 1271 . 8 1 1 A 107 107 ASN CA C 107 50.293 53.974 -3.681 1
1 1272 . 8 1 1 A 107 107 ASN CB C 107 41.223 36.184 5.039 1
1 1273 . 8 1 1 A 107 107 ASN N N 107 116.866 119.381 -2.515 1
1 1275 . 8 1 1 A 108 108 PRO HA H 108 2.926 3.630 -0.704 1
1 1282 . 8 1 1 A 108 108 PRO C C 108 176.671 176.533 0.138 1
1 1283 . 8 1 1 A 108 108 PRO CA C 108 60.804 62.301 -1.497 1
1 1284 . 8 1 1 A 108 108 PRO CB C 108 31.774 31.865 -0.091 1
1 1287 . 8 1 1 A 109 109 ILE H H 109 8.648 7.981 0.667 1
1 1288 . 8 1 1 A 109 109 ILE HA H 109 4.519 4.268 0.251 1
1 1298 . 8 1 1 A 109 109 ILE CA C 109 55.070 59.759 -4.689 1
1 1299 . 8 1 1 A 109 109 ILE CB C 109 36.068 38.232 -2.164 1
1 1303 . 8 1 1 A 109 109 ILE N N 109 128.817 123.656 5.161 1
1 1304 . 8 1 1 A 110 110 PRO HA H 110 4.587 4.374 0.213 1
1 1311 . 8 1 1 A 110 110 PRO C C 110 177.013 176.478 0.535 1
1 1312 . 8 1 1 A 110 110 PRO CA C 110 61.850 63.127 -1.277 1
1 1313 . 8 1 1 A 110 110 PRO CB C 110 32.507 31.872 0.635 1
1 1316 . 8 1 1 A 111 111 LYS H H 111 8.038 8.230 -0.192 1
1 1317 . 8 1 1 A 111 111 LYS HA H 111 3.553 3.808 -0.255 1
1 1326 . 8 1 1 A 111 111 LYS C C 111 176.123 176.244 -0.121 1
1 1327 . 8 1 1 A 111 111 LYS CA C 111 56.220 55.404 0.816 1
1 1328 . 8 1 1 A 111 111 LYS CB C 111 32.373 32.989 -0.616 1
1 1332 . 8 1 1 A 111 111 LYS N N 111 120.147 122.206 -2.059 1
1 1333 . 8 1 1 A 112 112 ASP H H 112 8.463 8.324 0.139 1
1 1334 . 8 1 1 A 112 112 ASP HA H 112 4.523 4.336 0.187 1
1 1337 . 8 1 1 A 112 112 ASP C C 112 175.986 175.674 0.312 1
1 1338 . 8 1 1 A 112 112 ASP CA C 112 54.256 54.496 -0.240 1
1 1339 . 8 1 1 A 112 112 ASP CB C 112 41.563 39.822 1.741 1
1 1340 . 8 1 1 A 112 112 ASP N N 112 121.863 125.642 -3.779 1
1 1341 . 8 1 1 A 113 113 LYS H H 113 8.059 8.605 -0.546 1
1 1342 . 8 1 1 A 113 113 LYS HA H 113 4.136 4.095 0.041 1
1 1351 . 8 1 1 A 113 113 LYS C C 113 176.010 176.608 -0.598 1
1 1352 . 8 1 1 A 113 113 LYS CA C 113 56.253 58.138 -1.885 1
1 1353 . 8 1 1 A 113 113 LYS CB C 113 32.754 32.924 -0.170 1
1 1357 . 8 1 1 A 113 113 LYS N N 113 121.725 125.861 -4.136 1
1 1358 . 8 1 1 A 114 114 LYS H H 114 8.225 7.199 1.026 1
1 1359 . 8 1 1 A 114 114 LYS HA H 114 4.169 4.733 -0.564 1
1 1368 . 8 1 1 A 114 114 LYS C C 114 176.198 175.689 0.509 1
1 1369 . 8 1 1 A 114 114 LYS CA C 114 56.413 54.936 1.477 1
1 1370 . 8 1 1 A 114 114 LYS CB C 114 32.725 35.542 -2.817 1
1 1374 . 8 1 1 A 114 114 LYS N N 114 121.857 114.046 7.811 1
1 1375 . 8 1 1 A 115 115 TRP H H 115 8.078 8.711 -0.633 1
1 1376 . 8 1 1 A 115 115 TRP HA H 115 4.709 4.774 -0.065 1
1 1385 . 8 1 1 A 115 115 TRP C C 115 175.119 176.874 -1.755 1
1 1386 . 8 1 1 A 115 115 TRP CA C 115 56.856 57.199 -0.343 1
1 1387 . 8 1 1 A 115 115 TRP CB C 115 29.474 29.264 0.210 1
1 1393 . 8 1 1 A 115 115 TRP N N 115 122.068 121.930 0.138 1
1 1 . 9 1 1 A 10 10 HIS HA H 10 4.616 4.886 -0.270 1
1 4 . 9 1 1 A 10 10 HIS C C 10 174.981 175.052 -0.071 1
1 5 . 9 1 1 A 10 10 HIS CA C 10 56.555 54.860 1.695 1
1 6 . 9 1 1 A 10 10 HIS CB C 10 30.231 33.518 -3.287 1
1 7 . 9 1 1 A 11 11 MET H H 11 8.103 8.869 -0.766 1
1 8 . 9 1 1 A 11 11 MET HA H 11 4.439 4.690 -0.251 1
1 13 . 9 1 1 A 11 11 MET C C 11 175.888 176.087 -0.199 1
1 14 . 9 1 1 A 11 11 MET CA C 11 55.090 54.782 0.308 1
1 15 . 9 1 1 A 11 11 MET CB C 11 33.121 33.234 -0.113 1
1 17 . 9 1 1 A 11 11 MET N N 11 120.743 122.088 -1.345 1
1 18 . 9 1 1 A 12 12 LYS H H 12 8.065 8.512 -0.447 1
1 19 . 9 1 1 A 12 12 LYS HA H 12 4.407 4.746 -0.339 1
1 28 . 9 1 1 A 12 12 LYS CA C 12 54.894 53.432 1.462 1
1 29 . 9 1 1 A 12 12 LYS CB C 12 31.863 32.026 -0.163 1
1 33 . 9 1 1 A 12 12 LYS N N 12 123.187 123.250 -0.063 1
1 34 . 9 1 1 A 13 13 PRO HA H 13 4.347 4.493 -0.146 1
1 41 . 9 1 1 A 13 13 PRO C C 13 176.891 177.787 -0.896 1
1 42 . 9 1 1 A 13 13 PRO CA C 13 62.542 62.863 -0.321 1
1 43 . 9 1 1 A 13 13 PRO CB C 13 32.663 32.569 0.094 1
1 46 . 9 1 1 A 14 14 LEU H H 14 8.339 8.768 -0.429 1
1 47 . 9 1 1 A 14 14 LEU HA H 14 3.373 3.927 -0.554 1
1 57 . 9 1 1 A 14 14 LEU C C 14 176.683 178.105 -1.422 1
1 58 . 9 1 1 A 14 14 LEU CA C 14 58.555 57.628 0.927 1
1 59 . 9 1 1 A 14 14 LEU CB C 14 41.828 40.994 0.834 1
1 63 . 9 1 1 A 14 14 LEU N N 14 123.191 124.849 -1.658 1
1 64 . 9 1 1 A 15 15 ALA H H 15 8.175 7.807 0.368 1
1 65 . 9 1 1 A 15 15 ALA HA H 15 3.983 4.162 -0.179 1
1 69 . 9 1 1 A 15 15 ALA C C 15 178.697 177.941 0.756 1
1 70 . 9 1 1 A 15 15 ALA CA C 15 54.164 54.236 -0.072 1
1 71 . 9 1 1 A 15 15 ALA CB C 15 18.771 18.186 0.585 1
1 72 . 9 1 1 A 15 15 ALA N N 15 113.594 119.821 -6.227 1
1 73 . 9 1 1 A 16 16 GLU H H 16 7.458 7.816 -0.358 1
1 74 . 9 1 1 A 16 16 GLU HA H 16 4.266 4.381 -0.115 1
1 79 . 9 1 1 A 16 16 GLU C C 16 176.510 176.476 0.034 1
1 80 . 9 1 1 A 16 16 GLU CA C 16 55.196 56.243 -1.047 1
1 81 . 9 1 1 A 16 16 GLU CB C 16 30.907 30.380 0.527 1
1 83 . 9 1 1 A 16 16 GLU N N 16 113.348 115.224 -1.876 1
1 84 . 9 1 1 A 17 17 GLN H H 17 7.501 6.978 0.523 1
1 85 . 9 1 1 A 17 17 GLN HA H 17 3.683 4.144 -0.461 1
1 92 . 9 1 1 A 17 17 GLN C C 17 178.053 176.329 1.724 1
1 93 . 9 1 1 A 17 17 GLN CA C 17 54.606 55.309 -0.703 1
1 94 . 9 1 1 A 17 17 GLN CB C 17 25.758 28.289 -2.531 1
1 96 . 9 1 1 A 17 17 GLN N N 17 119.411 119.778 -0.367 1
1 98 . 9 1 1 A 18 18 ASP H H 18 8.949 8.795 0.154 1
1 99 . 9 1 1 A 18 18 ASP HA H 18 4.184 4.176 0.008 1
1 102 . 9 1 1 A 18 18 ASP C C 18 175.263 177.621 -2.358 1
1 103 . 9 1 1 A 18 18 ASP CA C 18 57.275 56.610 0.665 1
1 104 . 9 1 1 A 18 18 ASP CB C 18 40.620 40.044 0.576 1
1 105 . 9 1 1 A 18 18 ASP N N 18 124.676 124.356 0.320 1
1 106 . 9 1 1 A 19 19 TRP H H 19 6.068 7.458 -1.390 1
1 107 . 9 1 1 A 19 19 TRP HA H 19 5.045 4.751 0.294 1
1 116 . 9 1 1 A 19 19 TRP C C 19 175.902 176.376 -0.474 1
1 117 . 9 1 1 A 19 19 TRP CA C 19 53.542 57.743 -4.201 1
1 118 . 9 1 1 A 19 19 TRP CB C 19 29.179 28.877 0.302 1
1 124 . 9 1 1 A 19 19 TRP N N 19 107.757 116.549 -8.792 1
1 126 . 9 1 1 A 20 20 TYR H H 20 7.430 7.411 0.019 1
1 127 . 9 1 1 A 20 20 TYR HA H 20 5.601 5.136 0.465 1
1 132 . 9 1 1 A 20 20 TYR C C 20 175.498 175.683 -0.185 1
1 133 . 9 1 1 A 20 20 TYR CA C 20 56.967 56.910 0.057 1
1 134 . 9 1 1 A 20 20 TYR CB C 20 39.083 38.471 0.612 1
1 137 . 9 1 1 A 20 20 TYR N N 20 123.173 121.554 1.619 1
1 138 . 9 1 1 A 21 21 HIS H H 21 8.934 8.927 0.007 1
1 139 . 9 1 1 A 21 21 HIS HA H 21 4.295 4.281 0.014 1
1 144 . 9 1 1 A 21 21 HIS C C 21 175.177 175.051 0.126 1
1 145 . 9 1 1 A 21 21 HIS CA C 21 56.572 56.544 0.028 1
1 146 . 9 1 1 A 21 21 HIS CB C 21 33.365 31.499 1.866 1
1 149 . 9 1 1 A 21 21 HIS N N 21 125.732 127.579 -1.847 1
1 150 . 9 1 1 A 22 22 GLY H H 22 5.280 6.694 -1.414 1
1 151 . 9 1 1 A 22 22 GLY HA2 H 22 3.905 3.357 0.548 1
1 152 . 9 1 1 A 22 22 GLY HA3 H 22 3.585 3.682 -0.097 1
1 153 . 9 1 1 A 22 22 GLY C C 22 174.411 173.558 0.853 1
1 154 . 9 1 1 A 22 22 GLY CA C 22 46.402 44.211 2.191 1
1 155 . 9 1 1 A 22 22 GLY N N 22 104.568 106.652 -2.084 1
1 156 . 9 1 1 A 23 23 ALA H H 23 8.768 7.930 0.838 1
1 157 . 9 1 1 A 23 23 ALA HA H 23 5.171 4.597 0.574 1
1 161 . 9 1 1 A 23 23 ALA C C 23 177.180 176.708 0.472 1
1 162 . 9 1 1 A 23 23 ALA CA C 23 51.153 51.452 -0.299 1
1 163 . 9 1 1 A 23 23 ALA CB C 23 16.999 18.224 -1.225 1
1 164 . 9 1 1 A 23 23 ALA N N 23 130.297 123.202 7.095 1
1 165 . 9 1 1 A 24 24 ILE H H 24 7.267 8.246 -0.979 1
1 166 . 9 1 1 A 24 24 ILE HA H 24 4.460 5.041 -0.581 1
1 176 . 9 1 1 A 24 24 ILE CA C 24 58.529 57.289 1.240 1
1 177 . 9 1 1 A 24 24 ILE CB C 24 38.763 39.856 -1.093 1
1 181 . 9 1 1 A 24 24 ILE N N 24 118.903 117.834 1.069 1
1 182 . 9 1 1 A 25 25 PRO HA H 25 4.224 4.555 -0.331 1
1 189 . 9 1 1 A 25 25 PRO C C 25 176.918 177.727 -0.809 1
1 190 . 9 1 1 A 25 25 PRO CA C 25 62.907 62.735 0.172 1
1 191 . 9 1 1 A 25 25 PRO CB C 25 32.671 32.543 0.128 1
1 194 . 9 1 1 A 26 26 ARG H H 26 8.781 9.039 -0.258 1
1 195 . 9 1 1 A 26 26 ARG HA H 26 3.472 3.875 -0.403 1
1 202 . 9 1 1 A 26 26 ARG C C 26 178.112 177.915 0.197 1
1 203 . 9 1 1 A 26 26 ARG CA C 26 60.863 59.303 1.560 1
1 204 . 9 1 1 A 26 26 ARG CB C 26 30.314 29.787 0.527 1
1 207 . 9 1 1 A 26 26 ARG N N 26 124.635 122.365 2.270 1
1 208 . 9 1 1 A 27 27 ILE H H 27 8.540 8.010 0.530 1
1 209 . 9 1 1 A 27 27 ILE HA H 27 3.787 3.591 0.196 1
1 219 . 9 1 1 A 27 27 ILE C C 27 177.390 177.599 -0.209 1
1 220 . 9 1 1 A 27 27 ILE CA C 27 64.329 65.129 -0.800 1
1 221 . 9 1 1 A 27 27 ILE CB C 27 37.413 37.941 -0.528 1
1 225 . 9 1 1 A 27 27 ILE N N 27 115.859 120.331 -4.472 1
1 226 . 9 1 1 A 28 28 GLU H H 28 6.953 8.578 -1.625 1
1 227 . 9 1 1 A 28 28 GLU HA H 28 4.067 4.059 0.008 1
1 232 . 9 1 1 A 28 28 GLU C C 28 179.006 179.322 -0.316 1
1 233 . 9 1 1 A 28 28 GLU CA C 28 58.985 59.638 -0.653 1
1 234 . 9 1 1 A 28 28 GLU CB C 28 29.316 29.113 0.203 1
1 236 . 9 1 1 A 28 28 GLU N N 28 120.554 119.134 1.420 1
1 237 . 9 1 1 A 29 29 ALA H H 29 7.999 7.962 0.037 1
1 238 . 9 1 1 A 29 29 ALA HA H 29 3.822 3.981 -0.159 1
1 242 . 9 1 1 A 29 29 ALA C C 29 178.809 179.857 -1.048 1
1 243 . 9 1 1 A 29 29 ALA CA C 29 54.698 55.308 -0.610 1
1 244 . 9 1 1 A 29 29 ALA CB C 29 18.059 18.246 -0.187 1
1 245 . 9 1 1 A 29 29 ALA N N 29 120.122 122.654 -2.532 1
1 246 . 9 1 1 A 30 30 GLN H H 30 8.168 7.825 0.343 1
1 247 . 9 1 1 A 30 30 GLN HA H 30 3.811 4.159 -0.348 1
1 254 . 9 1 1 A 30 30 GLN C C 30 177.578 178.146 -0.568 1
1 255 . 9 1 1 A 30 30 GLN CA C 30 59.731 58.838 0.893 1
1 256 . 9 1 1 A 30 30 GLN CB C 30 28.161 28.261 -0.100 1
1 258 . 9 1 1 A 30 30 GLN N N 30 112.109 116.373 -4.264 1
1 260 . 9 1 1 A 31 31 GLU H H 31 7.248 8.162 -0.914 1
1 261 . 9 1 1 A 31 31 GLU HA H 31 4.063 4.095 -0.032 1
1 266 . 9 1 1 A 31 31 GLU C C 31 177.423 178.922 -1.499 1
1 267 . 9 1 1 A 31 31 GLU CA C 31 57.650 59.144 -1.494 1
1 268 . 9 1 1 A 31 31 GLU CB C 31 29.757 29.437 0.320 1
1 270 . 9 1 1 A 31 31 GLU N N 31 115.340 119.547 -4.207 1
1 271 . 9 1 1 A 32 32 LEU H H 32 7.169 7.675 -0.506 1
1 272 . 9 1 1 A 32 32 LEU HA H 32 4.087 4.360 -0.273 1
1 282 . 9 1 1 A 32 32 LEU C C 32 175.850 176.895 -1.045 1
1 283 . 9 1 1 A 32 32 LEU CA C 32 55.580 56.005 -0.425 1
1 284 . 9 1 1 A 32 32 LEU CB C 32 42.910 42.078 0.832 1
1 288 . 9 1 1 A 32 32 LEU N N 32 116.367 114.540 1.827 1
1 289 . 9 1 1 A 33 33 LEU H H 33 7.062 7.621 -0.559 1
1 290 . 9 1 1 A 33 33 LEU HA H 33 4.431 4.528 -0.097 1
1 300 . 9 1 1 A 33 33 LEU C C 33 174.837 177.054 -2.217 1
1 301 . 9 1 1 A 33 33 LEU CA C 33 53.521 54.646 -1.125 1
1 302 . 9 1 1 A 33 33 LEU CB C 33 43.301 40.791 2.510 1
1 306 . 9 1 1 A 33 33 LEU N N 33 118.568 122.456 -3.888 1
1 307 . 9 1 1 A 34 34 LYS H H 34 8.749 8.390 0.359 1
1 308 . 9 1 1 A 34 34 LYS HA H 34 4.162 4.393 -0.231 1
1 317 . 9 1 1 A 34 34 LYS C C 34 174.378 175.604 -1.226 1
1 318 . 9 1 1 A 34 34 LYS CA C 34 56.575 56.715 -0.140 1
1 319 . 9 1 1 A 34 34 LYS CB C 34 36.918 33.965 2.953 1
1 323 . 9 1 1 A 34 34 LYS N N 34 121.659 119.581 2.078 1
1 324 . 9 1 1 A 35 35 LYS H H 35 8.137 7.223 0.914 1
1 325 . 9 1 1 A 35 35 LYS HA H 35 4.011 4.614 -0.603 1
1 334 . 9 1 1 A 35 35 LYS C C 35 174.343 175.825 -1.482 1
1 335 . 9 1 1 A 35 35 LYS CA C 35 53.960 54.419 -0.459 1
1 336 . 9 1 1 A 35 35 LYS CB C 35 35.587 35.125 0.462 1
1 340 . 9 1 1 A 35 35 LYS N N 35 119.354 116.185 3.169 1
1 341 . 9 1 1 A 36 36 GLN H H 36 8.394 8.556 -0.162 1
1 342 . 9 1 1 A 36 36 GLN HA H 36 4.187 4.292 -0.105 1
1 349 . 9 1 1 A 36 36 GLN C C 36 177.012 176.762 0.250 1
1 350 . 9 1 1 A 36 36 GLN CA C 36 57.750 57.876 -0.126 1
1 351 . 9 1 1 A 36 36 GLN CB C 36 28.433 28.446 -0.013 1
1 353 . 9 1 1 A 36 36 GLN N N 36 120.248 121.794 -1.546 1
1 355 . 9 1 1 A 37 37 GLY H H 37 9.597 9.373 0.224 1
1 356 . 9 1 1 A 37 37 GLY HA2 H 37 4.486 4.083 0.403 1
1 357 . 9 1 1 A 37 37 GLY HA3 H 37 3.926 4.086 -0.160 1
1 358 . 9 1 1 A 37 37 GLY C C 37 176.285 174.118 2.167 1
1 359 . 9 1 1 A 37 37 GLY CA C 37 46.146 45.187 0.959 1
1 360 . 9 1 1 A 37 37 GLY N N 37 116.637 115.303 1.334 1
1 361 . 9 1 1 A 38 38 ASP H H 38 8.925 7.738 1.187 1
1 362 . 9 1 1 A 38 38 ASP HA H 38 5.697 4.766 0.931 1
1 365 . 9 1 1 A 38 38 ASP C C 38 176.181 175.648 0.533 1
1 366 . 9 1 1 A 38 38 ASP CA C 38 55.066 55.608 -0.542 1
1 367 . 9 1 1 A 38 38 ASP CB C 38 42.933 41.258 1.675 1
1 368 . 9 1 1 A 38 38 ASP N N 38 127.293 122.023 5.270 1
1 369 . 9 1 1 A 39 39 PHE H H 39 8.647 8.548 0.099 1
1 370 . 9 1 1 A 39 39 PHE HA H 39 6.025 5.922 0.103 1
1 378 . 9 1 1 A 39 39 PHE C C 39 170.948 173.031 -2.083 1
1 379 . 9 1 1 A 39 39 PHE CA C 39 56.376 55.971 0.405 1
1 380 . 9 1 1 A 39 39 PHE CB C 39 44.583 43.204 1.379 1
1 386 . 9 1 1 A 39 39 PHE N N 39 117.102 119.703 -2.601 1
1 387 . 9 1 1 A 40 40 LEU H H 40 9.186 9.233 -0.047 1
1 388 . 9 1 1 A 40 40 LEU HA H 40 4.983 5.155 -0.172 1
1 398 . 9 1 1 A 40 40 LEU C C 40 174.787 174.637 0.150 1
1 399 . 9 1 1 A 40 40 LEU CA C 40 54.610 53.786 0.824 1
1 400 . 9 1 1 A 40 40 LEU CB C 40 44.330 45.925 -1.595 1
1 404 . 9 1 1 A 40 40 LEU N N 40 114.388 116.723 -2.335 1
1 405 . 9 1 1 A 41 41 VAL H H 41 9.390 9.214 0.176 1
1 406 . 9 1 1 A 41 41 VAL HA H 41 5.742 5.207 0.535 1
1 414 . 9 1 1 A 41 41 VAL C C 41 172.760 174.954 -2.194 1
1 415 . 9 1 1 A 41 41 VAL CA C 41 60.814 61.416 -0.602 1
1 416 . 9 1 1 A 41 41 VAL CB C 41 34.908 33.733 1.175 1
1 419 . 9 1 1 A 41 41 VAL N N 41 119.873 121.678 -1.805 1
1 420 . 9 1 1 A 42 42 ARG H H 42 9.598 9.306 0.292 1
1 421 . 9 1 1 A 42 42 ARG HA H 42 5.247 5.356 -0.109 1
1 429 . 9 1 1 A 42 42 ARG C C 42 173.379 173.895 -0.516 1
1 430 . 9 1 1 A 42 42 ARG CA C 42 53.202 53.558 -0.356 1
1 431 . 9 1 1 A 42 42 ARG CB C 42 33.507 34.303 -0.796 1
1 434 . 9 1 1 A 42 42 ARG N N 42 124.179 124.744 -0.565 1
1 436 . 9 1 1 A 43 43 GLU H H 43 8.234 8.600 -0.366 1
1 437 . 9 1 1 A 43 43 GLU HA H 43 4.890 4.783 0.107 1
1 442 . 9 1 1 A 43 43 GLU C C 43 176.929 175.820 1.109 1
1 443 . 9 1 1 A 43 43 GLU CA C 43 54.846 54.474 0.372 1
1 444 . 9 1 1 A 43 43 GLU CB C 43 31.599 32.705 -1.106 1
1 446 . 9 1 1 A 43 43 GLU N N 43 124.103 120.741 3.362 1
1 447 . 9 1 1 A 44 44 SER H H 44 9.033 9.112 -0.079 1
1 448 . 9 1 1 A 44 44 SER HA H 44 3.957 4.407 -0.450 1
1 451 . 9 1 1 A 44 44 SER C C 44 175.005 174.285 0.720 1
1 452 . 9 1 1 A 44 44 SER CA C 44 59.393 59.517 -0.124 1
1 453 . 9 1 1 A 44 44 SER CB C 44 63.619 63.441 0.178 1
1 454 . 9 1 1 A 44 44 SER N N 44 124.316 121.494 2.822 1
1 455 . 9 1 1 A 45 45 HIS H H 45 8.461 8.893 -0.432 1
1 456 . 9 1 1 A 45 45 HIS HA H 45 4.132 4.131 0.001 1
1 460 . 9 1 1 A 45 45 HIS C C 45 176.480 178.194 -1.714 1
1 461 . 9 1 1 A 45 45 HIS CA C 45 58.887 58.979 -0.092 1
1 462 . 9 1 1 A 45 45 HIS CB C 45 30.180 29.954 0.226 1
1 464 . 9 1 1 A 45 45 HIS N N 45 127.694 123.100 4.594 1
1 465 . 9 1 1 A 46 46 GLY H H 46 8.513 8.263 0.250 1
1 466 . 9 1 1 A 46 46 GLY HA2 H 46 3.827 3.921 -0.094 1
1 467 . 9 1 1 A 46 46 GLY HA3 H 46 3.827 3.926 -0.099 1
1 468 . 9 1 1 A 46 46 GLY C C 46 173.630 174.485 -0.855 1
1 469 . 9 1 1 A 46 46 GLY CA C 46 45.188 46.768 -1.580 1
1 470 . 9 1 1 A 46 46 GLY N N 46 110.761 106.739 4.022 1
1 471 . 9 1 1 A 47 47 LYS H H 47 7.216 7.795 -0.579 1
1 472 . 9 1 1 A 47 47 LYS HA H 47 4.540 4.774 -0.234 1
1 481 . 9 1 1 A 47 47 LYS CA C 47 53.475 53.058 0.417 1
1 482 . 9 1 1 A 47 47 LYS CB C 47 33.325 34.031 -0.706 1
1 486 . 9 1 1 A 47 47 LYS N N 47 121.356 120.571 0.785 1
1 487 . 9 1 1 A 48 48 PRO HA H 48 4.181 4.210 -0.029 1
1 494 . 9 1 1 A 48 48 PRO C C 48 178.920 177.533 1.387 1
1 495 . 9 1 1 A 48 48 PRO CA C 48 63.239 63.635 -0.396 1
1 496 . 9 1 1 A 48 48 PRO CB C 48 31.523 31.360 0.163 1
1 499 . 9 1 1 A 49 49 GLY H H 49 9.752 8.692 1.060 1
1 500 . 9 1 1 A 49 49 GLY HA2 H 49 4.053 3.848 0.205 1
1 501 . 9 1 1 A 49 49 GLY HA3 H 49 3.374 3.883 -0.509 1
1 502 . 9 1 1 A 49 49 GLY C C 49 172.093 173.867 -1.774 1
1 503 . 9 1 1 A 49 49 GLY CA C 49 45.041 45.218 -0.177 1
1 504 . 9 1 1 A 49 49 GLY N N 49 112.415 112.573 -0.158 1
1 505 . 9 1 1 A 50 50 GLU H H 50 7.623 7.777 -0.154 1
1 506 . 9 1 1 A 50 50 GLU HA H 50 4.537 4.551 -0.014 1
1 511 . 9 1 1 A 50 50 GLU C C 50 173.297 175.031 -1.734 1
1 512 . 9 1 1 A 50 50 GLU CA C 50 55.174 55.711 -0.537 1
1 513 . 9 1 1 A 50 50 GLU CB C 50 31.651 29.867 1.784 1
1 515 . 9 1 1 A 50 50 GLU N N 50 121.600 121.754 -0.154 1
1 516 . 9 1 1 A 51 51 TYR H H 51 9.452 9.069 0.383 1
1 517 . 9 1 1 A 51 51 TYR HA H 51 5.382 5.136 0.246 1
1 524 . 9 1 1 A 51 51 TYR C C 51 174.387 176.430 -2.043 1
1 525 . 9 1 1 A 51 51 TYR CA C 51 57.592 58.809 -1.217 1
1 526 . 9 1 1 A 51 51 TYR CB C 51 41.820 40.167 1.653 1
1 531 . 9 1 1 A 51 51 TYR N N 51 125.790 126.787 -0.997 1
1 532 . 9 1 1 A 52 52 VAL H H 52 9.471 9.196 0.275 1
1 533 . 9 1 1 A 52 52 VAL HA H 52 4.840 5.094 -0.254 1
1 541 . 9 1 1 A 52 52 VAL C C 52 174.947 174.724 0.223 1
1 542 . 9 1 1 A 52 52 VAL CA C 52 60.991 61.142 -0.151 1
1 543 . 9 1 1 A 52 52 VAL CB C 52 36.829 34.997 1.832 1
1 546 . 9 1 1 A 52 52 VAL N N 52 120.617 122.198 -1.581 1
1 547 . 9 1 1 A 53 53 LEU H H 53 9.457 9.293 0.164 1
1 548 . 9 1 1 A 53 53 LEU HA H 53 5.294 5.087 0.207 1
1 558 . 9 1 1 A 53 53 LEU C C 53 175.024 175.675 -0.651 1
1 559 . 9 1 1 A 53 53 LEU CA C 53 53.904 54.839 -0.935 1
1 560 . 9 1 1 A 53 53 LEU CB C 53 44.756 44.327 0.429 1
1 564 . 9 1 1 A 53 53 LEU N N 53 127.725 131.384 -3.659 1
1 565 . 9 1 1 A 54 54 SER H H 54 9.461 9.146 0.315 1
1 566 . 9 1 1 A 54 54 SER HA H 54 5.691 5.538 0.153 1
1 569 . 9 1 1 A 54 54 SER C C 54 172.227 172.873 -0.646 1
1 570 . 9 1 1 A 54 54 SER CA C 54 58.551 56.947 1.604 1
1 571 . 9 1 1 A 54 54 SER CB C 54 65.738 65.166 0.572 1
1 572 . 9 1 1 A 54 54 SER N N 54 127.178 121.523 5.655 1
1 573 . 9 1 1 A 55 55 VAL H H 55 9.049 9.020 0.029 1
1 574 . 9 1 1 A 55 55 VAL HA H 55 5.691 5.303 0.388 1
1 582 . 9 1 1 A 55 55 VAL C C 55 173.959 172.825 1.134 1
1 583 . 9 1 1 A 55 55 VAL CA C 55 58.398 59.831 -1.433 1
1 584 . 9 1 1 A 55 55 VAL CB C 55 36.262 36.016 0.246 1
1 587 . 9 1 1 A 55 55 VAL N N 55 120.619 126.258 -5.639 1
1 588 . 9 1 1 A 56 56 TYR H H 56 8.629 9.234 -0.605 1
1 589 . 9 1 1 A 56 56 TYR HA H 56 4.951 5.388 -0.437 1
1 596 . 9 1 1 A 56 56 TYR C C 56 175.224 174.440 0.784 1
1 597 . 9 1 1 A 56 56 TYR CA C 56 56.684 56.201 0.483 1
1 598 . 9 1 1 A 56 56 TYR CB C 56 39.646 40.370 -0.724 1
1 603 . 9 1 1 A 56 56 TYR N N 56 127.444 129.701 -2.257 1
1 604 . 9 1 1 A 57 57 SER H H 57 8.869 8.918 -0.049 1
1 605 . 9 1 1 A 57 57 SER HA H 57 4.739 4.857 -0.118 1
1 608 . 9 1 1 A 57 57 SER C C 57 174.492 173.447 1.045 1
1 609 . 9 1 1 A 57 57 SER CA C 57 57.591 56.994 0.597 1
1 610 . 9 1 1 A 57 57 SER CB C 57 64.281 66.338 -2.057 1
1 611 . 9 1 1 A 57 57 SER N N 57 122.165 123.046 -0.881 1
1 612 . 9 1 1 A 58 58 ASP H H 58 10.446 9.457 0.989 1
1 613 . 9 1 1 A 58 58 ASP HA H 58 4.382 4.255 0.127 1
1 616 . 9 1 1 A 58 58 ASP C C 58 176.398 175.402 0.996 1
1 617 . 9 1 1 A 58 58 ASP CA C 58 55.215 54.968 0.247 1
1 618 . 9 1 1 A 58 58 ASP CB C 58 39.513 39.649 -0.136 1
1 619 . 9 1 1 A 58 58 ASP N N 58 132.098 127.790 4.308 1
1 620 . 9 1 1 A 59 59 GLY H H 59 7.861 8.546 -0.685 1
1 621 . 9 1 1 A 59 59 GLY HA2 H 59 3.817 3.709 0.108 1
1 622 . 9 1 1 A 59 59 GLY HA3 H 59 4.086 3.823 0.263 1
1 623 . 9 1 1 A 59 59 GLY C C 59 173.111 173.477 -0.366 1
1 624 . 9 1 1 A 59 59 GLY CA C 59 45.486 45.751 -0.265 1
1 625 . 9 1 1 A 59 59 GLY N N 59 102.674 103.693 -1.019 1
1 626 . 9 1 1 A 60 60 GLN H H 60 7.137 7.364 -0.227 1
1 627 . 9 1 1 A 60 60 GLN HA H 60 4.455 4.588 -0.133 1
1 634 . 9 1 1 A 60 60 GLN C C 60 173.549 174.200 -0.651 1
1 635 . 9 1 1 A 60 60 GLN CA C 60 53.388 53.565 -0.177 1
1 636 . 9 1 1 A 60 60 GLN CB C 60 32.373 31.822 0.551 1
1 638 . 9 1 1 A 60 60 GLN N N 60 116.206 118.594 -2.388 1
1 640 . 9 1 1 A 61 61 ARG H H 61 8.589 8.403 0.186 1
1 641 . 9 1 1 A 61 61 ARG HA H 61 4.740 4.620 0.120 1
1 649 . 9 1 1 A 61 61 ARG C C 61 174.458 174.492 -0.034 1
1 650 . 9 1 1 A 61 61 ARG CA C 61 57.116 55.382 1.734 1
1 651 . 9 1 1 A 61 61 ARG CB C 61 29.615 30.668 -1.053 1
1 654 . 9 1 1 A 61 61 ARG N N 61 120.467 122.237 -1.770 1
1 656 . 9 1 1 A 62 62 ARG H H 62 8.867 8.888 -0.021 1
1 657 . 9 1 1 A 62 62 ARG HA H 62 4.297 4.254 0.043 1
1 665 . 9 1 1 A 62 62 ARG C C 62 173.485 175.484 -1.999 1
1 666 . 9 1 1 A 62 62 ARG CA C 62 53.355 55.056 -1.701 1
1 667 . 9 1 1 A 62 62 ARG CB C 62 33.028 30.938 2.090 1
1 670 . 9 1 1 A 62 62 ARG N N 62 122.641 124.660 -2.019 1
1 672 . 9 1 1 A 63 63 HIS H H 63 7.997 8.430 -0.433 1
1 673 . 9 1 1 A 63 63 HIS HA H 63 5.427 5.542 -0.115 1
1 678 . 9 1 1 A 63 63 HIS C C 63 174.946 173.733 1.213 1
1 679 . 9 1 1 A 63 63 HIS CA C 63 54.689 53.640 1.049 1
1 680 . 9 1 1 A 63 63 HIS CB C 63 33.008 32.223 0.785 1
1 683 . 9 1 1 A 63 63 HIS N N 63 119.064 120.600 -1.536 1
1 684 . 9 1 1 A 64 64 PHE H H 64 9.880 9.388 0.492 1
1 685 . 9 1 1 A 64 64 PHE HA H 64 4.824 5.028 -0.204 1
1 693 . 9 1 1 A 64 64 PHE C C 64 174.882 175.191 -0.309 1
1 694 . 9 1 1 A 64 64 PHE CA C 64 56.489 56.608 -0.119 1
1 695 . 9 1 1 A 64 64 PHE CB C 64 41.405 41.188 0.217 1
1 701 . 9 1 1 A 64 64 PHE N N 64 123.961 122.100 1.861 1
1 702 . 9 1 1 A 65 65 ILE H H 65 8.982 9.100 -0.118 1
1 703 . 9 1 1 A 65 65 ILE HA H 65 4.273 4.598 -0.325 1
1 713 . 9 1 1 A 65 65 ILE C C 65 176.556 175.977 0.579 1
1 714 . 9 1 1 A 65 65 ILE CA C 65 62.649 60.868 1.781 1
1 715 . 9 1 1 A 65 65 ILE CB C 65 38.296 38.276 0.020 1
1 719 . 9 1 1 A 65 65 ILE N N 65 126.601 123.985 2.616 1
1 720 . 9 1 1 A 66 66 ILE H H 66 8.947 8.832 0.115 1
1 721 . 9 1 1 A 66 66 ILE HA H 66 3.780 4.419 -0.639 1
1 731 . 9 1 1 A 66 66 ILE C C 66 175.721 175.385 0.336 1
1 732 . 9 1 1 A 66 66 ILE CA C 66 62.960 61.213 1.747 1
1 733 . 9 1 1 A 66 66 ILE CB C 66 37.209 38.228 -1.019 1
1 737 . 9 1 1 A 66 66 ILE N N 66 130.139 129.492 0.647 1
1 738 . 9 1 1 A 67 67 GLN H H 67 8.410 8.852 -0.442 1
1 739 . 9 1 1 A 67 67 GLN HA H 67 4.422 4.854 -0.432 1
1 746 . 9 1 1 A 67 67 GLN C C 67 174.347 174.122 0.225 1
1 747 . 9 1 1 A 67 67 GLN CA C 67 55.867 55.611 0.256 1
1 748 . 9 1 1 A 67 67 GLN CB C 67 29.950 29.645 0.305 1
1 750 . 9 1 1 A 67 67 GLN N N 67 128.872 127.515 1.357 1
1 752 . 9 1 1 A 68 68 TYR H H 68 8.619 9.056 -0.437 1
1 753 . 9 1 1 A 68 68 TYR HA H 68 5.300 4.643 0.657 1
1 760 . 9 1 1 A 68 68 TYR C C 68 174.695 174.373 0.322 1
1 761 . 9 1 1 A 68 68 TYR CA C 68 55.579 56.755 -1.176 1
1 762 . 9 1 1 A 68 68 TYR CB C 68 39.479 38.529 0.950 1
1 767 . 9 1 1 A 68 68 TYR N N 68 124.772 126.552 -1.780 1
1 768 . 9 1 1 A 69 69 VAL H H 69 8.539 8.726 -0.187 1
1 769 . 9 1 1 A 69 69 VAL HA H 69 4.046 4.318 -0.272 1
1 777 . 9 1 1 A 69 69 VAL C C 69 175.010 175.393 -0.383 1
1 778 . 9 1 1 A 69 69 VAL CA C 69 60.611 60.986 -0.375 1
1 779 . 9 1 1 A 69 69 VAL CB C 69 35.358 34.176 1.182 1
1 782 . 9 1 1 A 69 69 VAL N N 69 126.652 128.031 -1.379 1
1 783 . 9 1 1 A 70 70 ASP H H 70 9.089 9.326 -0.237 1
1 784 . 9 1 1 A 70 70 ASP HA H 70 4.025 4.132 -0.107 1
1 787 . 9 1 1 A 70 70 ASP C C 70 174.813 174.986 -0.173 1
1 788 . 9 1 1 A 70 70 ASP CA C 70 55.623 55.564 0.059 1
1 789 . 9 1 1 A 70 70 ASP CB C 70 39.081 38.880 0.201 1
1 790 . 9 1 1 A 70 70 ASP N N 70 128.327 129.282 -0.955 1
1 791 . 9 1 1 A 71 71 ASN H H 71 8.128 8.056 0.072 1
1 792 . 9 1 1 A 71 71 ASN HA H 71 3.597 3.816 -0.219 1
1 797 . 9 1 1 A 71 71 ASN C C 71 173.250 173.741 -0.491 1
1 798 . 9 1 1 A 71 71 ASN CA C 71 54.728 54.340 0.388 1
1 799 . 9 1 1 A 71 71 ASN CB C 71 37.601 37.221 0.380 1
1 800 . 9 1 1 A 71 71 ASN N N 71 107.230 107.491 -0.261 1
1 802 . 9 1 1 A 72 72 MET H H 72 7.256 7.401 -0.145 1
1 803 . 9 1 1 A 72 72 MET HA H 72 4.740 4.749 -0.009 1
1 808 . 9 1 1 A 72 72 MET C C 72 173.780 174.474 -0.694 1
1 809 . 9 1 1 A 72 72 MET CA C 72 53.703 53.990 -0.287 1
1 810 . 9 1 1 A 72 72 MET CB C 72 36.570 35.360 1.210 1
1 812 . 9 1 1 A 72 72 MET N N 72 117.117 117.074 0.043 1
1 813 . 9 1 1 A 73 73 TYR H H 73 9.430 9.122 0.308 1
1 814 . 9 1 1 A 73 73 TYR HA H 73 5.718 4.995 0.723 1
1 821 . 9 1 1 A 73 73 TYR C C 73 176.140 175.882 0.258 1
1 822 . 9 1 1 A 73 73 TYR CA C 73 57.290 58.006 -0.716 1
1 823 . 9 1 1 A 73 73 TYR CB C 73 40.013 39.075 0.938 1
1 828 . 9 1 1 A 73 73 TYR N N 73 119.856 122.682 -2.826 1
1 829 . 9 1 1 A 74 74 ARG H H 74 9.038 8.756 0.282 1
1 830 . 9 1 1 A 74 74 ARG HA H 74 4.867 4.817 0.050 1
1 838 . 9 1 1 A 74 74 ARG C C 74 173.954 175.735 -1.781 1
1 839 . 9 1 1 A 74 74 ARG CA C 74 54.887 54.366 0.521 1
1 840 . 9 1 1 A 74 74 ARG CB C 74 34.484 33.530 0.954 1
1 843 . 9 1 1 A 74 74 ARG N N 74 117.344 120.129 -2.785 1
1 845 . 9 1 1 A 75 75 PHE H H 75 9.005 8.838 0.167 1
1 846 . 9 1 1 A 75 75 PHE HA H 75 5.046 4.531 0.515 1
1 854 . 9 1 1 A 75 75 PHE C C 75 176.186 175.561 0.625 1
1 855 . 9 1 1 A 75 75 PHE CA C 75 59.658 59.265 0.393 1
1 856 . 9 1 1 A 75 75 PHE CB C 75 39.356 40.287 -0.931 1
1 862 . 9 1 1 A 75 75 PHE N N 75 117.865 121.248 -3.383 1
1 863 . 9 1 1 A 76 76 GLU H H 76 8.213 8.167 0.046 1
1 864 . 9 1 1 A 76 76 GLU HA H 76 4.586 4.726 -0.140 1
1 869 . 9 1 1 A 76 76 GLU C C 76 175.238 177.448 -2.210 1
1 870 . 9 1 1 A 76 76 GLU CA C 76 55.994 57.885 -1.891 1
1 871 . 9 1 1 A 76 76 GLU CB C 76 31.805 31.048 0.757 1
1 873 . 9 1 1 A 76 76 GLU N N 76 116.834 118.035 -1.201 1
1 874 . 9 1 1 A 77 77 GLY H H 77 8.692 7.904 0.788 1
1 875 . 9 1 1 A 77 77 GLY HA2 H 77 4.166 3.846 0.320 1
1 876 . 9 1 1 A 77 77 GLY HA3 H 77 4.015 3.856 0.159 1
1 877 . 9 1 1 A 77 77 GLY C C 77 173.784 173.937 -0.153 1
1 878 . 9 1 1 A 77 77 GLY CA C 77 45.505 46.686 -1.181 1
1 879 . 9 1 1 A 77 77 GLY N N 77 111.937 107.553 4.384 1
1 880 . 9 1 1 A 78 78 THR H H 78 8.332 7.927 0.405 1
1 881 . 9 1 1 A 78 78 THR HA H 78 3.900 4.245 -0.345 1
1 886 . 9 1 1 A 78 78 THR C C 78 173.591 173.921 -0.330 1
1 887 . 9 1 1 A 78 78 THR CA C 78 63.653 62.677 0.976 1
1 888 . 9 1 1 A 78 78 THR CB C 78 69.649 69.430 0.219 1
1 890 . 9 1 1 A 78 78 THR N N 78 120.765 114.876 5.889 1
1 891 . 9 1 1 A 79 79 GLY H H 79 8.038 8.361 -0.323 1
1 892 . 9 1 1 A 79 79 GLY HA2 H 79 4.748 4.324 0.424 1
1 893 . 9 1 1 A 79 79 GLY HA3 H 79 3.546 4.441 -0.895 1
1 894 . 9 1 1 A 79 79 GLY C C 79 172.580 171.812 0.768 1
1 895 . 9 1 1 A 79 79 GLY CA C 79 44.661 45.309 -0.648 1
1 896 . 9 1 1 A 79 79 GLY N N 79 109.887 113.701 -3.814 1
1 897 . 9 1 1 A 80 80 PHE H H 80 9.064 8.578 0.486 1
1 898 . 9 1 1 A 80 80 PHE HA H 80 4.886 4.926 -0.040 1
1 906 . 9 1 1 A 80 80 PHE C C 80 176.507 175.909 0.598 1
1 907 . 9 1 1 A 80 80 PHE CA C 80 57.257 56.706 0.551 1
1 908 . 9 1 1 A 80 80 PHE CB C 80 44.655 42.705 1.950 1
1 914 . 9 1 1 A 80 80 PHE N N 80 116.862 120.075 -3.213 1
1 915 . 9 1 1 A 81 81 SER H H 81 9.413 9.031 0.382 1
1 916 . 9 1 1 A 81 81 SER HA H 81 4.622 4.562 0.060 1
1 919 . 9 1 1 A 81 81 SER C C 81 173.735 173.987 -0.252 1
1 920 . 9 1 1 A 81 81 SER CA C 81 61.410 60.825 0.585 1
1 921 . 9 1 1 A 81 81 SER CB C 81 64.165 63.201 0.964 1
1 922 . 9 1 1 A 81 81 SER N N 81 116.467 117.517 -1.050 1
1 923 . 9 1 1 A 82 82 ASN H H 82 7.688 8.194 -0.506 1
1 924 . 9 1 1 A 82 82 ASN HA H 82 4.952 5.186 -0.234 1
1 929 . 9 1 1 A 82 82 ASN C C 82 173.303 175.794 -2.491 1
1 930 . 9 1 1 A 82 82 ASN CA C 82 52.086 52.279 -0.193 1
1 931 . 9 1 1 A 82 82 ASN CB C 82 41.258 40.719 0.539 1
1 932 . 9 1 1 A 82 82 ASN N N 82 113.355 116.452 -3.097 1
1 934 . 9 1 1 A 83 83 ILE H H 83 8.858 8.690 0.168 1
1 935 . 9 1 1 A 83 83 ILE HA H 83 3.571 3.708 -0.137 1
1 945 . 9 1 1 A 83 83 ILE CA C 83 66.416 65.483 0.933 1
1 946 . 9 1 1 A 83 83 ILE CB C 83 35.074 34.800 0.274 1
1 950 . 9 1 1 A 83 83 ILE N N 83 118.908 123.857 -4.949 1
1 951 . 9 1 1 A 84 84 PRO HA H 84 4.411 4.677 -0.266 1
1 958 . 9 1 1 A 84 84 PRO C C 84 177.616 179.061 -1.445 1
1 959 . 9 1 1 A 84 84 PRO CA C 84 67.525 66.351 1.174 1
1 960 . 9 1 1 A 84 84 PRO CB C 84 31.029 30.799 0.230 1
1 963 . 9 1 1 A 85 85 GLN H H 85 8.405 8.318 0.087 1
1 964 . 9 1 1 A 85 85 GLN HA H 85 3.874 3.982 -0.108 1
1 971 . 9 1 1 A 85 85 GLN C C 85 178.213 178.292 -0.079 1
1 972 . 9 1 1 A 85 85 GLN CA C 85 59.495 58.436 1.059 1
1 973 . 9 1 1 A 85 85 GLN CB C 85 29.270 27.993 1.277 1
1 975 . 9 1 1 A 85 85 GLN N N 85 115.597 117.346 -1.749 1
1 977 . 9 1 1 A 86 86 LEU H H 86 7.136 7.966 -0.830 1
1 978 . 9 1 1 A 86 86 LEU HA H 86 3.589 3.935 -0.346 1
1 988 . 9 1 1 A 86 86 LEU C C 86 177.728 178.573 -0.845 1
1 989 . 9 1 1 A 86 86 LEU CA C 86 58.136 58.366 -0.230 1
1 990 . 9 1 1 A 86 86 LEU CB C 86 42.290 41.812 0.478 1
1 994 . 9 1 1 A 86 86 LEU N N 86 121.840 122.010 -0.170 1
1 995 . 9 1 1 A 87 87 ILE H H 87 8.323 7.934 0.389 1
1 996 . 9 1 1 A 87 87 ILE HA H 87 3.415 3.371 0.044 1
1 1006 . 9 1 1 A 87 87 ILE C C 87 178.064 177.848 0.216 1
1 1007 . 9 1 1 A 87 87 ILE CA C 87 61.458 65.569 -4.111 1
1 1008 . 9 1 1 A 87 87 ILE CB C 87 34.561 37.649 -3.088 1
1 1012 . 9 1 1 A 87 87 ILE N N 87 118.117 119.601 -1.484 1
1 1013 . 9 1 1 A 88 88 ASP H H 88 8.805 8.321 0.484 1
1 1014 . 9 1 1 A 88 88 ASP HA H 88 4.548 4.198 0.350 1
1 1017 . 9 1 1 A 88 88 ASP C C 88 179.265 178.238 1.027 1
1 1018 . 9 1 1 A 88 88 ASP CA C 88 58.099 57.235 0.864 1
1 1019 . 9 1 1 A 88 88 ASP CB C 88 42.166 41.849 0.317 1
1 1020 . 9 1 1 A 88 88 ASP N N 88 119.143 120.393 -1.250 1
1 1021 . 9 1 1 A 89 89 HIS H H 89 8.113 8.019 0.094 1
1 1022 . 9 1 1 A 89 89 HIS HA H 89 4.225 4.238 -0.013 1
1 1026 . 9 1 1 A 89 89 HIS C C 89 179.261 176.919 2.342 1
1 1027 . 9 1 1 A 89 89 HIS CA C 89 60.647 59.007 1.640 1
1 1028 . 9 1 1 A 89 89 HIS CB C 89 30.801 29.342 1.459 1
1 1030 . 9 1 1 A 89 89 HIS N N 89 119.595 119.142 0.453 1
1 1031 . 9 1 1 A 90 90 HIS H H 90 7.685 7.851 -0.166 1
1 1032 . 9 1 1 A 90 90 HIS HA H 90 3.628 4.243 -0.615 1
1 1036 . 9 1 1 A 90 90 HIS C C 90 178.454 177.643 0.811 1
1 1037 . 9 1 1 A 90 90 HIS CA C 90 61.797 59.325 2.472 1
1 1038 . 9 1 1 A 90 90 HIS CB C 90 28.165 30.532 -2.367 1
1 1040 . 9 1 1 A 90 90 HIS N N 90 120.061 116.033 4.028 1
1 1041 . 9 1 1 A 91 91 TYR H H 91 9.394 8.179 1.215 1
1 1042 . 9 1 1 A 91 91 TYR HA H 91 4.238 3.898 0.340 1
1 1049 . 9 1 1 A 91 91 TYR C C 91 176.443 177.723 -1.280 1
1 1050 . 9 1 1 A 91 91 TYR CA C 91 60.669 61.659 -0.990 1
1 1051 . 9 1 1 A 91 91 TYR CB C 91 39.169 39.025 0.144 1
1 1056 . 9 1 1 A 91 91 TYR N N 91 123.532 120.094 3.438 1
1 1057 . 9 1 1 A 92 92 THR H H 92 8.774 8.508 0.266 1
1 1058 . 9 1 1 A 92 92 THR HA H 92 3.866 4.121 -0.255 1
1 1063 . 9 1 1 A 92 92 THR C C 92 177.050 176.501 0.549 1
1 1064 . 9 1 1 A 92 92 THR CA C 92 65.240 65.412 -0.172 1
1 1065 . 9 1 1 A 92 92 THR CB C 92 69.298 67.800 1.498 1
1 1067 . 9 1 1 A 92 92 THR N N 92 112.000 113.433 -1.433 1
1 1068 . 9 1 1 A 93 93 THR H H 93 7.617 7.501 0.116 1
1 1069 . 9 1 1 A 93 93 THR HA H 93 4.133 4.090 0.043 1
1 1074 . 9 1 1 A 93 93 THR C C 93 176.234 175.055 1.179 1
1 1075 . 9 1 1 A 93 93 THR CA C 93 63.527 63.035 0.492 1
1 1076 . 9 1 1 A 93 93 THR CB C 93 71.234 69.854 1.380 1
1 1078 . 9 1 1 A 93 93 THR N N 93 109.883 112.918 -3.035 1
1 1079 . 9 1 1 A 94 94 LYS H H 94 7.210 7.840 -0.630 1
1 1080 . 9 1 1 A 94 94 LYS HA H 94 3.830 3.781 0.049 1
1 1089 . 9 1 1 A 94 94 LYS C C 94 174.331 176.078 -1.747 1
1 1090 . 9 1 1 A 94 94 LYS CA C 94 56.776 57.383 -0.607 1
1 1091 . 9 1 1 A 94 94 LYS CB C 94 28.095 30.979 -2.884 1
1 1095 . 9 1 1 A 94 94 LYS N N 94 112.818 121.332 -8.514 1
1 1096 . 9 1 1 A 95 95 GLN H H 95 7.439 7.439 0.000 1
1 1097 . 9 1 1 A 95 95 GLN HA H 95 4.216 4.586 -0.370 1
1 1104 . 9 1 1 A 95 95 GLN C C 95 179.087 175.747 3.340 1
1 1105 . 9 1 1 A 95 95 GLN CA C 95 56.378 55.054 1.324 1
1 1106 . 9 1 1 A 95 95 GLN CB C 95 28.542 30.168 -1.626 1
1 1108 . 9 1 1 A 95 95 GLN N N 95 117.860 119.517 -1.657 1
1 1110 . 9 1 1 A 96 96 VAL H H 96 8.520 8.552 -0.032 1
1 1111 . 9 1 1 A 96 96 VAL HA H 96 4.297 4.387 -0.090 1
1 1119 . 9 1 1 A 96 96 VAL C C 96 177.329 176.069 1.260 1
1 1120 . 9 1 1 A 96 96 VAL CA C 96 61.196 61.859 -0.663 1
1 1121 . 9 1 1 A 96 96 VAL CB C 96 32.735 33.282 -0.547 1
1 1124 . 9 1 1 A 96 96 VAL N N 96 124.208 122.148 2.060 1
1 1125 . 9 1 1 A 97 97 ILE H H 97 8.491 8.617 -0.126 1
1 1126 . 9 1 1 A 97 97 ILE HA H 97 2.995 3.828 -0.833 1
1 1136 . 9 1 1 A 97 97 ILE CA C 97 62.066 62.613 -0.547 1
1 1137 . 9 1 1 A 97 97 ILE CB C 97 36.117 37.447 -1.330 1
1 1141 . 9 1 1 A 97 97 ILE N N 97 119.561 122.911 -3.350 1
1 1142 . 9 1 1 A 98 98 THR HA H 98 4.460 4.666 -0.206 1
1 1147 . 9 1 1 A 98 98 THR C C 98 174.335 174.813 -0.478 1
1 1148 . 9 1 1 A 98 98 THR CA C 98 58.244 59.314 -1.070 1
1 1149 . 9 1 1 A 98 98 THR CB C 98 73.056 72.040 1.016 1
1 1151 . 9 1 1 A 99 99 LYS H H 99 9.761 8.993 0.768 1
1 1152 . 9 1 1 A 99 99 LYS HA H 99 3.911 4.103 -0.192 1
1 1161 . 9 1 1 A 99 99 LYS C C 99 179.594 178.225 1.369 1
1 1162 . 9 1 1 A 99 99 LYS CA C 99 59.661 58.407 1.254 1
1 1163 . 9 1 1 A 99 99 LYS CB C 99 31.978 32.102 -0.124 1
1 1167 . 9 1 1 A 99 99 LYS N N 99 125.750 121.984 3.766 1
1 1168 . 9 1 1 A 100 100 LYS H H 100 8.910 7.872 1.038 1
1 1169 . 9 1 1 A 100 100 LYS HA H 100 4.024 4.238 -0.214 1
1 1178 . 9 1 1 A 100 100 LYS C C 100 178.060 177.199 0.861 1
1 1179 . 9 1 1 A 100 100 LYS CA C 100 58.642 58.571 0.071 1
1 1180 . 9 1 1 A 100 100 LYS CB C 100 32.750 32.590 0.160 1
1 1184 . 9 1 1 A 100 100 LYS N N 100 117.112 119.170 -2.058 1
1 1185 . 9 1 1 A 101 101 SER H H 101 7.721 7.602 0.119 1
1 1186 . 9 1 1 A 101 101 SER HA H 101 4.282 4.663 -0.381 1
1 1189 . 9 1 1 A 101 101 SER C C 101 176.403 175.431 0.972 1
1 1190 . 9 1 1 A 101 101 SER CA C 101 60.442 59.200 1.242 1
1 1191 . 9 1 1 A 101 101 SER CB C 101 63.775 65.539 -1.764 1
1 1192 . 9 1 1 A 101 101 SER N N 101 112.069 110.976 1.093 1
1 1193 . 9 1 1 A 102 102 GLY H H 102 8.038 8.649 -0.611 1
1 1194 . 9 1 1 A 102 102 GLY HA2 H 102 4.024 3.899 0.125 1
1 1195 . 9 1 1 A 102 102 GLY HA3 H 102 3.713 3.914 -0.201 1
1 1196 . 9 1 1 A 102 102 GLY C C 102 173.991 174.894 -0.903 1
1 1197 . 9 1 1 A 102 102 GLY CA C 102 46.458 46.047 0.411 1
1 1198 . 9 1 1 A 102 102 GLY N N 102 111.144 109.612 1.532 1
1 1199 . 9 1 1 A 103 103 VAL H H 103 7.155 8.070 -0.915 1
1 1200 . 9 1 1 A 103 103 VAL HA H 103 3.652 4.101 -0.449 1
1 1208 . 9 1 1 A 103 103 VAL C C 103 173.805 175.248 -1.443 1
1 1209 . 9 1 1 A 103 103 VAL CA C 103 64.310 62.219 2.091 1
1 1210 . 9 1 1 A 103 103 VAL CB C 103 32.254 32.492 -0.238 1
1 1213 . 9 1 1 A 103 103 VAL N N 103 119.836 121.463 -1.627 1
1 1214 . 9 1 1 A 104 104 VAL H H 104 7.653 8.942 -1.289 1
1 1215 . 9 1 1 A 104 104 VAL HA H 104 4.048 4.675 -0.627 1
1 1223 . 9 1 1 A 104 104 VAL C C 104 175.708 174.124 1.584 1
1 1224 . 9 1 1 A 104 104 VAL CA C 104 60.275 60.454 -0.179 1
1 1225 . 9 1 1 A 104 104 VAL CB C 104 35.112 35.196 -0.084 1
1 1228 . 9 1 1 A 104 104 VAL N N 104 125.859 127.130 -1.271 1
1 1229 . 9 1 1 A 105 105 LEU H H 105 8.616 8.371 0.245 1
1 1230 . 9 1 1 A 105 105 LEU HA H 105 3.905 4.737 -0.832 1
1 1240 . 9 1 1 A 105 105 LEU C C 105 175.380 175.547 -0.167 1
1 1241 . 9 1 1 A 105 105 LEU CA C 105 54.471 53.267 1.204 1
1 1242 . 9 1 1 A 105 105 LEU CB C 105 39.821 41.746 -1.925 1
1 1246 . 9 1 1 A 105 105 LEU N N 105 123.839 125.901 -2.062 1
1 1247 . 9 1 1 A 106 106 LEU H H 106 8.894 8.581 0.313 1
1 1248 . 9 1 1 A 106 106 LEU HA H 106 4.839 4.590 0.249 1
1 1258 . 9 1 1 A 106 106 LEU C C 106 176.930 176.324 0.606 1
1 1259 . 9 1 1 A 106 106 LEU CA C 106 56.288 53.102 3.186 1
1 1260 . 9 1 1 A 106 106 LEU CB C 106 45.237 45.384 -0.147 1
1 1264 . 9 1 1 A 106 106 LEU N N 106 120.590 121.283 -0.693 1
1 1265 . 9 1 1 A 107 107 ASN H H 107 8.124 9.078 -0.954 1
1 1266 . 9 1 1 A 107 107 ASN HA H 107 5.650 4.686 0.964 1
1 1271 . 9 1 1 A 107 107 ASN CA C 107 50.293 53.999 -3.706 1
1 1272 . 9 1 1 A 107 107 ASN CB C 107 41.223 36.184 5.039 1
1 1273 . 9 1 1 A 107 107 ASN N N 107 116.866 119.264 -2.398 1
1 1275 . 9 1 1 A 108 108 PRO HA H 108 2.926 3.909 -0.983 1
1 1282 . 9 1 1 A 108 108 PRO C C 108 176.671 176.055 0.616 1
1 1283 . 9 1 1 A 108 108 PRO CA C 108 60.804 62.224 -1.420 1
1 1284 . 9 1 1 A 108 108 PRO CB C 108 31.774 32.305 -0.531 1
1 1287 . 9 1 1 A 109 109 ILE H H 109 8.648 7.884 0.764 1
1 1288 . 9 1 1 A 109 109 ILE HA H 109 4.519 4.542 -0.023 1
1 1298 . 9 1 1 A 109 109 ILE CA C 109 55.070 58.526 -3.456 1
1 1299 . 9 1 1 A 109 109 ILE CB C 109 36.068 37.981 -1.913 1
1 1303 . 9 1 1 A 109 109 ILE N N 109 128.817 122.312 6.505 1
1 1304 . 9 1 1 A 110 110 PRO HA H 110 4.587 4.700 -0.113 1
1 1311 . 9 1 1 A 110 110 PRO C C 110 177.013 176.186 0.827 1
1 1312 . 9 1 1 A 110 110 PRO CA C 110 61.850 62.234 -0.384 1
1 1313 . 9 1 1 A 110 110 PRO CB C 110 32.507 33.090 -0.583 1
1 1316 . 9 1 1 A 111 111 LYS H H 111 8.038 8.381 -0.343 1
1 1317 . 9 1 1 A 111 111 LYS HA H 111 3.553 5.028 -1.475 1
1 1326 . 9 1 1 A 111 111 LYS C C 111 176.123 175.123 1.000 1
1 1327 . 9 1 1 A 111 111 LYS CA C 111 56.220 54.476 1.744 1
1 1328 . 9 1 1 A 111 111 LYS CB C 111 32.373 35.698 -3.325 1
1 1332 . 9 1 1 A 111 111 LYS N N 111 120.147 117.040 3.107 1
1 1333 . 9 1 1 A 112 112 ASP H H 112 8.463 8.570 -0.107 1
1 1334 . 9 1 1 A 112 112 ASP HA H 112 4.523 4.835 -0.312 1
1 1337 . 9 1 1 A 112 112 ASP C C 112 175.986 177.350 -1.364 1
1 1338 . 9 1 1 A 112 112 ASP CA C 112 54.256 52.619 1.637 1
1 1339 . 9 1 1 A 112 112 ASP CB C 112 41.563 41.295 0.268 1
1 1340 . 9 1 1 A 112 112 ASP N N 112 121.863 121.124 0.739 1
1 1341 . 9 1 1 A 113 113 LYS H H 113 8.059 8.426 -0.367 1
1 1342 . 9 1 1 A 113 113 LYS HA H 113 4.136 4.381 -0.245 1
1 1351 . 9 1 1 A 113 113 LYS C C 113 176.010 176.780 -0.770 1
1 1352 . 9 1 1 A 113 113 LYS CA C 113 56.253 56.978 -0.725 1
1 1353 . 9 1 1 A 113 113 LYS CB C 113 32.754 33.217 -0.463 1
1 1357 . 9 1 1 A 113 113 LYS N N 113 121.725 116.927 4.798 1
1 1358 . 9 1 1 A 114 114 LYS H H 114 8.225 7.486 0.739 1
1 1359 . 9 1 1 A 114 114 LYS HA H 114 4.169 4.491 -0.322 1
1 1368 . 9 1 1 A 114 114 LYS C C 114 176.198 177.128 -0.930 1
1 1369 . 9 1 1 A 114 114 LYS CA C 114 56.413 54.677 1.736 1
1 1370 . 9 1 1 A 114 114 LYS CB C 114 32.725 30.573 2.152 1
1 1374 . 9 1 1 A 114 114 LYS N N 114 121.857 119.668 2.189 1
1 1375 . 9 1 1 A 115 115 TRP H H 115 8.078 7.797 0.281 1
1 1376 . 9 1 1 A 115 115 TRP HA H 115 4.709 4.678 0.031 1
1 1385 . 9 1 1 A 115 115 TRP C C 115 175.119 177.562 -2.443 1
1 1386 . 9 1 1 A 115 115 TRP CA C 115 56.856 57.437 -0.581 1
1 1387 . 9 1 1 A 115 115 TRP CB C 115 29.474 29.427 0.047 1
1 1393 . 9 1 1 A 115 115 TRP N N 115 122.068 122.347 -0.279 1
1 1 . 10 1 1 A 10 10 HIS HA H 10 4.616 4.969 -0.353 1
1 4 . 10 1 1 A 10 10 HIS C C 10 174.981 173.715 1.266 1
1 5 . 10 1 1 A 10 10 HIS CA C 10 56.555 54.372 2.183 1
1 6 . 10 1 1 A 10 10 HIS CB C 10 30.231 31.188 -0.957 1
1 7 . 10 1 1 A 11 11 MET H H 11 8.103 9.228 -1.125 1
1 8 . 10 1 1 A 11 11 MET HA H 11 4.439 4.671 -0.232 1
1 13 . 10 1 1 A 11 11 MET C C 11 175.888 175.916 -0.028 1
1 14 . 10 1 1 A 11 11 MET CA C 11 55.090 54.592 0.498 1
1 15 . 10 1 1 A 11 11 MET CB C 11 33.121 33.616 -0.495 1
1 17 . 10 1 1 A 11 11 MET N N 11 120.743 124.685 -3.942 1
1 18 . 10 1 1 A 12 12 LYS H H 12 8.065 8.528 -0.463 1
1 19 . 10 1 1 A 12 12 LYS HA H 12 4.407 4.700 -0.293 1
1 28 . 10 1 1 A 12 12 LYS CA C 12 54.894 53.840 1.054 1
1 29 . 10 1 1 A 12 12 LYS CB C 12 31.863 31.754 0.109 1
1 33 . 10 1 1 A 12 12 LYS N N 12 123.187 124.714 -1.527 1
1 34 . 10 1 1 A 13 13 PRO HA H 13 4.347 4.439 -0.092 1
1 41 . 10 1 1 A 13 13 PRO C C 13 176.891 177.609 -0.718 1
1 42 . 10 1 1 A 13 13 PRO CA C 13 62.542 62.448 0.094 1
1 43 . 10 1 1 A 13 13 PRO CB C 13 32.663 32.507 0.156 1
1 46 . 10 1 1 A 14 14 LEU H H 14 8.339 8.738 -0.399 1
1 47 . 10 1 1 A 14 14 LEU HA H 14 3.373 3.849 -0.476 1
1 57 . 10 1 1 A 14 14 LEU C C 14 176.683 178.059 -1.376 1
1 58 . 10 1 1 A 14 14 LEU CA C 14 58.555 57.649 0.906 1
1 59 . 10 1 1 A 14 14 LEU CB C 14 41.828 41.138 0.690 1
1 63 . 10 1 1 A 14 14 LEU N N 14 123.191 124.099 -0.908 1
1 64 . 10 1 1 A 15 15 ALA H H 15 8.175 7.862 0.313 1
1 65 . 10 1 1 A 15 15 ALA HA H 15 3.983 3.956 0.027 1
1 69 . 10 1 1 A 15 15 ALA C C 15 178.697 178.980 -0.283 1
1 70 . 10 1 1 A 15 15 ALA CA C 15 54.164 54.925 -0.761 1
1 71 . 10 1 1 A 15 15 ALA CB C 15 18.771 18.255 0.516 1
1 72 . 10 1 1 A 15 15 ALA N N 15 113.594 119.977 -6.383 1
1 73 . 10 1 1 A 16 16 GLU H H 16 7.458 7.596 -0.138 1
1 74 . 10 1 1 A 16 16 GLU HA H 16 4.266 4.303 -0.037 1
1 79 . 10 1 1 A 16 16 GLU C C 16 176.510 176.477 0.033 1
1 80 . 10 1 1 A 16 16 GLU CA C 16 55.196 56.474 -1.278 1
1 81 . 10 1 1 A 16 16 GLU CB C 16 30.907 29.999 0.908 1
1 83 . 10 1 1 A 16 16 GLU N N 16 113.348 114.636 -1.288 1
1 84 . 10 1 1 A 17 17 GLN H H 17 7.501 6.956 0.545 1
1 85 . 10 1 1 A 17 17 GLN HA H 17 3.683 3.998 -0.315 1
1 92 . 10 1 1 A 17 17 GLN C C 17 178.053 176.258 1.795 1
1 93 . 10 1 1 A 17 17 GLN CA C 17 54.606 55.353 -0.747 1
1 94 . 10 1 1 A 17 17 GLN CB C 17 25.758 28.179 -2.421 1
1 96 . 10 1 1 A 17 17 GLN N N 17 119.411 119.765 -0.354 1
1 98 . 10 1 1 A 18 18 ASP H H 18 8.949 8.643 0.306 1
1 99 . 10 1 1 A 18 18 ASP HA H 18 4.184 4.123 0.061 1
1 102 . 10 1 1 A 18 18 ASP C C 18 175.263 176.947 -1.684 1
1 103 . 10 1 1 A 18 18 ASP CA C 18 57.275 56.437 0.838 1
1 104 . 10 1 1 A 18 18 ASP CB C 18 40.620 39.983 0.637 1
1 105 . 10 1 1 A 18 18 ASP N N 18 124.676 123.949 0.727 1
1 106 . 10 1 1 A 19 19 TRP H H 19 6.068 7.118 -1.050 1
1 107 . 10 1 1 A 19 19 TRP HA H 19 5.045 4.643 0.402 1
1 116 . 10 1 1 A 19 19 TRP C C 19 175.902 176.161 -0.259 1
1 117 . 10 1 1 A 19 19 TRP CA C 19 53.542 57.330 -3.788 1
1 118 . 10 1 1 A 19 19 TRP CB C 19 29.179 29.228 -0.049 1
1 124 . 10 1 1 A 19 19 TRP N N 19 107.757 116.670 -8.913 1
1 126 . 10 1 1 A 20 20 TYR H H 20 7.430 7.396 0.034 1
1 127 . 10 1 1 A 20 20 TYR HA H 20 5.601 5.309 0.292 1
1 132 . 10 1 1 A 20 20 TYR C C 20 175.498 175.551 -0.053 1
1 133 . 10 1 1 A 20 20 TYR CA C 20 56.967 57.072 -0.105 1
1 134 . 10 1 1 A 20 20 TYR CB C 20 39.083 38.606 0.477 1
1 137 . 10 1 1 A 20 20 TYR N N 20 123.173 121.455 1.718 1
1 138 . 10 1 1 A 21 21 HIS H H 21 8.934 8.851 0.083 1
1 139 . 10 1 1 A 21 21 HIS HA H 21 4.295 4.201 0.094 1
1 144 . 10 1 1 A 21 21 HIS C C 21 175.177 175.031 0.146 1
1 145 . 10 1 1 A 21 21 HIS CA C 21 56.572 56.714 -0.142 1
1 146 . 10 1 1 A 21 21 HIS CB C 21 33.365 31.917 1.448 1
1 149 . 10 1 1 A 21 21 HIS N N 21 125.732 127.560 -1.828 1
1 150 . 10 1 1 A 22 22 GLY H H 22 5.280 6.774 -1.494 1
1 151 . 10 1 1 A 22 22 GLY HA2 H 22 3.905 3.493 0.412 1
1 152 . 10 1 1 A 22 22 GLY HA3 H 22 3.585 3.756 -0.171 1
1 153 . 10 1 1 A 22 22 GLY C C 22 174.411 173.477 0.934 1
1 154 . 10 1 1 A 22 22 GLY CA C 22 46.402 43.953 2.449 1
1 155 . 10 1 1 A 22 22 GLY N N 22 104.568 106.498 -1.930 1
1 156 . 10 1 1 A 23 23 ALA H H 23 8.768 8.005 0.763 1
1 157 . 10 1 1 A 23 23 ALA HA H 23 5.171 4.786 0.385 1
1 161 . 10 1 1 A 23 23 ALA C C 23 177.180 176.745 0.435 1
1 162 . 10 1 1 A 23 23 ALA CA C 23 51.153 51.452 -0.299 1
1 163 . 10 1 1 A 23 23 ALA CB C 23 16.999 18.485 -1.486 1
1 164 . 10 1 1 A 23 23 ALA N N 23 130.297 123.160 7.137 1
1 165 . 10 1 1 A 24 24 ILE H H 24 7.267 8.166 -0.899 1
1 166 . 10 1 1 A 24 24 ILE HA H 24 4.460 4.909 -0.449 1
1 176 . 10 1 1 A 24 24 ILE CA C 24 58.529 57.230 1.299 1
1 177 . 10 1 1 A 24 24 ILE CB C 24 38.763 39.751 -0.988 1
1 181 . 10 1 1 A 24 24 ILE N N 24 118.903 118.130 0.773 1
1 182 . 10 1 1 A 25 25 PRO HA H 25 4.224 4.560 -0.336 1
1 189 . 10 1 1 A 25 25 PRO C C 25 176.918 177.503 -0.585 1
1 190 . 10 1 1 A 25 25 PRO CA C 25 62.907 62.601 0.306 1
1 191 . 10 1 1 A 25 25 PRO CB C 25 32.671 32.692 -0.021 1
1 194 . 10 1 1 A 26 26 ARG H H 26 8.781 9.066 -0.285 1
1 195 . 10 1 1 A 26 26 ARG HA H 26 3.472 3.887 -0.415 1
1 202 . 10 1 1 A 26 26 ARG C C 26 178.112 178.128 -0.016 1
1 203 . 10 1 1 A 26 26 ARG CA C 26 60.863 59.463 1.400 1
1 204 . 10 1 1 A 26 26 ARG CB C 26 30.314 29.669 0.645 1
1 207 . 10 1 1 A 26 26 ARG N N 26 124.635 121.975 2.660 1
1 208 . 10 1 1 A 27 27 ILE H H 27 8.540 8.167 0.373 1
1 209 . 10 1 1 A 27 27 ILE HA H 27 3.787 3.691 0.096 1
1 219 . 10 1 1 A 27 27 ILE C C 27 177.390 177.431 -0.041 1
1 220 . 10 1 1 A 27 27 ILE CA C 27 64.329 64.879 -0.550 1
1 221 . 10 1 1 A 27 27 ILE CB C 27 37.413 37.962 -0.549 1
1 225 . 10 1 1 A 27 27 ILE N N 27 115.859 119.864 -4.005 1
1 226 . 10 1 1 A 28 28 GLU H H 28 6.953 8.482 -1.529 1
1 227 . 10 1 1 A 28 28 GLU HA H 28 4.067 4.044 0.023 1
1 232 . 10 1 1 A 28 28 GLU C C 28 179.006 179.320 -0.314 1
1 233 . 10 1 1 A 28 28 GLU CA C 28 58.985 59.621 -0.636 1
1 234 . 10 1 1 A 28 28 GLU CB C 28 29.316 29.220 0.096 1
1 236 . 10 1 1 A 28 28 GLU N N 28 120.554 119.455 1.099 1
1 237 . 10 1 1 A 29 29 ALA H H 29 7.999 7.824 0.175 1
1 238 . 10 1 1 A 29 29 ALA HA H 29 3.822 4.045 -0.223 1
1 242 . 10 1 1 A 29 29 ALA C C 29 178.809 180.020 -1.211 1
1 243 . 10 1 1 A 29 29 ALA CA C 29 54.698 54.940 -0.242 1
1 244 . 10 1 1 A 29 29 ALA CB C 29 18.059 18.417 -0.358 1
1 245 . 10 1 1 A 29 29 ALA N N 29 120.122 122.564 -2.442 1
1 246 . 10 1 1 A 30 30 GLN H H 30 8.168 8.087 0.081 1
1 247 . 10 1 1 A 30 30 GLN HA H 30 3.811 4.224 -0.413 1
1 254 . 10 1 1 A 30 30 GLN C C 30 177.578 177.814 -0.236 1
1 255 . 10 1 1 A 30 30 GLN CA C 30 59.731 58.532 1.199 1
1 256 . 10 1 1 A 30 30 GLN CB C 30 28.161 28.687 -0.526 1
1 258 . 10 1 1 A 30 30 GLN N N 30 112.109 115.860 -3.751 1
1 260 . 10 1 1 A 31 31 GLU H H 31 7.248 8.434 -1.186 1
1 261 . 10 1 1 A 31 31 GLU HA H 31 4.063 4.116 -0.053 1
1 266 . 10 1 1 A 31 31 GLU C C 31 177.423 178.989 -1.566 1
1 267 . 10 1 1 A 31 31 GLU CA C 31 57.650 59.230 -1.580 1
1 268 . 10 1 1 A 31 31 GLU CB C 31 29.757 29.158 0.599 1
1 270 . 10 1 1 A 31 31 GLU N N 31 115.340 119.301 -3.961 1
1 271 . 10 1 1 A 32 32 LEU H H 32 7.169 7.247 -0.078 1
1 272 . 10 1 1 A 32 32 LEU HA H 32 4.087 4.246 -0.159 1
1 282 . 10 1 1 A 32 32 LEU C C 32 175.850 176.995 -1.145 1
1 283 . 10 1 1 A 32 32 LEU CA C 32 55.580 56.711 -1.131 1
1 284 . 10 1 1 A 32 32 LEU CB C 32 42.910 41.641 1.269 1
1 288 . 10 1 1 A 32 32 LEU N N 32 116.367 113.751 2.616 1
1 289 . 10 1 1 A 33 33 LEU H H 33 7.062 7.735 -0.673 1
1 290 . 10 1 1 A 33 33 LEU HA H 33 4.431 4.263 0.168 1
1 300 . 10 1 1 A 33 33 LEU C C 33 174.837 177.062 -2.225 1
1 301 . 10 1 1 A 33 33 LEU CA C 33 53.521 54.945 -1.424 1
1 302 . 10 1 1 A 33 33 LEU CB C 33 43.301 41.679 1.622 1
1 306 . 10 1 1 A 33 33 LEU N N 33 118.568 122.510 -3.942 1
1 307 . 10 1 1 A 34 34 LYS H H 34 8.749 8.524 0.225 1
1 308 . 10 1 1 A 34 34 LYS HA H 34 4.162 4.236 -0.074 1
1 317 . 10 1 1 A 34 34 LYS C C 34 174.378 175.250 -0.872 1
1 318 . 10 1 1 A 34 34 LYS CA C 34 56.575 56.054 0.521 1
1 319 . 10 1 1 A 34 34 LYS CB C 34 36.918 34.527 2.391 1
1 323 . 10 1 1 A 34 34 LYS N N 34 121.659 118.027 3.632 1
1 324 . 10 1 1 A 35 35 LYS H H 35 8.137 7.545 0.592 1
1 325 . 10 1 1 A 35 35 LYS HA H 35 4.011 4.745 -0.734 1
1 334 . 10 1 1 A 35 35 LYS C C 35 174.343 175.260 -0.917 1
1 335 . 10 1 1 A 35 35 LYS CA C 35 53.960 54.349 -0.389 1
1 336 . 10 1 1 A 35 35 LYS CB C 35 35.587 35.593 -0.006 1
1 340 . 10 1 1 A 35 35 LYS N N 35 119.354 115.840 3.514 1
1 341 . 10 1 1 A 36 36 GLN H H 36 8.394 8.737 -0.343 1
1 342 . 10 1 1 A 36 36 GLN HA H 36 4.187 4.567 -0.380 1
1 349 . 10 1 1 A 36 36 GLN C C 36 177.012 176.587 0.425 1
1 350 . 10 1 1 A 36 36 GLN CA C 36 57.750 57.877 -0.127 1
1 351 . 10 1 1 A 36 36 GLN CB C 36 28.433 28.420 0.013 1
1 353 . 10 1 1 A 36 36 GLN N N 36 120.248 123.432 -3.184 1
1 355 . 10 1 1 A 37 37 GLY H H 37 9.597 8.987 0.610 1
1 356 . 10 1 1 A 37 37 GLY HA2 H 37 4.486 4.102 0.384 1
1 357 . 10 1 1 A 37 37 GLY HA3 H 37 3.926 4.103 -0.177 1
1 358 . 10 1 1 A 37 37 GLY C C 37 176.285 174.524 1.761 1
1 359 . 10 1 1 A 37 37 GLY CA C 37 46.146 45.385 0.761 1
1 360 . 10 1 1 A 37 37 GLY N N 37 116.637 114.723 1.914 1
1 361 . 10 1 1 A 38 38 ASP H H 38 8.925 8.057 0.868 1
1 362 . 10 1 1 A 38 38 ASP HA H 38 5.697 4.745 0.952 1
1 365 . 10 1 1 A 38 38 ASP C C 38 176.181 175.723 0.458 1
1 366 . 10 1 1 A 38 38 ASP CA C 38 55.066 55.482 -0.416 1
1 367 . 10 1 1 A 38 38 ASP CB C 38 42.933 41.126 1.807 1
1 368 . 10 1 1 A 38 38 ASP N N 38 127.293 121.956 5.337 1
1 369 . 10 1 1 A 39 39 PHE H H 39 8.647 8.598 0.049 1
1 370 . 10 1 1 A 39 39 PHE HA H 39 6.025 6.020 0.005 1
1 378 . 10 1 1 A 39 39 PHE C C 39 170.948 173.011 -2.063 1
1 379 . 10 1 1 A 39 39 PHE CA C 39 56.376 56.120 0.256 1
1 380 . 10 1 1 A 39 39 PHE CB C 39 44.583 43.175 1.408 1
1 386 . 10 1 1 A 39 39 PHE N N 39 117.102 119.931 -2.829 1
1 387 . 10 1 1 A 40 40 LEU H H 40 9.186 8.993 0.193 1
1 388 . 10 1 1 A 40 40 LEU HA H 40 4.983 5.355 -0.372 1
1 398 . 10 1 1 A 40 40 LEU C C 40 174.787 174.562 0.225 1
1 399 . 10 1 1 A 40 40 LEU CA C 40 54.610 53.712 0.898 1
1 400 . 10 1 1 A 40 40 LEU CB C 40 44.330 46.199 -1.869 1
1 404 . 10 1 1 A 40 40 LEU N N 40 114.388 118.078 -3.690 1
1 405 . 10 1 1 A 41 41 VAL H H 41 9.390 9.166 0.224 1
1 406 . 10 1 1 A 41 41 VAL HA H 41 5.742 5.004 0.738 1
1 414 . 10 1 1 A 41 41 VAL C C 41 172.760 175.310 -2.550 1
1 415 . 10 1 1 A 41 41 VAL CA C 41 60.814 61.792 -0.978 1
1 416 . 10 1 1 A 41 41 VAL CB C 41 34.908 33.300 1.608 1
1 419 . 10 1 1 A 41 41 VAL N N 41 119.873 122.298 -2.425 1
1 420 . 10 1 1 A 42 42 ARG H H 42 9.598 9.119 0.479 1
1 421 . 10 1 1 A 42 42 ARG HA H 42 5.247 5.162 0.085 1
1 429 . 10 1 1 A 42 42 ARG C C 42 173.379 174.611 -1.232 1
1 430 . 10 1 1 A 42 42 ARG CA C 42 53.202 54.202 -1.000 1
1 431 . 10 1 1 A 42 42 ARG CB C 42 33.507 33.874 -0.367 1
1 434 . 10 1 1 A 42 42 ARG N N 42 124.179 124.710 -0.531 1
1 436 . 10 1 1 A 43 43 GLU H H 43 8.234 8.610 -0.376 1
1 437 . 10 1 1 A 43 43 GLU HA H 43 4.890 4.372 0.518 1
1 442 . 10 1 1 A 43 43 GLU C C 43 176.929 176.374 0.555 1
1 443 . 10 1 1 A 43 43 GLU CA C 43 54.846 55.468 -0.622 1
1 444 . 10 1 1 A 43 43 GLU CB C 43 31.599 31.143 0.456 1
1 446 . 10 1 1 A 43 43 GLU N N 43 124.103 124.390 -0.287 1
1 447 . 10 1 1 A 44 44 SER H H 44 9.033 8.994 0.039 1
1 448 . 10 1 1 A 44 44 SER HA H 44 3.957 4.580 -0.623 1
1 451 . 10 1 1 A 44 44 SER C C 44 175.005 175.738 -0.733 1
1 452 . 10 1 1 A 44 44 SER CA C 44 59.393 57.806 1.587 1
1 453 . 10 1 1 A 44 44 SER CB C 44 63.619 63.718 -0.099 1
1 454 . 10 1 1 A 44 44 SER N N 44 124.316 121.535 2.781 1
1 455 . 10 1 1 A 45 45 HIS H H 45 8.461 8.962 -0.501 1
1 456 . 10 1 1 A 45 45 HIS HA H 45 4.132 4.228 -0.096 1
1 460 . 10 1 1 A 45 45 HIS C C 45 176.480 176.931 -0.451 1
1 461 . 10 1 1 A 45 45 HIS CA C 45 58.887 58.125 0.762 1
1 462 . 10 1 1 A 45 45 HIS CB C 45 30.180 30.473 -0.293 1
1 464 . 10 1 1 A 45 45 HIS N N 45 127.694 127.850 -0.156 1
1 465 . 10 1 1 A 46 46 GLY H H 46 8.513 8.209 0.304 1
1 466 . 10 1 1 A 46 46 GLY HA2 H 46 3.827 3.824 0.003 1
1 467 . 10 1 1 A 46 46 GLY HA3 H 46 3.827 3.828 -0.001 1
1 468 . 10 1 1 A 46 46 GLY C C 46 173.630 174.291 -0.661 1
1 469 . 10 1 1 A 46 46 GLY CA C 46 45.188 46.304 -1.116 1
1 470 . 10 1 1 A 46 46 GLY N N 46 110.761 105.828 4.933 1
1 471 . 10 1 1 A 47 47 LYS H H 47 7.216 7.740 -0.524 1
1 472 . 10 1 1 A 47 47 LYS HA H 47 4.540 4.708 -0.168 1
1 481 . 10 1 1 A 47 47 LYS CA C 47 53.475 53.122 0.353 1
1 482 . 10 1 1 A 47 47 LYS CB C 47 33.325 33.753 -0.428 1
1 486 . 10 1 1 A 47 47 LYS N N 47 121.356 120.331 1.025 1
1 487 . 10 1 1 A 48 48 PRO HA H 48 4.181 4.269 -0.088 1
1 494 . 10 1 1 A 48 48 PRO C C 48 178.920 177.452 1.468 1
1 495 . 10 1 1 A 48 48 PRO CA C 48 63.239 63.930 -0.691 1
1 496 . 10 1 1 A 48 48 PRO CB C 48 31.523 31.421 0.102 1
1 499 . 10 1 1 A 49 49 GLY H H 49 9.752 8.673 1.079 1
1 500 . 10 1 1 A 49 49 GLY HA2 H 49 4.053 3.840 0.213 1
1 501 . 10 1 1 A 49 49 GLY HA3 H 49 3.374 3.878 -0.504 1
1 502 . 10 1 1 A 49 49 GLY C C 49 172.093 173.929 -1.836 1
1 503 . 10 1 1 A 49 49 GLY CA C 49 45.041 45.144 -0.103 1
1 504 . 10 1 1 A 49 49 GLY N N 49 112.415 112.740 -0.325 1
1 505 . 10 1 1 A 50 50 GLU H H 50 7.623 7.829 -0.206 1
1 506 . 10 1 1 A 50 50 GLU HA H 50 4.537 4.728 -0.191 1
1 511 . 10 1 1 A 50 50 GLU C C 50 173.297 175.136 -1.839 1
1 512 . 10 1 1 A 50 50 GLU CA C 50 55.174 55.621 -0.447 1
1 513 . 10 1 1 A 50 50 GLU CB C 50 31.651 30.964 0.687 1
1 515 . 10 1 1 A 50 50 GLU N N 50 121.600 121.603 -0.003 1
1 516 . 10 1 1 A 51 51 TYR H H 51 9.452 9.231 0.221 1
1 517 . 10 1 1 A 51 51 TYR HA H 51 5.382 5.292 0.090 1
1 524 . 10 1 1 A 51 51 TYR C C 51 174.387 175.228 -0.841 1
1 525 . 10 1 1 A 51 51 TYR CA C 51 57.592 56.653 0.939 1
1 526 . 10 1 1 A 51 51 TYR CB C 51 41.820 41.611 0.209 1
1 531 . 10 1 1 A 51 51 TYR N N 51 125.790 126.705 -0.915 1
1 532 . 10 1 1 A 52 52 VAL H H 52 9.471 9.354 0.117 1
1 533 . 10 1 1 A 52 52 VAL HA H 52 4.840 5.010 -0.170 1
1 541 . 10 1 1 A 52 52 VAL C C 52 174.947 174.549 0.398 1
1 542 . 10 1 1 A 52 52 VAL CA C 52 60.991 61.073 -0.082 1
1 543 . 10 1 1 A 52 52 VAL CB C 52 36.829 34.959 1.870 1
1 546 . 10 1 1 A 52 52 VAL N N 52 120.617 122.014 -1.397 1
1 547 . 10 1 1 A 53 53 LEU H H 53 9.457 9.326 0.131 1
1 548 . 10 1 1 A 53 53 LEU HA H 53 5.294 5.186 0.108 1
1 558 . 10 1 1 A 53 53 LEU C C 53 175.024 174.878 0.146 1
1 559 . 10 1 1 A 53 53 LEU CA C 53 53.904 54.482 -0.578 1
1 560 . 10 1 1 A 53 53 LEU CB C 53 44.756 44.406 0.350 1
1 564 . 10 1 1 A 53 53 LEU N N 53 127.725 131.335 -3.610 1
1 565 . 10 1 1 A 54 54 SER H H 54 9.461 9.314 0.147 1
1 566 . 10 1 1 A 54 54 SER HA H 54 5.691 5.467 0.224 1
1 569 . 10 1 1 A 54 54 SER C C 54 172.227 173.217 -0.990 1
1 570 . 10 1 1 A 54 54 SER CA C 54 58.551 57.834 0.717 1
1 571 . 10 1 1 A 54 54 SER CB C 54 65.738 64.776 0.962 1
1 572 . 10 1 1 A 54 54 SER N N 54 127.178 124.622 2.556 1
1 573 . 10 1 1 A 55 55 VAL H H 55 9.049 9.028 0.021 1
1 574 . 10 1 1 A 55 55 VAL HA H 55 5.691 5.493 0.198 1
1 582 . 10 1 1 A 55 55 VAL C C 55 173.959 172.851 1.108 1
1 583 . 10 1 1 A 55 55 VAL CA C 55 58.398 59.724 -1.326 1
1 584 . 10 1 1 A 55 55 VAL CB C 55 36.262 35.994 0.268 1
1 587 . 10 1 1 A 55 55 VAL N N 55 120.619 124.809 -4.190 1
1 588 . 10 1 1 A 56 56 TYR H H 56 8.629 9.081 -0.452 1
1 589 . 10 1 1 A 56 56 TYR HA H 56 4.951 4.927 0.024 1
1 596 . 10 1 1 A 56 56 TYR C C 56 175.224 174.856 0.368 1
1 597 . 10 1 1 A 56 56 TYR CA C 56 56.684 56.656 0.028 1
1 598 . 10 1 1 A 56 56 TYR CB C 56 39.646 39.575 0.071 1
1 603 . 10 1 1 A 56 56 TYR N N 56 127.444 129.486 -2.042 1
1 604 . 10 1 1 A 57 57 SER H H 57 8.869 8.857 0.012 1
1 605 . 10 1 1 A 57 57 SER HA H 57 4.739 4.808 -0.069 1
1 608 . 10 1 1 A 57 57 SER C C 57 174.492 172.630 1.862 1
1 609 . 10 1 1 A 57 57 SER CA C 57 57.591 57.251 0.340 1
1 610 . 10 1 1 A 57 57 SER CB C 57 64.281 66.374 -2.093 1
1 611 . 10 1 1 A 57 57 SER N N 57 122.165 122.913 -0.748 1
1 612 . 10 1 1 A 58 58 ASP H H 58 10.446 9.312 1.134 1
1 613 . 10 1 1 A 58 58 ASP HA H 58 4.382 4.300 0.082 1
1 616 . 10 1 1 A 58 58 ASP C C 58 176.398 176.133 0.265 1
1 617 . 10 1 1 A 58 58 ASP CA C 58 55.215 55.237 -0.022 1
1 618 . 10 1 1 A 58 58 ASP CB C 58 39.513 39.215 0.298 1
1 619 . 10 1 1 A 58 58 ASP N N 58 132.098 128.127 3.971 1
1 620 . 10 1 1 A 59 59 GLY H H 59 7.861 8.398 -0.537 1
1 621 . 10 1 1 A 59 59 GLY HA2 H 59 3.817 3.779 0.038 1
1 622 . 10 1 1 A 59 59 GLY HA3 H 59 4.086 3.791 0.295 1
1 623 . 10 1 1 A 59 59 GLY C C 59 173.111 173.495 -0.384 1
1 624 . 10 1 1 A 59 59 GLY CA C 59 45.486 45.312 0.174 1
1 625 . 10 1 1 A 59 59 GLY N N 59 102.674 104.679 -2.005 1
1 626 . 10 1 1 A 60 60 GLN H H 60 7.137 7.572 -0.435 1
1 627 . 10 1 1 A 60 60 GLN HA H 60 4.455 4.501 -0.046 1
1 634 . 10 1 1 A 60 60 GLN C C 60 173.549 175.125 -1.576 1
1 635 . 10 1 1 A 60 60 GLN CA C 60 53.388 54.013 -0.625 1
1 636 . 10 1 1 A 60 60 GLN CB C 60 32.373 30.508 1.865 1
1 638 . 10 1 1 A 60 60 GLN N N 60 116.206 119.195 -2.989 1
1 640 . 10 1 1 A 61 61 ARG H H 61 8.589 8.423 0.166 1
1 641 . 10 1 1 A 61 61 ARG HA H 61 4.740 4.390 0.350 1
1 649 . 10 1 1 A 61 61 ARG C C 61 174.458 174.747 -0.289 1
1 650 . 10 1 1 A 61 61 ARG CA C 61 57.116 55.244 1.872 1
1 651 . 10 1 1 A 61 61 ARG CB C 61 29.615 30.561 -0.946 1
1 654 . 10 1 1 A 61 61 ARG N N 61 120.467 121.551 -1.084 1
1 656 . 10 1 1 A 62 62 ARG H H 62 8.867 8.744 0.123 1
1 657 . 10 1 1 A 62 62 ARG HA H 62 4.297 4.153 0.144 1
1 665 . 10 1 1 A 62 62 ARG C C 62 173.485 175.671 -2.186 1
1 666 . 10 1 1 A 62 62 ARG CA C 62 53.355 55.462 -2.107 1
1 667 . 10 1 1 A 62 62 ARG CB C 62 33.028 30.585 2.443 1
1 670 . 10 1 1 A 62 62 ARG N N 62 122.641 124.373 -1.732 1
1 672 . 10 1 1 A 63 63 HIS H H 63 7.997 8.450 -0.453 1
1 673 . 10 1 1 A 63 63 HIS HA H 63 5.427 5.278 0.149 1
1 678 . 10 1 1 A 63 63 HIS C C 63 174.946 173.994 0.952 1
1 679 . 10 1 1 A 63 63 HIS CA C 63 54.689 53.895 0.794 1
1 680 . 10 1 1 A 63 63 HIS CB C 63 33.008 32.072 0.936 1
1 683 . 10 1 1 A 63 63 HIS N N 63 119.064 120.300 -1.236 1
1 684 . 10 1 1 A 64 64 PHE H H 64 9.880 9.417 0.463 1
1 685 . 10 1 1 A 64 64 PHE HA H 64 4.824 5.056 -0.232 1
1 693 . 10 1 1 A 64 64 PHE C C 64 174.882 175.336 -0.454 1
1 694 . 10 1 1 A 64 64 PHE CA C 64 56.489 56.341 0.148 1
1 695 . 10 1 1 A 64 64 PHE CB C 64 41.405 41.385 0.020 1
1 701 . 10 1 1 A 64 64 PHE N N 64 123.961 122.188 1.773 1
1 702 . 10 1 1 A 65 65 ILE H H 65 8.982 9.099 -0.117 1
1 703 . 10 1 1 A 65 65 ILE HA H 65 4.273 4.538 -0.265 1
1 713 . 10 1 1 A 65 65 ILE C C 65 176.556 175.965 0.591 1
1 714 . 10 1 1 A 65 65 ILE CA C 65 62.649 61.517 1.132 1
1 715 . 10 1 1 A 65 65 ILE CB C 65 38.296 38.098 0.198 1
1 719 . 10 1 1 A 65 65 ILE N N 65 126.601 124.470 2.131 1
1 720 . 10 1 1 A 66 66 ILE H H 66 8.947 9.113 -0.166 1
1 721 . 10 1 1 A 66 66 ILE HA H 66 3.780 4.547 -0.767 1
1 731 . 10 1 1 A 66 66 ILE C C 66 175.721 175.473 0.248 1
1 732 . 10 1 1 A 66 66 ILE CA C 66 62.960 60.398 2.562 1
1 733 . 10 1 1 A 66 66 ILE CB C 66 37.209 38.242 -1.033 1
1 737 . 10 1 1 A 66 66 ILE N N 66 130.139 128.790 1.349 1
1 738 . 10 1 1 A 67 67 GLN H H 67 8.410 8.927 -0.517 1
1 739 . 10 1 1 A 67 67 GLN HA H 67 4.422 4.812 -0.390 1
1 746 . 10 1 1 A 67 67 GLN C C 67 174.347 174.337 0.010 1
1 747 . 10 1 1 A 67 67 GLN CA C 67 55.867 55.146 0.721 1
1 748 . 10 1 1 A 67 67 GLN CB C 67 29.950 30.227 -0.277 1
1 750 . 10 1 1 A 67 67 GLN N N 67 128.872 127.152 1.720 1
1 752 . 10 1 1 A 68 68 TYR H H 68 8.619 8.981 -0.362 1
1 753 . 10 1 1 A 68 68 TYR HA H 68 5.300 4.852 0.448 1
1 760 . 10 1 1 A 68 68 TYR C C 68 174.695 174.293 0.402 1
1 761 . 10 1 1 A 68 68 TYR CA C 68 55.579 56.416 -0.837 1
1 762 . 10 1 1 A 68 68 TYR CB C 68 39.479 38.673 0.806 1
1 767 . 10 1 1 A 68 68 TYR N N 68 124.772 125.602 -0.830 1
1 768 . 10 1 1 A 69 69 VAL H H 69 8.539 8.701 -0.162 1
1 769 . 10 1 1 A 69 69 VAL HA H 69 4.046 4.365 -0.319 1
1 777 . 10 1 1 A 69 69 VAL C C 69 175.010 175.113 -0.103 1
1 778 . 10 1 1 A 69 69 VAL CA C 69 60.611 60.729 -0.118 1
1 779 . 10 1 1 A 69 69 VAL CB C 69 35.358 34.219 1.139 1
1 782 . 10 1 1 A 69 69 VAL N N 69 126.652 127.547 -0.895 1
1 783 . 10 1 1 A 70 70 ASP H H 70 9.089 9.294 -0.205 1
1 784 . 10 1 1 A 70 70 ASP HA H 70 4.025 4.202 -0.177 1
1 787 . 10 1 1 A 70 70 ASP C C 70 174.813 175.047 -0.234 1
1 788 . 10 1 1 A 70 70 ASP CA C 70 55.623 55.494 0.129 1
1 789 . 10 1 1 A 70 70 ASP CB C 70 39.081 39.207 -0.126 1
1 790 . 10 1 1 A 70 70 ASP N N 70 128.327 128.307 0.020 1
1 791 . 10 1 1 A 71 71 ASN H H 71 8.128 8.071 0.057 1
1 792 . 10 1 1 A 71 71 ASN HA H 71 3.597 3.711 -0.114 1
1 797 . 10 1 1 A 71 71 ASN C C 71 173.250 173.620 -0.370 1
1 798 . 10 1 1 A 71 71 ASN CA C 71 54.728 54.293 0.435 1
1 799 . 10 1 1 A 71 71 ASN CB C 71 37.601 37.146 0.455 1
1 800 . 10 1 1 A 71 71 ASN N N 71 107.230 107.951 -0.721 1
1 802 . 10 1 1 A 72 72 MET H H 72 7.256 7.357 -0.101 1
1 803 . 10 1 1 A 72 72 MET HA H 72 4.740 4.939 -0.199 1
1 808 . 10 1 1 A 72 72 MET C C 72 173.780 174.180 -0.400 1
1 809 . 10 1 1 A 72 72 MET CA C 72 53.703 53.976 -0.273 1
1 810 . 10 1 1 A 72 72 MET CB C 72 36.570 37.175 -0.605 1
1 812 . 10 1 1 A 72 72 MET N N 72 117.117 117.074 0.043 1
1 813 . 10 1 1 A 73 73 TYR H H 73 9.430 9.216 0.214 1
1 814 . 10 1 1 A 73 73 TYR HA H 73 5.718 5.233 0.485 1
1 821 . 10 1 1 A 73 73 TYR C C 73 176.140 175.742 0.398 1
1 822 . 10 1 1 A 73 73 TYR CA C 73 57.290 56.889 0.401 1
1 823 . 10 1 1 A 73 73 TYR CB C 73 40.013 39.884 0.129 1
1 828 . 10 1 1 A 73 73 TYR N N 73 119.856 120.504 -0.648 1
1 829 . 10 1 1 A 74 74 ARG H H 74 9.038 8.710 0.328 1
1 830 . 10 1 1 A 74 74 ARG HA H 74 4.867 5.002 -0.135 1
1 838 . 10 1 1 A 74 74 ARG C C 74 173.954 174.853 -0.899 1
1 839 . 10 1 1 A 74 74 ARG CA C 74 54.887 54.252 0.635 1
1 840 . 10 1 1 A 74 74 ARG CB C 74 34.484 34.295 0.189 1
1 843 . 10 1 1 A 74 74 ARG N N 74 117.344 121.553 -4.209 1
1 845 . 10 1 1 A 75 75 PHE H H 75 9.005 8.874 0.131 1
1 846 . 10 1 1 A 75 75 PHE HA H 75 5.046 4.739 0.307 1
1 854 . 10 1 1 A 75 75 PHE C C 75 176.186 176.246 -0.060 1
1 855 . 10 1 1 A 75 75 PHE CA C 75 59.658 59.383 0.275 1
1 856 . 10 1 1 A 75 75 PHE CB C 75 39.356 40.608 -1.252 1
1 862 . 10 1 1 A 75 75 PHE N N 75 117.865 118.646 -0.781 1
1 863 . 10 1 1 A 76 76 GLU H H 76 8.213 8.408 -0.195 1
1 864 . 10 1 1 A 76 76 GLU HA H 76 4.586 4.705 -0.119 1
1 869 . 10 1 1 A 76 76 GLU C C 76 175.238 177.531 -2.293 1
1 870 . 10 1 1 A 76 76 GLU CA C 76 55.994 57.553 -1.559 1
1 871 . 10 1 1 A 76 76 GLU CB C 76 31.805 32.589 -0.784 1
1 873 . 10 1 1 A 76 76 GLU N N 76 116.834 118.826 -1.992 1
1 874 . 10 1 1 A 77 77 GLY H H 77 8.692 7.965 0.727 1
1 875 . 10 1 1 A 77 77 GLY HA2 H 77 4.166 4.080 0.086 1
1 876 . 10 1 1 A 77 77 GLY HA3 H 77 4.015 4.087 -0.072 1
1 877 . 10 1 1 A 77 77 GLY C C 77 173.784 173.143 0.641 1
1 878 . 10 1 1 A 77 77 GLY CA C 77 45.505 44.901 0.604 1
1 879 . 10 1 1 A 77 77 GLY N N 77 111.937 108.139 3.798 1
1 880 . 10 1 1 A 78 78 THR H H 78 8.332 8.166 0.166 1
1 881 . 10 1 1 A 78 78 THR HA H 78 3.900 4.589 -0.689 1
1 886 . 10 1 1 A 78 78 THR C C 78 173.591 174.199 -0.608 1
1 887 . 10 1 1 A 78 78 THR CA C 78 63.653 61.191 2.462 1
1 888 . 10 1 1 A 78 78 THR CB C 78 69.649 69.868 -0.219 1
1 890 . 10 1 1 A 78 78 THR N N 78 120.765 117.325 3.440 1
1 891 . 10 1 1 A 79 79 GLY H H 79 8.038 8.314 -0.276 1
1 892 . 10 1 1 A 79 79 GLY HA2 H 79 4.748 4.392 0.356 1
1 893 . 10 1 1 A 79 79 GLY HA3 H 79 3.546 4.490 -0.944 1
1 894 . 10 1 1 A 79 79 GLY C C 79 172.580 171.742 0.838 1
1 895 . 10 1 1 A 79 79 GLY CA C 79 44.661 46.117 -1.456 1
1 896 . 10 1 1 A 79 79 GLY N N 79 109.887 111.179 -1.292 1
1 897 . 10 1 1 A 80 80 PHE H H 80 9.064 8.391 0.673 1
1 898 . 10 1 1 A 80 80 PHE HA H 80 4.886 4.966 -0.080 1
1 906 . 10 1 1 A 80 80 PHE C C 80 176.507 176.308 0.199 1
1 907 . 10 1 1 A 80 80 PHE CA C 80 57.257 56.732 0.525 1
1 908 . 10 1 1 A 80 80 PHE CB C 80 44.655 42.472 2.183 1
1 914 . 10 1 1 A 80 80 PHE N N 80 116.862 120.222 -3.360 1
1 915 . 10 1 1 A 81 81 SER H H 81 9.413 8.731 0.682 1
1 916 . 10 1 1 A 81 81 SER HA H 81 4.622 4.427 0.195 1
1 919 . 10 1 1 A 81 81 SER C C 81 173.735 174.900 -1.165 1
1 920 . 10 1 1 A 81 81 SER CA C 81 61.410 61.608 -0.198 1
1 921 . 10 1 1 A 81 81 SER CB C 81 64.165 63.392 0.773 1
1 922 . 10 1 1 A 81 81 SER N N 81 116.467 116.315 0.152 1
1 923 . 10 1 1 A 82 82 ASN H H 82 7.688 8.113 -0.425 1
1 924 . 10 1 1 A 82 82 ASN HA H 82 4.952 5.273 -0.321 1
1 929 . 10 1 1 A 82 82 ASN C C 82 173.303 175.464 -2.161 1
1 930 . 10 1 1 A 82 82 ASN CA C 82 52.086 52.289 -0.203 1
1 931 . 10 1 1 A 82 82 ASN CB C 82 41.258 40.929 0.329 1
1 932 . 10 1 1 A 82 82 ASN N N 82 113.355 116.925 -3.570 1
1 934 . 10 1 1 A 83 83 ILE H H 83 8.858 8.856 0.002 1
1 935 . 10 1 1 A 83 83 ILE HA H 83 3.571 3.775 -0.204 1
1 945 . 10 1 1 A 83 83 ILE CA C 83 66.416 65.430 0.986 1
1 946 . 10 1 1 A 83 83 ILE CB C 83 35.074 34.749 0.325 1
1 950 . 10 1 1 A 83 83 ILE N N 83 118.908 122.997 -4.089 1
1 951 . 10 1 1 A 84 84 PRO HA H 84 4.411 4.679 -0.268 1
1 958 . 10 1 1 A 84 84 PRO C C 84 177.616 179.529 -1.913 1
1 959 . 10 1 1 A 84 84 PRO CA C 84 67.525 66.499 1.026 1
1 960 . 10 1 1 A 84 84 PRO CB C 84 31.029 30.887 0.142 1
1 963 . 10 1 1 A 85 85 GLN H H 85 8.405 8.308 0.097 1
1 964 . 10 1 1 A 85 85 GLN HA H 85 3.874 3.987 -0.113 1
1 971 . 10 1 1 A 85 85 GLN C C 85 178.213 178.133 0.080 1
1 972 . 10 1 1 A 85 85 GLN CA C 85 59.495 58.715 0.780 1
1 973 . 10 1 1 A 85 85 GLN CB C 85 29.270 28.274 0.996 1
1 975 . 10 1 1 A 85 85 GLN N N 85 115.597 117.378 -1.781 1
1 977 . 10 1 1 A 86 86 LEU H H 86 7.136 8.055 -0.919 1
1 978 . 10 1 1 A 86 86 LEU HA H 86 3.589 3.831 -0.242 1
1 988 . 10 1 1 A 86 86 LEU C C 86 177.728 178.534 -0.806 1
1 989 . 10 1 1 A 86 86 LEU CA C 86 58.136 58.429 -0.293 1
1 990 . 10 1 1 A 86 86 LEU CB C 86 42.290 41.874 0.416 1
1 994 . 10 1 1 A 86 86 LEU N N 86 121.840 121.964 -0.124 1
1 995 . 10 1 1 A 87 87 ILE H H 87 8.323 8.132 0.191 1
1 996 . 10 1 1 A 87 87 ILE HA H 87 3.415 3.463 -0.048 1
1 1006 . 10 1 1 A 87 87 ILE C C 87 178.064 177.621 0.443 1
1 1007 . 10 1 1 A 87 87 ILE CA C 87 61.458 65.625 -4.167 1
1 1008 . 10 1 1 A 87 87 ILE CB C 87 34.561 37.825 -3.264 1
1 1012 . 10 1 1 A 87 87 ILE N N 87 118.117 119.669 -1.552 1
1 1013 . 10 1 1 A 88 88 ASP H H 88 8.805 8.310 0.495 1
1 1014 . 10 1 1 A 88 88 ASP HA H 88 4.548 4.222 0.326 1
1 1017 . 10 1 1 A 88 88 ASP C C 88 179.265 178.033 1.232 1
1 1018 . 10 1 1 A 88 88 ASP CA C 88 58.099 57.335 0.764 1
1 1019 . 10 1 1 A 88 88 ASP CB C 88 42.166 41.886 0.280 1
1 1020 . 10 1 1 A 88 88 ASP N N 88 119.143 120.523 -1.380 1
1 1021 . 10 1 1 A 89 89 HIS H H 89 8.113 7.919 0.194 1
1 1022 . 10 1 1 A 89 89 HIS HA H 89 4.225 4.292 -0.067 1
1 1026 . 10 1 1 A 89 89 HIS C C 89 179.261 176.962 2.299 1
1 1027 . 10 1 1 A 89 89 HIS CA C 89 60.647 59.216 1.431 1
1 1028 . 10 1 1 A 89 89 HIS CB C 89 30.801 29.526 1.275 1
1 1030 . 10 1 1 A 89 89 HIS N N 89 119.595 119.095 0.500 1
1 1031 . 10 1 1 A 90 90 HIS H H 90 7.685 7.843 -0.158 1
1 1032 . 10 1 1 A 90 90 HIS HA H 90 3.628 4.098 -0.470 1
1 1036 . 10 1 1 A 90 90 HIS C C 90 178.454 177.514 0.940 1
1 1037 . 10 1 1 A 90 90 HIS CA C 90 61.797 60.180 1.617 1
1 1038 . 10 1 1 A 90 90 HIS CB C 90 28.165 29.933 -1.768 1
1 1040 . 10 1 1 A 90 90 HIS N N 90 120.061 117.607 2.454 1
1 1041 . 10 1 1 A 91 91 TYR H H 91 9.394 7.981 1.413 1
1 1042 . 10 1 1 A 91 91 TYR HA H 91 4.238 3.879 0.359 1
1 1049 . 10 1 1 A 91 91 TYR C C 91 176.443 177.362 -0.919 1
1 1050 . 10 1 1 A 91 91 TYR CA C 91 60.669 61.834 -1.165 1
1 1051 . 10 1 1 A 91 91 TYR CB C 91 39.169 38.958 0.211 1
1 1056 . 10 1 1 A 91 91 TYR N N 91 123.532 119.959 3.573 1
1 1057 . 10 1 1 A 92 92 THR H H 92 8.774 8.495 0.279 1
1 1058 . 10 1 1 A 92 92 THR HA H 92 3.866 4.093 -0.227 1
1 1063 . 10 1 1 A 92 92 THR C C 92 177.050 176.345 0.705 1
1 1064 . 10 1 1 A 92 92 THR CA C 92 65.240 65.323 -0.083 1
1 1065 . 10 1 1 A 92 92 THR CB C 92 69.298 67.964 1.334 1
1 1067 . 10 1 1 A 92 92 THR N N 92 112.000 112.871 -0.871 1
1 1068 . 10 1 1 A 93 93 THR H H 93 7.617 7.664 -0.047 1
1 1069 . 10 1 1 A 93 93 THR HA H 93 4.133 4.113 0.020 1
1 1074 . 10 1 1 A 93 93 THR C C 93 176.234 174.946 1.288 1
1 1075 . 10 1 1 A 93 93 THR CA C 93 63.527 62.723 0.804 1
1 1076 . 10 1 1 A 93 93 THR CB C 93 71.234 69.766 1.468 1
1 1078 . 10 1 1 A 93 93 THR N N 93 109.883 112.699 -2.816 1
1 1079 . 10 1 1 A 94 94 LYS H H 94 7.210 7.655 -0.445 1
1 1080 . 10 1 1 A 94 94 LYS HA H 94 3.830 3.757 0.073 1
1 1089 . 10 1 1 A 94 94 LYS C C 94 174.331 175.911 -1.580 1
1 1090 . 10 1 1 A 94 94 LYS CA C 94 56.776 57.401 -0.625 1
1 1091 . 10 1 1 A 94 94 LYS CB C 94 28.095 30.724 -2.629 1
1 1095 . 10 1 1 A 94 94 LYS N N 94 112.818 121.101 -8.283 1
1 1096 . 10 1 1 A 95 95 GLN H H 95 7.439 7.502 -0.063 1
1 1097 . 10 1 1 A 95 95 GLN HA H 95 4.216 4.592 -0.376 1
1 1104 . 10 1 1 A 95 95 GLN C C 95 179.087 175.585 3.502 1
1 1105 . 10 1 1 A 95 95 GLN CA C 95 56.378 55.255 1.123 1
1 1106 . 10 1 1 A 95 95 GLN CB C 95 28.542 30.270 -1.728 1
1 1108 . 10 1 1 A 95 95 GLN N N 95 117.860 119.680 -1.820 1
1 1110 . 10 1 1 A 96 96 VAL H H 96 8.520 8.554 -0.034 1
1 1111 . 10 1 1 A 96 96 VAL HA H 96 4.297 4.407 -0.110 1
1 1119 . 10 1 1 A 96 96 VAL C C 96 177.329 176.743 0.586 1
1 1120 . 10 1 1 A 96 96 VAL CA C 96 61.196 62.068 -0.872 1
1 1121 . 10 1 1 A 96 96 VAL CB C 96 32.735 32.975 -0.240 1
1 1124 . 10 1 1 A 96 96 VAL N N 96 124.208 122.431 1.777 1
1 1125 . 10 1 1 A 97 97 ILE H H 97 8.491 8.445 0.046 1
1 1126 . 10 1 1 A 97 97 ILE HA H 97 2.995 3.507 -0.512 1
1 1136 . 10 1 1 A 97 97 ILE CA C 97 62.066 63.259 -1.193 1
1 1137 . 10 1 1 A 97 97 ILE CB C 97 36.117 37.958 -1.841 1
1 1141 . 10 1 1 A 97 97 ILE N N 97 119.561 124.753 -5.192 1
1 1142 . 10 1 1 A 98 98 THR HA H 98 4.460 4.441 0.019 1
1 1147 . 10 1 1 A 98 98 THR C C 98 174.335 174.938 -0.603 1
1 1148 . 10 1 1 A 98 98 THR CA C 98 58.244 60.201 -1.957 1
1 1149 . 10 1 1 A 98 98 THR CB C 98 73.056 70.671 2.385 1
1 1151 . 10 1 1 A 99 99 LYS H H 99 9.761 8.965 0.796 1
1 1152 . 10 1 1 A 99 99 LYS HA H 99 3.911 3.945 -0.034 1
1 1161 . 10 1 1 A 99 99 LYS C C 99 179.594 179.165 0.429 1
1 1162 . 10 1 1 A 99 99 LYS CA C 99 59.661 59.922 -0.261 1
1 1163 . 10 1 1 A 99 99 LYS CB C 99 31.978 32.142 -0.164 1
1 1167 . 10 1 1 A 99 99 LYS N N 99 125.750 123.421 2.329 1
1 1168 . 10 1 1 A 100 100 LYS H H 100 8.910 7.810 1.100 1
1 1169 . 10 1 1 A 100 100 LYS HA H 100 4.024 4.111 -0.087 1
1 1178 . 10 1 1 A 100 100 LYS C C 100 178.060 178.110 -0.050 1
1 1179 . 10 1 1 A 100 100 LYS CA C 100 58.642 58.693 -0.051 1
1 1180 . 10 1 1 A 100 100 LYS CB C 100 32.750 32.265 0.485 1
1 1184 . 10 1 1 A 100 100 LYS N N 100 117.112 120.286 -3.174 1
1 1185 . 10 1 1 A 101 101 SER H H 101 7.721 7.467 0.254 1
1 1186 . 10 1 1 A 101 101 SER HA H 101 4.282 4.614 -0.332 1
1 1189 . 10 1 1 A 101 101 SER C C 101 176.403 174.476 1.927 1
1 1190 . 10 1 1 A 101 101 SER CA C 101 60.442 58.874 1.568 1
1 1191 . 10 1 1 A 101 101 SER CB C 101 63.775 65.100 -1.325 1
1 1192 . 10 1 1 A 101 101 SER N N 101 112.069 111.766 0.303 1
1 1193 . 10 1 1 A 102 102 GLY H H 102 8.038 7.995 0.043 1
1 1194 . 10 1 1 A 102 102 GLY HA2 H 102 4.024 3.880 0.144 1
1 1195 . 10 1 1 A 102 102 GLY HA3 H 102 3.713 3.906 -0.193 1
1 1196 . 10 1 1 A 102 102 GLY C C 102 173.991 174.475 -0.484 1
1 1197 . 10 1 1 A 102 102 GLY CA C 102 46.458 46.779 -0.321 1
1 1198 . 10 1 1 A 102 102 GLY N N 102 111.144 110.714 0.430 1
1 1199 . 10 1 1 A 103 103 VAL H H 103 7.155 7.677 -0.522 1
1 1200 . 10 1 1 A 103 103 VAL HA H 103 3.652 4.278 -0.626 1
1 1208 . 10 1 1 A 103 103 VAL C C 103 173.805 175.142 -1.337 1
1 1209 . 10 1 1 A 103 103 VAL CA C 103 64.310 61.608 2.702 1
1 1210 . 10 1 1 A 103 103 VAL CB C 103 32.254 33.447 -1.193 1
1 1213 . 10 1 1 A 103 103 VAL N N 103 119.836 119.545 0.291 1
1 1214 . 10 1 1 A 104 104 VAL H H 104 7.653 9.085 -1.432 1
1 1215 . 10 1 1 A 104 104 VAL HA H 104 4.048 4.417 -0.369 1
1 1223 . 10 1 1 A 104 104 VAL C C 104 175.708 174.572 1.136 1
1 1224 . 10 1 1 A 104 104 VAL CA C 104 60.275 60.728 -0.453 1
1 1225 . 10 1 1 A 104 104 VAL CB C 104 35.112 34.041 1.071 1
1 1228 . 10 1 1 A 104 104 VAL N N 104 125.859 128.197 -2.338 1
1 1229 . 10 1 1 A 105 105 LEU H H 105 8.616 8.315 0.301 1
1 1230 . 10 1 1 A 105 105 LEU HA H 105 3.905 4.598 -0.693 1
1 1240 . 10 1 1 A 105 105 LEU C C 105 175.380 175.696 -0.316 1
1 1241 . 10 1 1 A 105 105 LEU CA C 105 54.471 53.732 0.739 1
1 1242 . 10 1 1 A 105 105 LEU CB C 105 39.821 41.081 -1.260 1
1 1246 . 10 1 1 A 105 105 LEU N N 105 123.839 126.171 -2.332 1
1 1247 . 10 1 1 A 106 106 LEU H H 106 8.894 8.501 0.393 1
1 1248 . 10 1 1 A 106 106 LEU HA H 106 4.839 4.908 -0.069 1
1 1258 . 10 1 1 A 106 106 LEU C C 106 176.930 176.284 0.646 1
1 1259 . 10 1 1 A 106 106 LEU CA C 106 56.288 53.096 3.192 1
1 1260 . 10 1 1 A 106 106 LEU CB C 106 45.237 45.589 -0.352 1
1 1264 . 10 1 1 A 106 106 LEU N N 106 120.590 121.710 -1.120 1
1 1265 . 10 1 1 A 107 107 ASN H H 107 8.124 9.108 -0.984 1
1 1266 . 10 1 1 A 107 107 ASN HA H 107 5.650 4.622 1.028 1
1 1271 . 10 1 1 A 107 107 ASN CA C 107 50.293 54.014 -3.721 1
1 1272 . 10 1 1 A 107 107 ASN CB C 107 41.223 36.204 5.019 1
1 1273 . 10 1 1 A 107 107 ASN N N 107 116.866 117.939 -1.073 1
1 1275 . 10 1 1 A 108 108 PRO HA H 108 2.926 4.058 -1.132 1
1 1282 . 10 1 1 A 108 108 PRO C C 108 176.671 175.490 1.181 1
1 1283 . 10 1 1 A 108 108 PRO CA C 108 60.804 62.432 -1.628 1
1 1284 . 10 1 1 A 108 108 PRO CB C 108 31.774 32.074 -0.300 1
1 1287 . 10 1 1 A 109 109 ILE H H 109 8.648 7.742 0.906 1
1 1288 . 10 1 1 A 109 109 ILE HA H 109 4.519 4.541 -0.022 1
1 1298 . 10 1 1 A 109 109 ILE CA C 109 55.070 58.363 -3.293 1
1 1299 . 10 1 1 A 109 109 ILE CB C 109 36.068 38.484 -2.416 1
1 1303 . 10 1 1 A 109 109 ILE N N 109 128.817 122.487 6.330 1
1 1304 . 10 1 1 A 110 110 PRO HA H 110 4.587 4.584 0.003 1
1 1311 . 10 1 1 A 110 110 PRO C C 110 177.013 176.130 0.883 1
1 1312 . 10 1 1 A 110 110 PRO CA C 110 61.850 62.514 -0.664 1
1 1313 . 10 1 1 A 110 110 PRO CB C 110 32.507 33.060 -0.553 1
1 1316 . 10 1 1 A 111 111 LYS H H 111 8.038 8.273 -0.235 1
1 1317 . 10 1 1 A 111 111 LYS HA H 111 3.553 5.121 -1.568 1
1 1326 . 10 1 1 A 111 111 LYS C C 111 176.123 174.042 2.081 1
1 1327 . 10 1 1 A 111 111 LYS CA C 111 56.220 53.788 2.432 1
1 1328 . 10 1 1 A 111 111 LYS CB C 111 32.373 36.679 -4.306 1
1 1332 . 10 1 1 A 111 111 LYS N N 111 120.147 115.682 4.465 1
1 1333 . 10 1 1 A 112 112 ASP H H 112 8.463 8.523 -0.060 1
1 1334 . 10 1 1 A 112 112 ASP HA H 112 4.523 4.920 -0.397 1
1 1337 . 10 1 1 A 112 112 ASP C C 112 175.986 174.542 1.444 1
1 1338 . 10 1 1 A 112 112 ASP CA C 112 54.256 53.222 1.034 1
1 1339 . 10 1 1 A 112 112 ASP CB C 112 41.563 44.602 -3.039 1
1 1340 . 10 1 1 A 112 112 ASP N N 112 121.863 119.032 2.831 1
1 1341 . 10 1 1 A 113 113 LYS H H 113 8.059 8.472 -0.413 1
1 1342 . 10 1 1 A 113 113 LYS HA H 113 4.136 4.280 -0.144 1
1 1351 . 10 1 1 A 113 113 LYS C C 113 176.010 175.204 0.806 1
1 1352 . 10 1 1 A 113 113 LYS CA C 113 56.253 55.976 0.277 1
1 1353 . 10 1 1 A 113 113 LYS CB C 113 32.754 32.309 0.445 1
1 1357 . 10 1 1 A 113 113 LYS N N 113 121.725 121.633 0.092 1
1 1358 . 10 1 1 A 114 114 LYS H H 114 8.225 7.433 0.792 1
1 1359 . 10 1 1 A 114 114 LYS HA H 114 4.169 4.658 -0.489 1
1 1368 . 10 1 1 A 114 114 LYS C C 114 176.198 176.141 0.057 1
1 1369 . 10 1 1 A 114 114 LYS CA C 114 56.413 54.342 2.071 1
1 1370 . 10 1 1 A 114 114 LYS CB C 114 32.725 35.841 -3.116 1
1 1374 . 10 1 1 A 114 114 LYS N N 114 121.857 118.411 3.446 1
1 1375 . 10 1 1 A 115 115 TRP H H 115 8.078 8.667 -0.589 1
1 1376 . 10 1 1 A 115 115 TRP HA H 115 4.709 4.768 -0.059 1
1 1385 . 10 1 1 A 115 115 TRP C C 115 175.119 175.932 -0.813 1
1 1386 . 10 1 1 A 115 115 TRP CA C 115 56.856 56.140 0.716 1
1 1387 . 10 1 1 A 115 115 TRP CB C 115 29.474 27.238 2.236 1
1 1393 . 10 1 1 A 115 115 TRP N N 115 122.068 121.230 0.838 1
1 1 . 11 1 1 A 10 10 HIS HA H 10 4.616 4.811 -0.195 1
1 4 . 11 1 1 A 10 10 HIS C C 10 174.981 173.041 1.940 1
1 5 . 11 1 1 A 10 10 HIS CA C 10 56.555 56.288 0.267 1
1 6 . 11 1 1 A 10 10 HIS CB C 10 30.231 32.722 -2.491 1
1 7 . 11 1 1 A 11 11 MET H H 11 8.103 8.321 -0.218 1
1 8 . 11 1 1 A 11 11 MET HA H 11 4.439 4.167 0.272 1
1 13 . 11 1 1 A 11 11 MET C C 11 175.888 175.651 0.237 1
1 14 . 11 1 1 A 11 11 MET CA C 11 55.090 55.345 -0.255 1
1 15 . 11 1 1 A 11 11 MET CB C 11 33.121 32.812 0.309 1
1 17 . 11 1 1 A 11 11 MET N N 11 120.743 123.014 -2.271 1
1 18 . 11 1 1 A 12 12 LYS H H 12 8.065 8.415 -0.350 1
1 19 . 11 1 1 A 12 12 LYS HA H 12 4.407 4.656 -0.249 1
1 28 . 11 1 1 A 12 12 LYS CA C 12 54.894 52.570 2.324 1
1 29 . 11 1 1 A 12 12 LYS CB C 12 31.863 33.434 -1.571 1
1 33 . 11 1 1 A 12 12 LYS N N 12 123.187 122.962 0.225 1
1 34 . 11 1 1 A 13 13 PRO HA H 13 4.347 4.477 -0.130 1
1 41 . 11 1 1 A 13 13 PRO C C 13 176.891 176.985 -0.094 1
1 42 . 11 1 1 A 13 13 PRO CA C 13 62.542 62.249 0.293 1
1 43 . 11 1 1 A 13 13 PRO CB C 13 32.663 33.560 -0.897 1
1 46 . 11 1 1 A 14 14 LEU H H 14 8.339 8.750 -0.411 1
1 47 . 11 1 1 A 14 14 LEU HA H 14 3.373 3.789 -0.416 1
1 57 . 11 1 1 A 14 14 LEU C C 14 176.683 178.331 -1.648 1
1 58 . 11 1 1 A 14 14 LEU CA C 14 58.555 57.418 1.137 1
1 59 . 11 1 1 A 14 14 LEU CB C 14 41.828 41.077 0.751 1
1 63 . 11 1 1 A 14 14 LEU N N 14 123.191 123.092 0.099 1
1 64 . 11 1 1 A 15 15 ALA H H 15 8.175 7.829 0.346 1
1 65 . 11 1 1 A 15 15 ALA HA H 15 3.983 4.210 -0.227 1
1 69 . 11 1 1 A 15 15 ALA C C 15 178.697 177.952 0.745 1
1 70 . 11 1 1 A 15 15 ALA CA C 15 54.164 54.230 -0.066 1
1 71 . 11 1 1 A 15 15 ALA CB C 15 18.771 18.235 0.536 1
1 72 . 11 1 1 A 15 15 ALA N N 15 113.594 119.824 -6.230 1
1 73 . 11 1 1 A 16 16 GLU H H 16 7.458 7.490 -0.032 1
1 74 . 11 1 1 A 16 16 GLU HA H 16 4.266 4.294 -0.028 1
1 79 . 11 1 1 A 16 16 GLU C C 16 176.510 176.509 0.001 1
1 80 . 11 1 1 A 16 16 GLU CA C 16 55.196 56.602 -1.406 1
1 81 . 11 1 1 A 16 16 GLU CB C 16 30.907 30.208 0.699 1
1 83 . 11 1 1 A 16 16 GLU N N 16 113.348 115.609 -2.261 1
1 84 . 11 1 1 A 17 17 GLN H H 17 7.501 6.988 0.513 1
1 85 . 11 1 1 A 17 17 GLN HA H 17 3.683 4.004 -0.321 1
1 92 . 11 1 1 A 17 17 GLN C C 17 178.053 176.008 2.045 1
1 93 . 11 1 1 A 17 17 GLN CA C 17 54.606 55.230 -0.624 1
1 94 . 11 1 1 A 17 17 GLN CB C 17 25.758 28.164 -2.406 1
1 96 . 11 1 1 A 17 17 GLN N N 17 119.411 119.521 -0.110 1
1 98 . 11 1 1 A 18 18 ASP H H 18 8.949 8.429 0.520 1
1 99 . 11 1 1 A 18 18 ASP HA H 18 4.184 4.102 0.082 1
1 102 . 11 1 1 A 18 18 ASP C C 18 175.263 178.230 -2.967 1
1 103 . 11 1 1 A 18 18 ASP CA C 18 57.275 57.024 0.251 1
1 104 . 11 1 1 A 18 18 ASP CB C 18 40.620 40.273 0.347 1
1 105 . 11 1 1 A 18 18 ASP N N 18 124.676 123.458 1.218 1
1 106 . 11 1 1 A 19 19 TRP H H 19 6.068 7.165 -1.097 1
1 107 . 11 1 1 A 19 19 TRP HA H 19 5.045 4.600 0.445 1
1 116 . 11 1 1 A 19 19 TRP C C 19 175.902 176.248 -0.346 1
1 117 . 11 1 1 A 19 19 TRP CA C 19 53.542 57.669 -4.127 1
1 118 . 11 1 1 A 19 19 TRP CB C 19 29.179 28.691 0.488 1
1 124 . 11 1 1 A 19 19 TRP N N 19 107.757 118.052 -10.295 1
1 126 . 11 1 1 A 20 20 TYR H H 20 7.430 7.408 0.022 1
1 127 . 11 1 1 A 20 20 TYR HA H 20 5.601 5.472 0.129 1
1 132 . 11 1 1 A 20 20 TYR C C 20 175.498 175.573 -0.075 1
1 133 . 11 1 1 A 20 20 TYR CA C 20 56.967 56.967 0.000 1
1 134 . 11 1 1 A 20 20 TYR CB C 20 39.083 38.633 0.450 1
1 137 . 11 1 1 A 20 20 TYR N N 20 123.173 121.545 1.628 1
1 138 . 11 1 1 A 21 21 HIS H H 21 8.934 8.690 0.244 1
1 139 . 11 1 1 A 21 21 HIS HA H 21 4.295 4.274 0.021 1
1 144 . 11 1 1 A 21 21 HIS C C 21 175.177 175.040 0.137 1
1 145 . 11 1 1 A 21 21 HIS CA C 21 56.572 56.435 0.137 1
1 146 . 11 1 1 A 21 21 HIS CB C 21 33.365 31.398 1.967 1
1 149 . 11 1 1 A 21 21 HIS N N 21 125.732 127.476 -1.744 1
1 150 . 11 1 1 A 22 22 GLY H H 22 5.280 6.716 -1.436 1
1 151 . 11 1 1 A 22 22 GLY HA2 H 22 3.905 3.438 0.467 1
1 152 . 11 1 1 A 22 22 GLY HA3 H 22 3.585 3.702 -0.117 1
1 153 . 11 1 1 A 22 22 GLY C C 22 174.411 174.407 0.004 1
1 154 . 11 1 1 A 22 22 GLY CA C 22 46.402 44.221 2.181 1
1 155 . 11 1 1 A 22 22 GLY N N 22 104.568 106.621 -2.053 1
1 156 . 11 1 1 A 23 23 ALA H H 23 8.768 8.354 0.414 1
1 157 . 11 1 1 A 23 23 ALA HA H 23 5.171 4.539 0.632 1
1 161 . 11 1 1 A 23 23 ALA C C 23 177.180 177.417 -0.237 1
1 162 . 11 1 1 A 23 23 ALA CA C 23 51.153 51.285 -0.132 1
1 163 . 11 1 1 A 23 23 ALA CB C 23 16.999 18.833 -1.834 1
1 164 . 11 1 1 A 23 23 ALA N N 23 130.297 128.120 2.177 1
1 165 . 11 1 1 A 24 24 ILE H H 24 7.267 7.180 0.087 1
1 166 . 11 1 1 A 24 24 ILE HA H 24 4.460 4.393 0.067 1
1 176 . 11 1 1 A 24 24 ILE CA C 24 58.529 59.598 -1.069 1
1 177 . 11 1 1 A 24 24 ILE CB C 24 38.763 37.756 1.007 1
1 181 . 11 1 1 A 24 24 ILE N N 24 118.903 114.960 3.943 1
1 182 . 11 1 1 A 25 25 PRO HA H 25 4.224 4.457 -0.233 1
1 189 . 11 1 1 A 25 25 PRO C C 25 176.918 177.447 -0.529 1
1 190 . 11 1 1 A 25 25 PRO CA C 25 62.907 62.295 0.612 1
1 191 . 11 1 1 A 25 25 PRO CB C 25 32.671 32.443 0.228 1
1 194 . 11 1 1 A 26 26 ARG H H 26 8.781 9.015 -0.234 1
1 195 . 11 1 1 A 26 26 ARG HA H 26 3.472 3.933 -0.461 1
1 202 . 11 1 1 A 26 26 ARG C C 26 178.112 177.936 0.176 1
1 203 . 11 1 1 A 26 26 ARG CA C 26 60.863 59.321 1.542 1
1 204 . 11 1 1 A 26 26 ARG CB C 26 30.314 29.832 0.482 1
1 207 . 11 1 1 A 26 26 ARG N N 26 124.635 121.726 2.909 1
1 208 . 11 1 1 A 27 27 ILE H H 27 8.540 8.051 0.489 1
1 209 . 11 1 1 A 27 27 ILE HA H 27 3.787 3.616 0.171 1
1 219 . 11 1 1 A 27 27 ILE C C 27 177.390 177.504 -0.114 1
1 220 . 11 1 1 A 27 27 ILE CA C 27 64.329 64.862 -0.533 1
1 221 . 11 1 1 A 27 27 ILE CB C 27 37.413 37.890 -0.477 1
1 225 . 11 1 1 A 27 27 ILE N N 27 115.859 119.989 -4.130 1
1 226 . 11 1 1 A 28 28 GLU H H 28 6.953 8.242 -1.289 1
1 227 . 11 1 1 A 28 28 GLU HA H 28 4.067 3.992 0.075 1
1 232 . 11 1 1 A 28 28 GLU C C 28 179.006 179.327 -0.321 1
1 233 . 11 1 1 A 28 28 GLU CA C 28 58.985 59.437 -0.452 1
1 234 . 11 1 1 A 28 28 GLU CB C 28 29.316 29.006 0.310 1
1 236 . 11 1 1 A 28 28 GLU N N 28 120.554 119.280 1.274 1
1 237 . 11 1 1 A 29 29 ALA H H 29 7.999 7.975 0.024 1
1 238 . 11 1 1 A 29 29 ALA HA H 29 3.822 3.925 -0.103 1
1 242 . 11 1 1 A 29 29 ALA C C 29 178.809 179.720 -0.911 1
1 243 . 11 1 1 A 29 29 ALA CA C 29 54.698 55.361 -0.663 1
1 244 . 11 1 1 A 29 29 ALA CB C 29 18.059 18.276 -0.217 1
1 245 . 11 1 1 A 29 29 ALA N N 29 120.122 122.723 -2.601 1
1 246 . 11 1 1 A 30 30 GLN H H 30 8.168 8.084 0.084 1
1 247 . 11 1 1 A 30 30 GLN HA H 30 3.811 4.154 -0.343 1
1 254 . 11 1 1 A 30 30 GLN C C 30 177.578 178.192 -0.614 1
1 255 . 11 1 1 A 30 30 GLN CA C 30 59.731 58.582 1.149 1
1 256 . 11 1 1 A 30 30 GLN CB C 30 28.161 28.549 -0.388 1
1 258 . 11 1 1 A 30 30 GLN N N 30 112.109 115.859 -3.750 1
1 260 . 11 1 1 A 31 31 GLU H H 31 7.248 8.211 -0.963 1
1 261 . 11 1 1 A 31 31 GLU HA H 31 4.063 4.044 0.019 1
1 266 . 11 1 1 A 31 31 GLU C C 31 177.423 179.280 -1.857 1
1 267 . 11 1 1 A 31 31 GLU CA C 31 57.650 59.108 -1.458 1
1 268 . 11 1 1 A 31 31 GLU CB C 31 29.757 29.149 0.608 1
1 270 . 11 1 1 A 31 31 GLU N N 31 115.340 119.684 -4.344 1
1 271 . 11 1 1 A 32 32 LEU H H 32 7.169 7.379 -0.210 1
1 272 . 11 1 1 A 32 32 LEU HA H 32 4.087 4.100 -0.013 1
1 282 . 11 1 1 A 32 32 LEU C C 32 175.850 177.014 -1.164 1
1 283 . 11 1 1 A 32 32 LEU CA C 32 55.580 56.867 -1.287 1
1 284 . 11 1 1 A 32 32 LEU CB C 32 42.910 41.423 1.487 1
1 288 . 11 1 1 A 32 32 LEU N N 32 116.367 115.659 0.708 1
1 289 . 11 1 1 A 33 33 LEU H H 33 7.062 7.422 -0.360 1
1 290 . 11 1 1 A 33 33 LEU HA H 33 4.431 4.339 0.092 1
1 300 . 11 1 1 A 33 33 LEU C C 33 174.837 177.177 -2.340 1
1 301 . 11 1 1 A 33 33 LEU CA C 33 53.521 54.483 -0.962 1
1 302 . 11 1 1 A 33 33 LEU CB C 33 43.301 40.971 2.330 1
1 306 . 11 1 1 A 33 33 LEU N N 33 118.568 122.249 -3.681 1
1 307 . 11 1 1 A 34 34 LYS H H 34 8.749 8.493 0.256 1
1 308 . 11 1 1 A 34 34 LYS HA H 34 4.162 4.110 0.052 1
1 317 . 11 1 1 A 34 34 LYS C C 34 174.378 175.173 -0.795 1
1 318 . 11 1 1 A 34 34 LYS CA C 34 56.575 55.280 1.295 1
1 319 . 11 1 1 A 34 34 LYS CB C 34 36.918 33.451 3.467 1
1 323 . 11 1 1 A 34 34 LYS N N 34 121.659 117.629 4.030 1
1 324 . 11 1 1 A 35 35 LYS H H 35 8.137 7.108 1.029 1
1 325 . 11 1 1 A 35 35 LYS HA H 35 4.011 4.647 -0.636 1
1 334 . 11 1 1 A 35 35 LYS C C 35 174.343 174.835 -0.492 1
1 335 . 11 1 1 A 35 35 LYS CA C 35 53.960 54.430 -0.470 1
1 336 . 11 1 1 A 35 35 LYS CB C 35 35.587 35.740 -0.153 1
1 340 . 11 1 1 A 35 35 LYS N N 35 119.354 116.836 2.518 1
1 341 . 11 1 1 A 36 36 GLN H H 36 8.394 8.718 -0.324 1
1 342 . 11 1 1 A 36 36 GLN HA H 36 4.187 4.373 -0.186 1
1 349 . 11 1 1 A 36 36 GLN C C 36 177.012 176.662 0.350 1
1 350 . 11 1 1 A 36 36 GLN CA C 36 57.750 57.971 -0.221 1
1 351 . 11 1 1 A 36 36 GLN CB C 36 28.433 28.430 0.003 1
1 353 . 11 1 1 A 36 36 GLN N N 36 120.248 123.499 -3.251 1
1 355 . 11 1 1 A 37 37 GLY H H 37 9.597 9.228 0.369 1
1 356 . 11 1 1 A 37 37 GLY HA2 H 37 4.486 4.112 0.374 1
1 357 . 11 1 1 A 37 37 GLY HA3 H 37 3.926 4.113 -0.187 1
1 358 . 11 1 1 A 37 37 GLY C C 37 176.285 174.427 1.858 1
1 359 . 11 1 1 A 37 37 GLY CA C 37 46.146 45.335 0.811 1
1 360 . 11 1 1 A 37 37 GLY N N 37 116.637 114.757 1.880 1
1 361 . 11 1 1 A 38 38 ASP H H 38 8.925 7.994 0.931 1
1 362 . 11 1 1 A 38 38 ASP HA H 38 5.697 4.774 0.923 1
1 365 . 11 1 1 A 38 38 ASP C C 38 176.181 175.635 0.546 1
1 366 . 11 1 1 A 38 38 ASP CA C 38 55.066 55.585 -0.519 1
1 367 . 11 1 1 A 38 38 ASP CB C 38 42.933 41.293 1.640 1
1 368 . 11 1 1 A 38 38 ASP N N 38 127.293 121.956 5.337 1
1 369 . 11 1 1 A 39 39 PHE H H 39 8.647 8.213 0.434 1
1 370 . 11 1 1 A 39 39 PHE HA H 39 6.025 5.958 0.067 1
1 378 . 11 1 1 A 39 39 PHE C C 39 170.948 172.987 -2.039 1
1 379 . 11 1 1 A 39 39 PHE CA C 39 56.376 55.975 0.401 1
1 380 . 11 1 1 A 39 39 PHE CB C 39 44.583 43.172 1.411 1
1 386 . 11 1 1 A 39 39 PHE N N 39 117.102 119.858 -2.756 1
1 387 . 11 1 1 A 40 40 LEU H H 40 9.186 8.974 0.212 1
1 388 . 11 1 1 A 40 40 LEU HA H 40 4.983 5.150 -0.167 1
1 398 . 11 1 1 A 40 40 LEU C C 40 174.787 174.570 0.217 1
1 399 . 11 1 1 A 40 40 LEU CA C 40 54.610 53.657 0.953 1
1 400 . 11 1 1 A 40 40 LEU CB C 40 44.330 46.135 -1.805 1
1 404 . 11 1 1 A 40 40 LEU N N 40 114.388 118.051 -3.663 1
1 405 . 11 1 1 A 41 41 VAL H H 41 9.390 9.278 0.112 1
1 406 . 11 1 1 A 41 41 VAL HA H 41 5.742 5.036 0.706 1
1 414 . 11 1 1 A 41 41 VAL C C 41 172.760 175.094 -2.334 1
1 415 . 11 1 1 A 41 41 VAL CA C 41 60.814 61.679 -0.865 1
1 416 . 11 1 1 A 41 41 VAL CB C 41 34.908 33.286 1.622 1
1 419 . 11 1 1 A 41 41 VAL N N 41 119.873 122.872 -2.999 1
1 420 . 11 1 1 A 42 42 ARG H H 42 9.598 9.005 0.593 1
1 421 . 11 1 1 A 42 42 ARG HA H 42 5.247 5.309 -0.062 1
1 429 . 11 1 1 A 42 42 ARG C C 42 173.379 174.506 -1.127 1
1 430 . 11 1 1 A 42 42 ARG CA C 42 53.202 54.070 -0.868 1
1 431 . 11 1 1 A 42 42 ARG CB C 42 33.507 34.031 -0.524 1
1 434 . 11 1 1 A 42 42 ARG N N 42 124.179 124.482 -0.303 1
1 436 . 11 1 1 A 43 43 GLU H H 43 8.234 8.788 -0.554 1
1 437 . 11 1 1 A 43 43 GLU HA H 43 4.890 4.097 0.793 1
1 442 . 11 1 1 A 43 43 GLU C C 43 176.929 176.634 0.295 1
1 443 . 11 1 1 A 43 43 GLU CA C 43 54.846 56.294 -1.448 1
1 444 . 11 1 1 A 43 43 GLU CB C 43 31.599 30.354 1.245 1
1 446 . 11 1 1 A 43 43 GLU N N 43 124.103 123.362 0.741 1
1 447 . 11 1 1 A 44 44 SER H H 44 9.033 8.574 0.459 1
1 448 . 11 1 1 A 44 44 SER HA H 44 3.957 4.416 -0.459 1
1 451 . 11 1 1 A 44 44 SER C C 44 175.005 174.233 0.772 1
1 452 . 11 1 1 A 44 44 SER CA C 44 59.393 57.992 1.401 1
1 453 . 11 1 1 A 44 44 SER CB C 44 63.619 63.802 -0.183 1
1 454 . 11 1 1 A 44 44 SER N N 44 124.316 121.085 3.231 1
1 455 . 11 1 1 A 45 45 HIS H H 45 8.461 8.571 -0.110 1
1 456 . 11 1 1 A 45 45 HIS HA H 45 4.132 4.232 -0.100 1
1 460 . 11 1 1 A 45 45 HIS C C 45 176.480 176.289 0.191 1
1 461 . 11 1 1 A 45 45 HIS CA C 45 58.887 57.457 1.430 1
1 462 . 11 1 1 A 45 45 HIS CB C 45 30.180 29.439 0.741 1
1 464 . 11 1 1 A 45 45 HIS N N 45 127.694 125.998 1.696 1
1 465 . 11 1 1 A 46 46 GLY H H 46 8.513 8.782 -0.269 1
1 466 . 11 1 1 A 46 46 GLY HA2 H 46 3.827 3.713 0.114 1
1 467 . 11 1 1 A 46 46 GLY HA3 H 46 3.827 3.723 0.104 1
1 468 . 11 1 1 A 46 46 GLY C C 46 173.630 174.063 -0.433 1
1 469 . 11 1 1 A 46 46 GLY CA C 46 45.188 45.657 -0.469 1
1 470 . 11 1 1 A 46 46 GLY N N 46 110.761 114.546 -3.785 1
1 471 . 11 1 1 A 47 47 LYS H H 47 7.216 7.772 -0.556 1
1 472 . 11 1 1 A 47 47 LYS HA H 47 4.540 4.828 -0.288 1
1 481 . 11 1 1 A 47 47 LYS CA C 47 53.475 53.203 0.272 1
1 482 . 11 1 1 A 47 47 LYS CB C 47 33.325 33.581 -0.256 1
1 486 . 11 1 1 A 47 47 LYS N N 47 121.356 120.521 0.835 1
1 487 . 11 1 1 A 48 48 PRO HA H 48 4.181 4.279 -0.098 1
1 494 . 11 1 1 A 48 48 PRO C C 48 178.920 177.836 1.084 1
1 495 . 11 1 1 A 48 48 PRO CA C 48 63.239 63.994 -0.755 1
1 496 . 11 1 1 A 48 48 PRO CB C 48 31.523 31.368 0.155 1
1 499 . 11 1 1 A 49 49 GLY H H 49 9.752 8.724 1.028 1
1 500 . 11 1 1 A 49 49 GLY HA2 H 49 4.053 3.947 0.106 1
1 501 . 11 1 1 A 49 49 GLY HA3 H 49 3.374 4.072 -0.698 1
1 502 . 11 1 1 A 49 49 GLY C C 49 172.093 173.771 -1.678 1
1 503 . 11 1 1 A 49 49 GLY CA C 49 45.041 45.698 -0.657 1
1 504 . 11 1 1 A 49 49 GLY N N 49 112.415 112.824 -0.409 1
1 505 . 11 1 1 A 50 50 GLU H H 50 7.623 7.437 0.186 1
1 506 . 11 1 1 A 50 50 GLU HA H 50 4.537 4.973 -0.436 1
1 511 . 11 1 1 A 50 50 GLU C C 50 173.297 174.901 -1.604 1
1 512 . 11 1 1 A 50 50 GLU CA C 50 55.174 55.475 -0.301 1
1 513 . 11 1 1 A 50 50 GLU CB C 50 31.651 32.615 -0.964 1
1 515 . 11 1 1 A 50 50 GLU N N 50 121.600 119.840 1.760 1
1 516 . 11 1 1 A 51 51 TYR H H 51 9.452 9.249 0.203 1
1 517 . 11 1 1 A 51 51 TYR HA H 51 5.382 5.112 0.270 1
1 524 . 11 1 1 A 51 51 TYR C C 51 174.387 175.225 -0.838 1
1 525 . 11 1 1 A 51 51 TYR CA C 51 57.592 56.992 0.600 1
1 526 . 11 1 1 A 51 51 TYR CB C 51 41.820 41.076 0.744 1
1 531 . 11 1 1 A 51 51 TYR N N 51 125.790 126.879 -1.089 1
1 532 . 11 1 1 A 52 52 VAL H H 52 9.471 9.609 -0.138 1
1 533 . 11 1 1 A 52 52 VAL HA H 52 4.840 5.013 -0.173 1
1 541 . 11 1 1 A 52 52 VAL C C 52 174.947 175.144 -0.197 1
1 542 . 11 1 1 A 52 52 VAL CA C 52 60.991 61.342 -0.351 1
1 543 . 11 1 1 A 52 52 VAL CB C 52 36.829 34.032 2.797 1
1 546 . 11 1 1 A 52 52 VAL N N 52 120.617 122.347 -1.730 1
1 547 . 11 1 1 A 53 53 LEU H H 53 9.457 9.409 0.048 1
1 548 . 11 1 1 A 53 53 LEU HA H 53 5.294 5.138 0.156 1
1 558 . 11 1 1 A 53 53 LEU C C 53 175.024 174.873 0.151 1
1 559 . 11 1 1 A 53 53 LEU CA C 53 53.904 54.465 -0.561 1
1 560 . 11 1 1 A 53 53 LEU CB C 53 44.756 44.195 0.561 1
1 564 . 11 1 1 A 53 53 LEU N N 53 127.725 131.426 -3.701 1
1 565 . 11 1 1 A 54 54 SER H H 54 9.461 9.305 0.156 1
1 566 . 11 1 1 A 54 54 SER HA H 54 5.691 5.606 0.085 1
1 569 . 11 1 1 A 54 54 SER C C 54 172.227 173.337 -1.110 1
1 570 . 11 1 1 A 54 54 SER CA C 54 58.551 58.002 0.549 1
1 571 . 11 1 1 A 54 54 SER CB C 54 65.738 64.803 0.935 1
1 572 . 11 1 1 A 54 54 SER N N 54 127.178 124.850 2.328 1
1 573 . 11 1 1 A 55 55 VAL H H 55 9.049 8.886 0.163 1
1 574 . 11 1 1 A 55 55 VAL HA H 55 5.691 5.458 0.233 1
1 582 . 11 1 1 A 55 55 VAL C C 55 173.959 172.798 1.161 1
1 583 . 11 1 1 A 55 55 VAL CA C 55 58.398 59.808 -1.410 1
1 584 . 11 1 1 A 55 55 VAL CB C 55 36.262 36.009 0.253 1
1 587 . 11 1 1 A 55 55 VAL N N 55 120.619 124.310 -3.691 1
1 588 . 11 1 1 A 56 56 TYR H H 56 8.629 9.305 -0.676 1
1 589 . 11 1 1 A 56 56 TYR HA H 56 4.951 4.901 0.050 1
1 596 . 11 1 1 A 56 56 TYR C C 56 175.224 174.087 1.137 1
1 597 . 11 1 1 A 56 56 TYR CA C 56 56.684 56.525 0.159 1
1 598 . 11 1 1 A 56 56 TYR CB C 56 39.646 39.706 -0.060 1
1 603 . 11 1 1 A 56 56 TYR N N 56 127.444 129.739 -2.295 1
1 604 . 11 1 1 A 57 57 SER H H 57 8.869 8.955 -0.086 1
1 605 . 11 1 1 A 57 57 SER HA H 57 4.739 4.963 -0.224 1
1 608 . 11 1 1 A 57 57 SER C C 57 174.492 172.987 1.505 1
1 609 . 11 1 1 A 57 57 SER CA C 57 57.591 56.640 0.951 1
1 610 . 11 1 1 A 57 57 SER CB C 57 64.281 65.542 -1.261 1
1 611 . 11 1 1 A 57 57 SER N N 57 122.165 123.446 -1.281 1
1 612 . 11 1 1 A 58 58 ASP H H 58 10.446 9.498 0.948 1
1 613 . 11 1 1 A 58 58 ASP HA H 58 4.382 4.324 0.058 1
1 616 . 11 1 1 A 58 58 ASP C C 58 176.398 176.077 0.321 1
1 617 . 11 1 1 A 58 58 ASP CA C 58 55.215 55.269 -0.054 1
1 618 . 11 1 1 A 58 58 ASP CB C 58 39.513 39.160 0.353 1
1 619 . 11 1 1 A 58 58 ASP N N 58 132.098 128.881 3.217 1
1 620 . 11 1 1 A 59 59 GLY H H 59 7.861 7.963 -0.102 1
1 621 . 11 1 1 A 59 59 GLY HA2 H 59 3.817 3.800 0.017 1
1 622 . 11 1 1 A 59 59 GLY HA3 H 59 4.086 3.934 0.152 1
1 623 . 11 1 1 A 59 59 GLY C C 59 173.111 173.631 -0.520 1
1 624 . 11 1 1 A 59 59 GLY CA C 59 45.486 44.824 0.662 1
1 625 . 11 1 1 A 59 59 GLY N N 59 102.674 104.938 -2.264 1
1 626 . 11 1 1 A 60 60 GLN H H 60 7.137 7.563 -0.426 1
1 627 . 11 1 1 A 60 60 GLN HA H 60 4.455 4.355 0.100 1
1 634 . 11 1 1 A 60 60 GLN C C 60 173.549 175.162 -1.613 1
1 635 . 11 1 1 A 60 60 GLN CA C 60 53.388 54.775 -1.387 1
1 636 . 11 1 1 A 60 60 GLN CB C 60 32.373 30.027 2.346 1
1 638 . 11 1 1 A 60 60 GLN N N 60 116.206 119.514 -3.308 1
1 640 . 11 1 1 A 61 61 ARG H H 61 8.589 8.386 0.203 1
1 641 . 11 1 1 A 61 61 ARG HA H 61 4.740 4.582 0.158 1
1 649 . 11 1 1 A 61 61 ARG C C 61 174.458 174.759 -0.301 1
1 650 . 11 1 1 A 61 61 ARG CA C 61 57.116 55.301 1.815 1
1 651 . 11 1 1 A 61 61 ARG CB C 61 29.615 30.618 -1.003 1
1 654 . 11 1 1 A 61 61 ARG N N 61 120.467 122.405 -1.938 1
1 656 . 11 1 1 A 62 62 ARG H H 62 8.867 8.738 0.129 1
1 657 . 11 1 1 A 62 62 ARG HA H 62 4.297 4.180 0.117 1
1 665 . 11 1 1 A 62 62 ARG C C 62 173.485 175.377 -1.892 1
1 666 . 11 1 1 A 62 62 ARG CA C 62 53.355 55.892 -2.537 1
1 667 . 11 1 1 A 62 62 ARG CB C 62 33.028 31.137 1.891 1
1 670 . 11 1 1 A 62 62 ARG N N 62 122.641 124.457 -1.816 1
1 672 . 11 1 1 A 63 63 HIS H H 63 7.997 8.288 -0.291 1
1 673 . 11 1 1 A 63 63 HIS HA H 63 5.427 5.208 0.219 1
1 678 . 11 1 1 A 63 63 HIS C C 63 174.946 173.946 1.000 1
1 679 . 11 1 1 A 63 63 HIS CA C 63 54.689 54.156 0.533 1
1 680 . 11 1 1 A 63 63 HIS CB C 63 33.008 32.161 0.847 1
1 683 . 11 1 1 A 63 63 HIS N N 63 119.064 118.292 0.772 1
1 684 . 11 1 1 A 64 64 PHE H H 64 9.880 9.420 0.460 1
1 685 . 11 1 1 A 64 64 PHE HA H 64 4.824 5.051 -0.227 1
1 693 . 11 1 1 A 64 64 PHE C C 64 174.882 175.174 -0.292 1
1 694 . 11 1 1 A 64 64 PHE CA C 64 56.489 56.319 0.170 1
1 695 . 11 1 1 A 64 64 PHE CB C 64 41.405 42.456 -1.051 1
1 701 . 11 1 1 A 64 64 PHE N N 64 123.961 122.116 1.845 1
1 702 . 11 1 1 A 65 65 ILE H H 65 8.982 9.325 -0.343 1
1 703 . 11 1 1 A 65 65 ILE HA H 65 4.273 4.788 -0.515 1
1 713 . 11 1 1 A 65 65 ILE C C 65 176.556 175.158 1.398 1
1 714 . 11 1 1 A 65 65 ILE CA C 65 62.649 60.078 2.571 1
1 715 . 11 1 1 A 65 65 ILE CB C 65 38.296 40.280 -1.984 1
1 719 . 11 1 1 A 65 65 ILE N N 65 126.601 123.189 3.412 1
1 720 . 11 1 1 A 66 66 ILE H H 66 8.947 9.025 -0.078 1
1 721 . 11 1 1 A 66 66 ILE HA H 66 3.780 4.255 -0.475 1
1 731 . 11 1 1 A 66 66 ILE C C 66 175.721 175.490 0.231 1
1 732 . 11 1 1 A 66 66 ILE CA C 66 62.960 60.856 2.104 1
1 733 . 11 1 1 A 66 66 ILE CB C 66 37.209 38.524 -1.315 1
1 737 . 11 1 1 A 66 66 ILE N N 66 130.139 129.062 1.077 1
1 738 . 11 1 1 A 67 67 GLN H H 67 8.410 8.673 -0.263 1
1 739 . 11 1 1 A 67 67 GLN HA H 67 4.422 4.855 -0.433 1
1 746 . 11 1 1 A 67 67 GLN C C 67 174.347 174.037 0.310 1
1 747 . 11 1 1 A 67 67 GLN CA C 67 55.867 54.998 0.869 1
1 748 . 11 1 1 A 67 67 GLN CB C 67 29.950 30.558 -0.608 1
1 750 . 11 1 1 A 67 67 GLN N N 67 128.872 127.049 1.823 1
1 752 . 11 1 1 A 68 68 TYR H H 68 8.619 8.905 -0.286 1
1 753 . 11 1 1 A 68 68 TYR HA H 68 5.300 4.838 0.462 1
1 760 . 11 1 1 A 68 68 TYR C C 68 174.695 174.224 0.471 1
1 761 . 11 1 1 A 68 68 TYR CA C 68 55.579 56.401 -0.822 1
1 762 . 11 1 1 A 68 68 TYR CB C 68 39.479 38.776 0.703 1
1 767 . 11 1 1 A 68 68 TYR N N 68 124.772 125.307 -0.535 1
1 768 . 11 1 1 A 69 69 VAL H H 69 8.539 8.678 -0.139 1
1 769 . 11 1 1 A 69 69 VAL HA H 69 4.046 4.397 -0.351 1
1 777 . 11 1 1 A 69 69 VAL C C 69 175.010 175.050 -0.040 1
1 778 . 11 1 1 A 69 69 VAL CA C 69 60.611 60.749 -0.138 1
1 779 . 11 1 1 A 69 69 VAL CB C 69 35.358 34.216 1.142 1
1 782 . 11 1 1 A 69 69 VAL N N 69 126.652 127.162 -0.510 1
1 783 . 11 1 1 A 70 70 ASP H H 70 9.089 9.321 -0.232 1
1 784 . 11 1 1 A 70 70 ASP HA H 70 4.025 4.194 -0.169 1
1 787 . 11 1 1 A 70 70 ASP C C 70 174.813 175.127 -0.314 1
1 788 . 11 1 1 A 70 70 ASP CA C 70 55.623 55.456 0.167 1
1 789 . 11 1 1 A 70 70 ASP CB C 70 39.081 39.394 -0.313 1
1 790 . 11 1 1 A 70 70 ASP N N 70 128.327 127.948 0.379 1
1 791 . 11 1 1 A 71 71 ASN H H 71 8.128 8.135 -0.007 1
1 792 . 11 1 1 A 71 71 ASN HA H 71 3.597 3.304 0.293 1
1 797 . 11 1 1 A 71 71 ASN C C 71 173.250 173.444 -0.194 1
1 798 . 11 1 1 A 71 71 ASN CA C 71 54.728 54.139 0.589 1
1 799 . 11 1 1 A 71 71 ASN CB C 71 37.601 37.125 0.476 1
1 800 . 11 1 1 A 71 71 ASN N N 71 107.230 108.176 -0.946 1
1 802 . 11 1 1 A 72 72 MET H H 72 7.256 7.342 -0.086 1
1 803 . 11 1 1 A 72 72 MET HA H 72 4.740 4.774 -0.034 1
1 808 . 11 1 1 A 72 72 MET C C 72 173.780 174.467 -0.687 1
1 809 . 11 1 1 A 72 72 MET CA C 72 53.703 54.413 -0.710 1
1 810 . 11 1 1 A 72 72 MET CB C 72 36.570 36.630 -0.060 1
1 812 . 11 1 1 A 72 72 MET N N 72 117.117 116.801 0.316 1
1 813 . 11 1 1 A 73 73 TYR H H 73 9.430 9.235 0.195 1
1 814 . 11 1 1 A 73 73 TYR HA H 73 5.718 5.165 0.553 1
1 821 . 11 1 1 A 73 73 TYR C C 73 176.140 175.642 0.498 1
1 822 . 11 1 1 A 73 73 TYR CA C 73 57.290 57.354 -0.064 1
1 823 . 11 1 1 A 73 73 TYR CB C 73 40.013 39.925 0.088 1
1 828 . 11 1 1 A 73 73 TYR N N 73 119.856 121.215 -1.359 1
1 829 . 11 1 1 A 74 74 ARG H H 74 9.038 8.690 0.348 1
1 830 . 11 1 1 A 74 74 ARG HA H 74 4.867 5.066 -0.199 1
1 838 . 11 1 1 A 74 74 ARG C C 74 173.954 174.794 -0.840 1
1 839 . 11 1 1 A 74 74 ARG CA C 74 54.887 54.825 0.062 1
1 840 . 11 1 1 A 74 74 ARG CB C 74 34.484 33.974 0.510 1
1 843 . 11 1 1 A 74 74 ARG N N 74 117.344 120.698 -3.354 1
1 845 . 11 1 1 A 75 75 PHE H H 75 9.005 9.152 -0.147 1
1 846 . 11 1 1 A 75 75 PHE HA H 75 5.046 4.562 0.484 1
1 854 . 11 1 1 A 75 75 PHE C C 75 176.186 177.724 -1.538 1
1 855 . 11 1 1 A 75 75 PHE CA C 75 59.658 60.272 -0.614 1
1 856 . 11 1 1 A 75 75 PHE CB C 75 39.356 39.996 -0.640 1
1 862 . 11 1 1 A 75 75 PHE N N 75 117.865 121.576 -3.711 1
1 863 . 11 1 1 A 76 76 GLU H H 76 8.213 8.104 0.109 1
1 864 . 11 1 1 A 76 76 GLU HA H 76 4.586 4.211 0.375 1
1 869 . 11 1 1 A 76 76 GLU C C 76 175.238 177.255 -2.017 1
1 870 . 11 1 1 A 76 76 GLU CA C 76 55.994 58.636 -2.642 1
1 871 . 11 1 1 A 76 76 GLU CB C 76 31.805 30.695 1.110 1
1 873 . 11 1 1 A 76 76 GLU N N 76 116.834 118.580 -1.746 1
1 874 . 11 1 1 A 77 77 GLY H H 77 8.692 7.638 1.054 1
1 875 . 11 1 1 A 77 77 GLY HA2 H 77 4.166 4.032 0.134 1
1 876 . 11 1 1 A 77 77 GLY HA3 H 77 4.015 4.032 -0.017 1
1 877 . 11 1 1 A 77 77 GLY C C 77 173.784 174.948 -1.164 1
1 878 . 11 1 1 A 77 77 GLY CA C 77 45.505 45.520 -0.015 1
1 879 . 11 1 1 A 77 77 GLY N N 77 111.937 106.965 4.972 1
1 880 . 11 1 1 A 78 78 THR H H 78 8.332 7.728 0.604 1
1 881 . 11 1 1 A 78 78 THR HA H 78 3.900 4.173 -0.273 1
1 886 . 11 1 1 A 78 78 THR C C 78 173.591 174.615 -1.024 1
1 887 . 11 1 1 A 78 78 THR CA C 78 63.653 63.933 -0.280 1
1 888 . 11 1 1 A 78 78 THR CB C 78 69.649 69.297 0.352 1
1 890 . 11 1 1 A 78 78 THR N N 78 120.765 115.581 5.184 1
1 891 . 11 1 1 A 79 79 GLY H H 79 8.038 8.583 -0.545 1
1 892 . 11 1 1 A 79 79 GLY HA2 H 79 4.748 4.225 0.523 1
1 893 . 11 1 1 A 79 79 GLY HA3 H 79 3.546 4.367 -0.821 1
1 894 . 11 1 1 A 79 79 GLY C C 79 172.580 171.724 0.856 1
1 895 . 11 1 1 A 79 79 GLY CA C 79 44.661 44.031 0.630 1
1 896 . 11 1 1 A 79 79 GLY N N 79 109.887 114.358 -4.471 1
1 897 . 11 1 1 A 80 80 PHE H H 80 9.064 8.848 0.216 1
1 898 . 11 1 1 A 80 80 PHE HA H 80 4.886 4.865 0.021 1
1 906 . 11 1 1 A 80 80 PHE C C 80 176.507 176.031 0.476 1
1 907 . 11 1 1 A 80 80 PHE CA C 80 57.257 56.797 0.460 1
1 908 . 11 1 1 A 80 80 PHE CB C 80 44.655 42.765 1.890 1
1 914 . 11 1 1 A 80 80 PHE N N 80 116.862 122.756 -5.894 1
1 915 . 11 1 1 A 81 81 SER H H 81 9.413 9.022 0.391 1
1 916 . 11 1 1 A 81 81 SER HA H 81 4.622 4.426 0.196 1
1 919 . 11 1 1 A 81 81 SER C C 81 173.735 174.109 -0.374 1
1 920 . 11 1 1 A 81 81 SER CA C 81 61.410 60.013 1.397 1
1 921 . 11 1 1 A 81 81 SER CB C 81 64.165 63.547 0.618 1
1 922 . 11 1 1 A 81 81 SER N N 81 116.467 118.377 -1.910 1
1 923 . 11 1 1 A 82 82 ASN H H 82 7.688 7.951 -0.263 1
1 924 . 11 1 1 A 82 82 ASN HA H 82 4.952 5.198 -0.246 1
1 929 . 11 1 1 A 82 82 ASN C C 82 173.303 175.613 -2.310 1
1 930 . 11 1 1 A 82 82 ASN CA C 82 52.086 51.912 0.174 1
1 931 . 11 1 1 A 82 82 ASN CB C 82 41.258 40.690 0.568 1
1 932 . 11 1 1 A 82 82 ASN N N 82 113.355 116.900 -3.545 1
1 934 . 11 1 1 A 83 83 ILE H H 83 8.858 8.598 0.260 1
1 935 . 11 1 1 A 83 83 ILE HA H 83 3.571 3.769 -0.198 1
1 945 . 11 1 1 A 83 83 ILE CA C 83 66.416 65.278 1.138 1
1 946 . 11 1 1 A 83 83 ILE CB C 83 35.074 34.785 0.289 1
1 950 . 11 1 1 A 83 83 ILE N N 83 118.908 124.574 -5.666 1
1 951 . 11 1 1 A 84 84 PRO HA H 84 4.411 4.741 -0.330 1
1 958 . 11 1 1 A 84 84 PRO C C 84 177.616 179.458 -1.842 1
1 959 . 11 1 1 A 84 84 PRO CA C 84 67.525 66.535 0.990 1
1 960 . 11 1 1 A 84 84 PRO CB C 84 31.029 30.931 0.098 1
1 963 . 11 1 1 A 85 85 GLN H H 85 8.405 8.372 0.033 1
1 964 . 11 1 1 A 85 85 GLN HA H 85 3.874 3.998 -0.124 1
1 971 . 11 1 1 A 85 85 GLN C C 85 178.213 178.292 -0.079 1
1 972 . 11 1 1 A 85 85 GLN CA C 85 59.495 58.481 1.014 1
1 973 . 11 1 1 A 85 85 GLN CB C 85 29.270 28.084 1.186 1
1 975 . 11 1 1 A 85 85 GLN N N 85 115.597 117.219 -1.622 1
1 977 . 11 1 1 A 86 86 LEU H H 86 7.136 8.049 -0.913 1
1 978 . 11 1 1 A 86 86 LEU HA H 86 3.589 3.816 -0.227 1
1 988 . 11 1 1 A 86 86 LEU C C 86 177.728 178.519 -0.791 1
1 989 . 11 1 1 A 86 86 LEU CA C 86 58.136 58.413 -0.277 1
1 990 . 11 1 1 A 86 86 LEU CB C 86 42.290 41.679 0.611 1
1 994 . 11 1 1 A 86 86 LEU N N 86 121.840 122.014 -0.174 1
1 995 . 11 1 1 A 87 87 ILE H H 87 8.323 7.979 0.344 1
1 996 . 11 1 1 A 87 87 ILE HA H 87 3.415 3.358 0.057 1
1 1006 . 11 1 1 A 87 87 ILE C C 87 178.064 177.750 0.314 1
1 1007 . 11 1 1 A 87 87 ILE CA C 87 61.458 65.340 -3.882 1
1 1008 . 11 1 1 A 87 87 ILE CB C 87 34.561 37.169 -2.608 1
1 1012 . 11 1 1 A 87 87 ILE N N 87 118.117 119.632 -1.515 1
1 1013 . 11 1 1 A 88 88 ASP H H 88 8.805 8.437 0.368 1
1 1014 . 11 1 1 A 88 88 ASP HA H 88 4.548 4.336 0.212 1
1 1017 . 11 1 1 A 88 88 ASP C C 88 179.265 177.991 1.274 1
1 1018 . 11 1 1 A 88 88 ASP CA C 88 58.099 57.323 0.776 1
1 1019 . 11 1 1 A 88 88 ASP CB C 88 42.166 41.939 0.227 1
1 1020 . 11 1 1 A 88 88 ASP N N 88 119.143 120.670 -1.527 1
1 1021 . 11 1 1 A 89 89 HIS H H 89 8.113 8.059 0.054 1
1 1022 . 11 1 1 A 89 89 HIS HA H 89 4.225 4.222 0.003 1
1 1026 . 11 1 1 A 89 89 HIS C C 89 179.261 177.075 2.186 1
1 1027 . 11 1 1 A 89 89 HIS CA C 89 60.647 59.053 1.594 1
1 1028 . 11 1 1 A 89 89 HIS CB C 89 30.801 30.062 0.739 1
1 1030 . 11 1 1 A 89 89 HIS N N 89 119.595 119.011 0.584 1
1 1031 . 11 1 1 A 90 90 HIS H H 90 7.685 7.973 -0.288 1
1 1032 . 11 1 1 A 90 90 HIS HA H 90 3.628 4.141 -0.513 1
1 1036 . 11 1 1 A 90 90 HIS C C 90 178.454 177.563 0.891 1
1 1037 . 11 1 1 A 90 90 HIS CA C 90 61.797 60.163 1.634 1
1 1038 . 11 1 1 A 90 90 HIS CB C 90 28.165 29.722 -1.557 1
1 1040 . 11 1 1 A 90 90 HIS N N 90 120.061 117.659 2.402 1
1 1041 . 11 1 1 A 91 91 TYR H H 91 9.394 8.531 0.863 1
1 1042 . 11 1 1 A 91 91 TYR HA H 91 4.238 3.853 0.385 1
1 1049 . 11 1 1 A 91 91 TYR C C 91 176.443 177.363 -0.920 1
1 1050 . 11 1 1 A 91 91 TYR CA C 91 60.669 61.892 -1.223 1
1 1051 . 11 1 1 A 91 91 TYR CB C 91 39.169 38.770 0.399 1
1 1056 . 11 1 1 A 91 91 TYR N N 91 123.532 120.058 3.474 1
1 1057 . 11 1 1 A 92 92 THR H H 92 8.774 8.454 0.320 1
1 1058 . 11 1 1 A 92 92 THR HA H 92 3.866 4.035 -0.169 1
1 1063 . 11 1 1 A 92 92 THR C C 92 177.050 176.398 0.652 1
1 1064 . 11 1 1 A 92 92 THR CA C 92 65.240 65.204 0.036 1
1 1065 . 11 1 1 A 92 92 THR CB C 92 69.298 67.872 1.426 1
1 1067 . 11 1 1 A 92 92 THR N N 92 112.000 112.913 -0.913 1
1 1068 . 11 1 1 A 93 93 THR H H 93 7.617 7.536 0.081 1
1 1069 . 11 1 1 A 93 93 THR HA H 93 4.133 4.105 0.028 1
1 1074 . 11 1 1 A 93 93 THR C C 93 176.234 175.048 1.186 1
1 1075 . 11 1 1 A 93 93 THR CA C 93 63.527 62.977 0.550 1
1 1076 . 11 1 1 A 93 93 THR CB C 93 71.234 69.844 1.390 1
1 1078 . 11 1 1 A 93 93 THR N N 93 109.883 113.055 -3.172 1
1 1079 . 11 1 1 A 94 94 LYS H H 94 7.210 7.748 -0.538 1
1 1080 . 11 1 1 A 94 94 LYS HA H 94 3.830 3.788 0.042 1
1 1089 . 11 1 1 A 94 94 LYS C C 94 174.331 176.069 -1.738 1
1 1090 . 11 1 1 A 94 94 LYS CA C 94 56.776 57.355 -0.579 1
1 1091 . 11 1 1 A 94 94 LYS CB C 94 28.095 30.804 -2.709 1
1 1095 . 11 1 1 A 94 94 LYS N N 94 112.818 121.575 -8.757 1
1 1096 . 11 1 1 A 95 95 GLN H H 95 7.439 7.524 -0.085 1
1 1097 . 11 1 1 A 95 95 GLN HA H 95 4.216 4.554 -0.338 1
1 1104 . 11 1 1 A 95 95 GLN C C 95 179.087 175.852 3.235 1
1 1105 . 11 1 1 A 95 95 GLN CA C 95 56.378 55.404 0.974 1
1 1106 . 11 1 1 A 95 95 GLN CB C 95 28.542 30.345 -1.803 1
1 1108 . 11 1 1 A 95 95 GLN N N 95 117.860 119.580 -1.720 1
1 1110 . 11 1 1 A 96 96 VAL H H 96 8.520 8.632 -0.112 1
1 1111 . 11 1 1 A 96 96 VAL HA H 96 4.297 4.408 -0.111 1
1 1119 . 11 1 1 A 96 96 VAL C C 96 177.329 176.838 0.491 1
1 1120 . 11 1 1 A 96 96 VAL CA C 96 61.196 61.844 -0.648 1
1 1121 . 11 1 1 A 96 96 VAL CB C 96 32.735 33.306 -0.571 1
1 1124 . 11 1 1 A 96 96 VAL N N 96 124.208 122.341 1.867 1
1 1125 . 11 1 1 A 97 97 ILE H H 97 8.491 8.245 0.246 1
1 1126 . 11 1 1 A 97 97 ILE HA H 97 2.995 3.498 -0.503 1
1 1136 . 11 1 1 A 97 97 ILE CA C 97 62.066 63.242 -1.176 1
1 1137 . 11 1 1 A 97 97 ILE CB C 97 36.117 37.846 -1.729 1
1 1141 . 11 1 1 A 97 97 ILE N N 97 119.561 123.950 -4.389 1
1 1142 . 11 1 1 A 98 98 THR HA H 98 4.460 4.497 -0.037 1
1 1147 . 11 1 1 A 98 98 THR C C 98 174.335 174.907 -0.572 1
1 1148 . 11 1 1 A 98 98 THR CA C 98 58.244 59.894 -1.650 1
1 1149 . 11 1 1 A 98 98 THR CB C 98 73.056 70.625 2.431 1
1 1151 . 11 1 1 A 99 99 LYS H H 99 9.761 9.015 0.746 1
1 1152 . 11 1 1 A 99 99 LYS HA H 99 3.911 4.071 -0.160 1
1 1161 . 11 1 1 A 99 99 LYS C C 99 179.594 178.409 1.185 1
1 1162 . 11 1 1 A 99 99 LYS CA C 99 59.661 58.453 1.208 1
1 1163 . 11 1 1 A 99 99 LYS CB C 99 31.978 32.035 -0.057 1
1 1167 . 11 1 1 A 99 99 LYS N N 99 125.750 123.231 2.519 1
1 1168 . 11 1 1 A 100 100 LYS H H 100 8.910 7.615 1.295 1
1 1169 . 11 1 1 A 100 100 LYS HA H 100 4.024 4.208 -0.184 1
1 1178 . 11 1 1 A 100 100 LYS C C 100 178.060 176.885 1.175 1
1 1179 . 11 1 1 A 100 100 LYS CA C 100 58.642 58.507 0.135 1
1 1180 . 11 1 1 A 100 100 LYS CB C 100 32.750 32.390 0.360 1
1 1184 . 11 1 1 A 100 100 LYS N N 100 117.112 119.003 -1.891 1
1 1185 . 11 1 1 A 101 101 SER H H 101 7.721 7.702 0.019 1
1 1186 . 11 1 1 A 101 101 SER HA H 101 4.282 4.630 -0.348 1
1 1189 . 11 1 1 A 101 101 SER C C 101 176.403 175.382 1.021 1
1 1190 . 11 1 1 A 101 101 SER CA C 101 60.442 59.470 0.972 1
1 1191 . 11 1 1 A 101 101 SER CB C 101 63.775 64.892 -1.117 1
1 1192 . 11 1 1 A 101 101 SER N N 101 112.069 111.247 0.822 1
1 1193 . 11 1 1 A 102 102 GLY H H 102 8.038 8.516 -0.478 1
1 1194 . 11 1 1 A 102 102 GLY HA2 H 102 4.024 3.858 0.166 1
1 1195 . 11 1 1 A 102 102 GLY HA3 H 102 3.713 3.882 -0.169 1
1 1196 . 11 1 1 A 102 102 GLY C C 102 173.991 174.671 -0.680 1
1 1197 . 11 1 1 A 102 102 GLY CA C 102 46.458 45.882 0.576 1
1 1198 . 11 1 1 A 102 102 GLY N N 102 111.144 108.851 2.293 1
1 1199 . 11 1 1 A 103 103 VAL H H 103 7.155 7.866 -0.711 1
1 1200 . 11 1 1 A 103 103 VAL HA H 103 3.652 4.001 -0.349 1
1 1208 . 11 1 1 A 103 103 VAL C C 103 173.805 174.966 -1.161 1
1 1209 . 11 1 1 A 103 103 VAL CA C 103 64.310 62.863 1.447 1
1 1210 . 11 1 1 A 103 103 VAL CB C 103 32.254 31.875 0.379 1
1 1213 . 11 1 1 A 103 103 VAL N N 103 119.836 121.756 -1.920 1
1 1214 . 11 1 1 A 104 104 VAL H H 104 7.653 9.080 -1.427 1
1 1215 . 11 1 1 A 104 104 VAL HA H 104 4.048 4.456 -0.408 1
1 1223 . 11 1 1 A 104 104 VAL C C 104 175.708 174.811 0.897 1
1 1224 . 11 1 1 A 104 104 VAL CA C 104 60.275 61.027 -0.752 1
1 1225 . 11 1 1 A 104 104 VAL CB C 104 35.112 33.660 1.452 1
1 1228 . 11 1 1 A 104 104 VAL N N 104 125.859 128.637 -2.778 1
1 1229 . 11 1 1 A 105 105 LEU H H 105 8.616 8.262 0.354 1
1 1230 . 11 1 1 A 105 105 LEU HA H 105 3.905 4.418 -0.513 1
1 1240 . 11 1 1 A 105 105 LEU C C 105 175.380 175.918 -0.538 1
1 1241 . 11 1 1 A 105 105 LEU CA C 105 54.471 54.007 0.464 1
1 1242 . 11 1 1 A 105 105 LEU CB C 105 39.821 40.811 -0.990 1
1 1246 . 11 1 1 A 105 105 LEU N N 105 123.839 126.970 -3.131 1
1 1247 . 11 1 1 A 106 106 LEU H H 106 8.894 8.609 0.285 1
1 1248 . 11 1 1 A 106 106 LEU HA H 106 4.839 5.217 -0.378 1
1 1258 . 11 1 1 A 106 106 LEU C C 106 176.930 176.023 0.907 1
1 1259 . 11 1 1 A 106 106 LEU CA C 106 56.288 53.125 3.163 1
1 1260 . 11 1 1 A 106 106 LEU CB C 106 45.237 45.505 -0.268 1
1 1264 . 11 1 1 A 106 106 LEU N N 106 120.590 121.769 -1.179 1
1 1265 . 11 1 1 A 107 107 ASN H H 107 8.124 9.007 -0.883 1
1 1266 . 11 1 1 A 107 107 ASN HA H 107 5.650 4.287 1.363 1
1 1271 . 11 1 1 A 107 107 ASN CA C 107 50.293 53.931 -3.638 1
1 1272 . 11 1 1 A 107 107 ASN CB C 107 41.223 37.167 4.056 1
1 1273 . 11 1 1 A 107 107 ASN N N 107 116.866 116.277 0.589 1
1 1275 . 11 1 1 A 108 108 PRO HA H 108 2.926 3.961 -1.035 1
1 1282 . 11 1 1 A 108 108 PRO C C 108 176.671 176.313 0.358 1
1 1283 . 11 1 1 A 108 108 PRO CA C 108 60.804 62.263 -1.459 1
1 1284 . 11 1 1 A 108 108 PRO CB C 108 31.774 30.401 1.373 1
1 1287 . 11 1 1 A 109 109 ILE H H 109 8.648 7.485 1.163 1
1 1288 . 11 1 1 A 109 109 ILE HA H 109 4.519 4.269 0.250 1
1 1298 . 11 1 1 A 109 109 ILE CA C 109 55.070 59.787 -4.717 1
1 1299 . 11 1 1 A 109 109 ILE CB C 109 36.068 38.265 -2.197 1
1 1303 . 11 1 1 A 109 109 ILE N N 109 128.817 123.850 4.967 1
1 1304 . 11 1 1 A 110 110 PRO HA H 110 4.587 4.460 0.127 1
1 1311 . 11 1 1 A 110 110 PRO C C 110 177.013 176.489 0.524 1
1 1312 . 11 1 1 A 110 110 PRO CA C 110 61.850 62.821 -0.971 1
1 1313 . 11 1 1 A 110 110 PRO CB C 110 32.507 32.002 0.505 1
1 1316 . 11 1 1 A 111 111 LYS H H 111 8.038 8.073 -0.035 1
1 1317 . 11 1 1 A 111 111 LYS HA H 111 3.553 3.498 0.055 1
1 1326 . 11 1 1 A 111 111 LYS C C 111 176.123 175.684 0.439 1
1 1327 . 11 1 1 A 111 111 LYS CA C 111 56.220 54.984 1.236 1
1 1328 . 11 1 1 A 111 111 LYS CB C 111 32.373 32.834 -0.461 1
1 1332 . 11 1 1 A 111 111 LYS N N 111 120.147 118.294 1.853 1
1 1333 . 11 1 1 A 112 112 ASP H H 112 8.463 8.298 0.165 1
1 1334 . 11 1 1 A 112 112 ASP HA H 112 4.523 4.850 -0.327 1
1 1337 . 11 1 1 A 112 112 ASP C C 112 175.986 175.405 0.581 1
1 1338 . 11 1 1 A 112 112 ASP CA C 112 54.256 52.122 2.134 1
1 1339 . 11 1 1 A 112 112 ASP CB C 112 41.563 42.388 -0.825 1
1 1340 . 11 1 1 A 112 112 ASP N N 112 121.863 119.672 2.191 1
1 1341 . 11 1 1 A 113 113 LYS H H 113 8.059 8.326 -0.267 1
1 1342 . 11 1 1 A 113 113 LYS HA H 113 4.136 4.177 -0.041 1
1 1351 . 11 1 1 A 113 113 LYS C C 113 176.010 175.017 0.993 1
1 1352 . 11 1 1 A 113 113 LYS CA C 113 56.253 55.540 0.713 1
1 1353 . 11 1 1 A 113 113 LYS CB C 113 32.754 30.811 1.943 1
1 1357 . 11 1 1 A 113 113 LYS N N 113 121.725 119.620 2.105 1
1 1358 . 11 1 1 A 114 114 LYS H H 114 8.225 8.251 -0.026 1
1 1359 . 11 1 1 A 114 114 LYS HA H 114 4.169 4.470 -0.301 1
1 1368 . 11 1 1 A 114 114 LYS C C 114 176.198 176.247 -0.049 1
1 1369 . 11 1 1 A 114 114 LYS CA C 114 56.413 55.772 0.641 1
1 1370 . 11 1 1 A 114 114 LYS CB C 114 32.725 32.224 0.501 1
1 1374 . 11 1 1 A 114 114 LYS N N 114 121.857 123.775 -1.918 1
1 1375 . 11 1 1 A 115 115 TRP H H 115 8.078 8.080 -0.002 1
1 1376 . 11 1 1 A 115 115 TRP HA H 115 4.709 4.857 -0.148 1
1 1385 . 11 1 1 A 115 115 TRP C C 115 175.119 176.303 -1.184 1
1 1386 . 11 1 1 A 115 115 TRP CA C 115 56.856 56.585 0.271 1
1 1387 . 11 1 1 A 115 115 TRP CB C 115 29.474 29.584 -0.110 1
1 1393 . 11 1 1 A 115 115 TRP N N 115 122.068 126.574 -4.506 1
1 1 . 12 1 1 A 10 10 HIS HA H 10 4.616 4.792 -0.176 1
1 4 . 12 1 1 A 10 10 HIS C C 10 174.981 173.733 1.248 1
1 5 . 12 1 1 A 10 10 HIS CA C 10 56.555 56.350 0.205 1
1 6 . 12 1 1 A 10 10 HIS CB C 10 30.231 32.285 -2.054 1
1 7 . 12 1 1 A 11 11 MET H H 11 8.103 8.577 -0.474 1
1 8 . 12 1 1 A 11 11 MET HA H 11 4.439 4.293 0.146 1
1 13 . 12 1 1 A 11 11 MET C C 11 175.888 176.349 -0.461 1
1 14 . 12 1 1 A 11 11 MET CA C 11 55.090 55.534 -0.444 1
1 15 . 12 1 1 A 11 11 MET CB C 11 33.121 32.371 0.750 1
1 17 . 12 1 1 A 11 11 MET N N 11 120.743 127.567 -6.824 1
1 18 . 12 1 1 A 12 12 LYS H H 12 8.065 8.533 -0.468 1
1 19 . 12 1 1 A 12 12 LYS HA H 12 4.407 4.667 -0.260 1
1 28 . 12 1 1 A 12 12 LYS CA C 12 54.894 53.838 1.056 1
1 29 . 12 1 1 A 12 12 LYS CB C 12 31.863 31.934 -0.071 1
1 33 . 12 1 1 A 12 12 LYS N N 12 123.187 124.044 -0.857 1
1 34 . 12 1 1 A 13 13 PRO HA H 13 4.347 4.481 -0.134 1
1 41 . 12 1 1 A 13 13 PRO C C 13 176.891 177.631 -0.740 1
1 42 . 12 1 1 A 13 13 PRO CA C 13 62.542 62.502 0.040 1
1 43 . 12 1 1 A 13 13 PRO CB C 13 32.663 32.539 0.124 1
1 46 . 12 1 1 A 14 14 LEU H H 14 8.339 8.769 -0.430 1
1 47 . 12 1 1 A 14 14 LEU HA H 14 3.373 3.898 -0.525 1
1 57 . 12 1 1 A 14 14 LEU C C 14 176.683 178.118 -1.435 1
1 58 . 12 1 1 A 14 14 LEU CA C 14 58.555 57.674 0.881 1
1 59 . 12 1 1 A 14 14 LEU CB C 14 41.828 41.018 0.810 1
1 63 . 12 1 1 A 14 14 LEU N N 14 123.191 124.253 -1.062 1
1 64 . 12 1 1 A 15 15 ALA H H 15 8.175 8.055 0.120 1
1 65 . 12 1 1 A 15 15 ALA HA H 15 3.983 4.112 -0.129 1
1 69 . 12 1 1 A 15 15 ALA C C 15 178.697 178.498 0.199 1
1 70 . 12 1 1 A 15 15 ALA CA C 15 54.164 54.640 -0.476 1
1 71 . 12 1 1 A 15 15 ALA CB C 15 18.771 18.160 0.611 1
1 72 . 12 1 1 A 15 15 ALA N N 15 113.594 119.705 -6.111 1
1 73 . 12 1 1 A 16 16 GLU H H 16 7.458 7.618 -0.160 1
1 74 . 12 1 1 A 16 16 GLU HA H 16 4.266 4.315 -0.049 1
1 79 . 12 1 1 A 16 16 GLU C C 16 176.510 177.098 -0.588 1
1 80 . 12 1 1 A 16 16 GLU CA C 16 55.196 57.714 -2.518 1
1 81 . 12 1 1 A 16 16 GLU CB C 16 30.907 30.132 0.775 1
1 83 . 12 1 1 A 16 16 GLU N N 16 113.348 115.401 -2.053 1
1 84 . 12 1 1 A 17 17 GLN H H 17 7.501 6.859 0.642 1
1 85 . 12 1 1 A 17 17 GLN HA H 17 3.683 3.980 -0.297 1
1 92 . 12 1 1 A 17 17 GLN C C 17 178.053 176.042 2.011 1
1 93 . 12 1 1 A 17 17 GLN CA C 17 54.606 55.561 -0.955 1
1 94 . 12 1 1 A 17 17 GLN CB C 17 25.758 28.317 -2.559 1
1 96 . 12 1 1 A 17 17 GLN N N 17 119.411 119.226 0.185 1
1 98 . 12 1 1 A 18 18 ASP H H 18 8.949 8.479 0.470 1
1 99 . 12 1 1 A 18 18 ASP HA H 18 4.184 4.153 0.031 1
1 102 . 12 1 1 A 18 18 ASP C C 18 175.263 178.241 -2.978 1
1 103 . 12 1 1 A 18 18 ASP CA C 18 57.275 56.961 0.314 1
1 104 . 12 1 1 A 18 18 ASP CB C 18 40.620 40.258 0.362 1
1 105 . 12 1 1 A 18 18 ASP N N 18 124.676 123.525 1.151 1
1 106 . 12 1 1 A 19 19 TRP H H 19 6.068 7.153 -1.085 1
1 107 . 12 1 1 A 19 19 TRP HA H 19 5.045 4.813 0.232 1
1 116 . 12 1 1 A 19 19 TRP C C 19 175.902 176.467 -0.565 1
1 117 . 12 1 1 A 19 19 TRP CA C 19 53.542 57.662 -4.120 1
1 118 . 12 1 1 A 19 19 TRP CB C 19 29.179 28.773 0.406 1
1 124 . 12 1 1 A 19 19 TRP N N 19 107.757 118.210 -10.453 1
1 126 . 12 1 1 A 20 20 TYR H H 20 7.430 7.555 -0.125 1
1 127 . 12 1 1 A 20 20 TYR HA H 20 5.601 5.384 0.217 1
1 132 . 12 1 1 A 20 20 TYR C C 20 175.498 176.008 -0.510 1
1 133 . 12 1 1 A 20 20 TYR CA C 20 56.967 56.961 0.006 1
1 134 . 12 1 1 A 20 20 TYR CB C 20 39.083 38.565 0.518 1
1 137 . 12 1 1 A 20 20 TYR N N 20 123.173 121.879 1.294 1
1 138 . 12 1 1 A 21 21 HIS H H 21 8.934 8.974 -0.040 1
1 139 . 12 1 1 A 21 21 HIS HA H 21 4.295 4.434 -0.139 1
1 144 . 12 1 1 A 21 21 HIS C C 21 175.177 175.012 0.165 1
1 145 . 12 1 1 A 21 21 HIS CA C 21 56.572 56.157 0.415 1
1 146 . 12 1 1 A 21 21 HIS CB C 21 33.365 30.170 3.195 1
1 149 . 12 1 1 A 21 21 HIS N N 21 125.732 127.496 -1.764 1
1 150 . 12 1 1 A 22 22 GLY H H 22 5.280 6.854 -1.574 1
1 151 . 12 1 1 A 22 22 GLY HA2 H 22 3.905 3.328 0.577 1
1 152 . 12 1 1 A 22 22 GLY HA3 H 22 3.585 3.670 -0.085 1
1 153 . 12 1 1 A 22 22 GLY C C 22 174.411 174.117 0.294 1
1 154 . 12 1 1 A 22 22 GLY CA C 22 46.402 45.688 0.714 1
1 155 . 12 1 1 A 22 22 GLY N N 22 104.568 106.416 -1.848 1
1 156 . 12 1 1 A 23 23 ALA H H 23 8.768 8.361 0.407 1
1 157 . 12 1 1 A 23 23 ALA HA H 23 5.171 4.530 0.641 1
1 161 . 12 1 1 A 23 23 ALA C C 23 177.180 176.763 0.417 1
1 162 . 12 1 1 A 23 23 ALA CA C 23 51.153 50.745 0.408 1
1 163 . 12 1 1 A 23 23 ALA CB C 23 16.999 18.403 -1.404 1
1 164 . 12 1 1 A 23 23 ALA N N 23 130.297 126.686 3.611 1
1 165 . 12 1 1 A 24 24 ILE H H 24 7.267 7.975 -0.708 1
1 166 . 12 1 1 A 24 24 ILE HA H 24 4.460 4.784 -0.324 1
1 176 . 12 1 1 A 24 24 ILE CA C 24 58.529 58.724 -0.195 1
1 177 . 12 1 1 A 24 24 ILE CB C 24 38.763 38.724 0.039 1
1 181 . 12 1 1 A 24 24 ILE N N 24 118.903 118.491 0.412 1
1 182 . 12 1 1 A 25 25 PRO HA H 25 4.224 4.484 -0.260 1
1 189 . 12 1 1 A 25 25 PRO C C 25 176.918 177.602 -0.684 1
1 190 . 12 1 1 A 25 25 PRO CA C 25 62.907 62.715 0.192 1
1 191 . 12 1 1 A 25 25 PRO CB C 25 32.671 32.544 0.127 1
1 194 . 12 1 1 A 26 26 ARG H H 26 8.781 9.111 -0.330 1
1 195 . 12 1 1 A 26 26 ARG HA H 26 3.472 3.897 -0.425 1
1 202 . 12 1 1 A 26 26 ARG C C 26 178.112 178.007 0.105 1
1 203 . 12 1 1 A 26 26 ARG CA C 26 60.863 59.471 1.392 1
1 204 . 12 1 1 A 26 26 ARG CB C 26 30.314 29.817 0.497 1
1 207 . 12 1 1 A 26 26 ARG N N 26 124.635 121.658 2.977 1
1 208 . 12 1 1 A 27 27 ILE H H 27 8.540 8.146 0.394 1
1 209 . 12 1 1 A 27 27 ILE HA H 27 3.787 3.689 0.098 1
1 219 . 12 1 1 A 27 27 ILE C C 27 177.390 177.588 -0.198 1
1 220 . 12 1 1 A 27 27 ILE CA C 27 64.329 64.813 -0.484 1
1 221 . 12 1 1 A 27 27 ILE CB C 27 37.413 38.003 -0.590 1
1 225 . 12 1 1 A 27 27 ILE N N 27 115.859 120.007 -4.148 1
1 226 . 12 1 1 A 28 28 GLU H H 28 6.953 8.495 -1.542 1
1 227 . 12 1 1 A 28 28 GLU HA H 28 4.067 4.041 0.026 1
1 232 . 12 1 1 A 28 28 GLU C C 28 179.006 179.470 -0.464 1
1 233 . 12 1 1 A 28 28 GLU CA C 28 58.985 59.481 -0.496 1
1 234 . 12 1 1 A 28 28 GLU CB C 28 29.316 29.043 0.273 1
1 236 . 12 1 1 A 28 28 GLU N N 28 120.554 119.438 1.116 1
1 237 . 12 1 1 A 29 29 ALA H H 29 7.999 7.897 0.102 1
1 238 . 12 1 1 A 29 29 ALA HA H 29 3.822 3.988 -0.166 1
1 242 . 12 1 1 A 29 29 ALA C C 29 178.809 179.631 -0.822 1
1 243 . 12 1 1 A 29 29 ALA CA C 29 54.698 55.512 -0.814 1
1 244 . 12 1 1 A 29 29 ALA CB C 29 18.059 18.271 -0.212 1
1 245 . 12 1 1 A 29 29 ALA N N 29 120.122 122.744 -2.622 1
1 246 . 12 1 1 A 30 30 GLN H H 30 8.168 8.268 -0.100 1
1 247 . 12 1 1 A 30 30 GLN HA H 30 3.811 4.125 -0.314 1
1 254 . 12 1 1 A 30 30 GLN C C 30 177.578 177.737 -0.159 1
1 255 . 12 1 1 A 30 30 GLN CA C 30 59.731 58.678 1.053 1
1 256 . 12 1 1 A 30 30 GLN CB C 30 28.161 27.990 0.171 1
1 258 . 12 1 1 A 30 30 GLN N N 30 112.109 116.398 -4.289 1
1 260 . 12 1 1 A 31 31 GLU H H 31 7.248 8.141 -0.893 1
1 261 . 12 1 1 A 31 31 GLU HA H 31 4.063 4.091 -0.028 1
1 266 . 12 1 1 A 31 31 GLU C C 31 177.423 178.632 -1.209 1
1 267 . 12 1 1 A 31 31 GLU CA C 31 57.650 59.026 -1.376 1
1 268 . 12 1 1 A 31 31 GLU CB C 31 29.757 29.315 0.442 1
1 270 . 12 1 1 A 31 31 GLU N N 31 115.340 119.484 -4.144 1
1 271 . 12 1 1 A 32 32 LEU H H 32 7.169 7.673 -0.504 1
1 272 . 12 1 1 A 32 32 LEU HA H 32 4.087 4.504 -0.417 1
1 282 . 12 1 1 A 32 32 LEU C C 32 175.850 176.838 -0.988 1
1 283 . 12 1 1 A 32 32 LEU CA C 32 55.580 55.403 0.177 1
1 284 . 12 1 1 A 32 32 LEU CB C 32 42.910 42.271 0.639 1
1 288 . 12 1 1 A 32 32 LEU N N 32 116.367 113.537 2.830 1
1 289 . 12 1 1 A 33 33 LEU H H 33 7.062 7.604 -0.542 1
1 290 . 12 1 1 A 33 33 LEU HA H 33 4.431 4.436 -0.005 1
1 300 . 12 1 1 A 33 33 LEU C C 33 174.837 177.232 -2.395 1
1 301 . 12 1 1 A 33 33 LEU CA C 33 53.521 54.283 -0.762 1
1 302 . 12 1 1 A 33 33 LEU CB C 33 43.301 41.423 1.878 1
1 306 . 12 1 1 A 33 33 LEU N N 33 118.568 122.066 -3.498 1
1 307 . 12 1 1 A 34 34 LYS H H 34 8.749 8.561 0.188 1
1 308 . 12 1 1 A 34 34 LYS HA H 34 4.162 4.230 -0.068 1
1 317 . 12 1 1 A 34 34 LYS C C 34 174.378 174.885 -0.507 1
1 318 . 12 1 1 A 34 34 LYS CA C 34 56.575 55.969 0.606 1
1 319 . 12 1 1 A 34 34 LYS CB C 34 36.918 34.524 2.394 1
1 323 . 12 1 1 A 34 34 LYS N N 34 121.659 117.953 3.706 1
1 324 . 12 1 1 A 35 35 LYS H H 35 8.137 7.460 0.677 1
1 325 . 12 1 1 A 35 35 LYS HA H 35 4.011 4.662 -0.651 1
1 334 . 12 1 1 A 35 35 LYS C C 35 174.343 175.029 -0.686 1
1 335 . 12 1 1 A 35 35 LYS CA C 35 53.960 54.143 -0.183 1
1 336 . 12 1 1 A 35 35 LYS CB C 35 35.587 35.575 0.012 1
1 340 . 12 1 1 A 35 35 LYS N N 35 119.354 116.188 3.166 1
1 341 . 12 1 1 A 36 36 GLN H H 36 8.394 8.635 -0.241 1
1 342 . 12 1 1 A 36 36 GLN HA H 36 4.187 4.500 -0.313 1
1 349 . 12 1 1 A 36 36 GLN C C 36 177.012 176.680 0.332 1
1 350 . 12 1 1 A 36 36 GLN CA C 36 57.750 57.904 -0.154 1
1 351 . 12 1 1 A 36 36 GLN CB C 36 28.433 28.433 0.000 1
1 353 . 12 1 1 A 36 36 GLN N N 36 120.248 122.960 -2.712 1
1 355 . 12 1 1 A 37 37 GLY H H 37 9.597 8.787 0.810 1
1 356 . 12 1 1 A 37 37 GLY HA2 H 37 4.486 4.106 0.380 1
1 357 . 12 1 1 A 37 37 GLY HA3 H 37 3.926 4.119 -0.193 1
1 358 . 12 1 1 A 37 37 GLY C C 37 176.285 174.492 1.793 1
1 359 . 12 1 1 A 37 37 GLY CA C 37 46.146 45.425 0.721 1
1 360 . 12 1 1 A 37 37 GLY N N 37 116.637 114.674 1.963 1
1 361 . 12 1 1 A 38 38 ASP H H 38 8.925 7.880 1.045 1
1 362 . 12 1 1 A 38 38 ASP HA H 38 5.697 4.682 1.015 1
1 365 . 12 1 1 A 38 38 ASP C C 38 176.181 175.724 0.457 1
1 366 . 12 1 1 A 38 38 ASP CA C 38 55.066 55.487 -0.421 1
1 367 . 12 1 1 A 38 38 ASP CB C 38 42.933 41.223 1.710 1
1 368 . 12 1 1 A 38 38 ASP N N 38 127.293 122.050 5.243 1
1 369 . 12 1 1 A 39 39 PHE H H 39 8.647 8.437 0.210 1
1 370 . 12 1 1 A 39 39 PHE HA H 39 6.025 5.949 0.076 1
1 378 . 12 1 1 A 39 39 PHE C C 39 170.948 173.050 -2.102 1
1 379 . 12 1 1 A 39 39 PHE CA C 39 56.376 56.159 0.217 1
1 380 . 12 1 1 A 39 39 PHE CB C 39 44.583 42.781 1.802 1
1 386 . 12 1 1 A 39 39 PHE N N 39 117.102 119.233 -2.131 1
1 387 . 12 1 1 A 40 40 LEU H H 40 9.186 9.017 0.169 1
1 388 . 12 1 1 A 40 40 LEU HA H 40 4.983 5.129 -0.146 1
1 398 . 12 1 1 A 40 40 LEU C C 40 174.787 174.467 0.320 1
1 399 . 12 1 1 A 40 40 LEU CA C 40 54.610 53.823 0.787 1
1 400 . 12 1 1 A 40 40 LEU CB C 40 44.330 45.913 -1.583 1
1 404 . 12 1 1 A 40 40 LEU N N 40 114.388 117.810 -3.422 1
1 405 . 12 1 1 A 41 41 VAL H H 41 9.390 9.560 -0.170 1
1 406 . 12 1 1 A 41 41 VAL HA H 41 5.742 5.090 0.652 1
1 414 . 12 1 1 A 41 41 VAL C C 41 172.760 175.226 -2.466 1
1 415 . 12 1 1 A 41 41 VAL CA C 41 60.814 61.516 -0.702 1
1 416 . 12 1 1 A 41 41 VAL CB C 41 34.908 33.447 1.461 1
1 419 . 12 1 1 A 41 41 VAL N N 41 119.873 121.803 -1.930 1
1 420 . 12 1 1 A 42 42 ARG H H 42 9.598 9.318 0.280 1
1 421 . 12 1 1 A 42 42 ARG HA H 42 5.247 5.512 -0.265 1
1 429 . 12 1 1 A 42 42 ARG C C 42 173.379 174.033 -0.654 1
1 430 . 12 1 1 A 42 42 ARG CA C 42 53.202 53.772 -0.570 1
1 431 . 12 1 1 A 42 42 ARG CB C 42 33.507 34.061 -0.554 1
1 434 . 12 1 1 A 42 42 ARG N N 42 124.179 124.786 -0.607 1
1 436 . 12 1 1 A 43 43 GLU H H 43 8.234 8.940 -0.706 1
1 437 . 12 1 1 A 43 43 GLU HA H 43 4.890 4.865 0.025 1
1 442 . 12 1 1 A 43 43 GLU C C 43 176.929 175.669 1.260 1
1 443 . 12 1 1 A 43 43 GLU CA C 43 54.846 54.529 0.317 1
1 444 . 12 1 1 A 43 43 GLU CB C 43 31.599 33.009 -1.410 1
1 446 . 12 1 1 A 43 43 GLU N N 43 124.103 121.206 2.897 1
1 447 . 12 1 1 A 44 44 SER H H 44 9.033 8.928 0.105 1
1 448 . 12 1 1 A 44 44 SER HA H 44 3.957 4.448 -0.491 1
1 451 . 12 1 1 A 44 44 SER C C 44 175.005 175.583 -0.578 1
1 452 . 12 1 1 A 44 44 SER CA C 44 59.393 57.538 1.855 1
1 453 . 12 1 1 A 44 44 SER CB C 44 63.619 64.274 -0.655 1
1 454 . 12 1 1 A 44 44 SER N N 44 124.316 120.630 3.686 1
1 455 . 12 1 1 A 45 45 HIS H H 45 8.461 8.740 -0.279 1
1 456 . 12 1 1 A 45 45 HIS HA H 45 4.132 4.157 -0.025 1
1 460 . 12 1 1 A 45 45 HIS C C 45 176.480 178.133 -1.653 1
1 461 . 12 1 1 A 45 45 HIS CA C 45 58.887 58.714 0.173 1
1 462 . 12 1 1 A 45 45 HIS CB C 45 30.180 29.291 0.889 1
1 464 . 12 1 1 A 45 45 HIS N N 45 127.694 126.425 1.269 1
1 465 . 12 1 1 A 46 46 GLY H H 46 8.513 8.192 0.321 1
1 466 . 12 1 1 A 46 46 GLY HA2 H 46 3.827 3.905 -0.078 1
1 467 . 12 1 1 A 46 46 GLY HA3 H 46 3.827 3.912 -0.085 1
1 468 . 12 1 1 A 46 46 GLY C C 46 173.630 174.441 -0.811 1
1 469 . 12 1 1 A 46 46 GLY CA C 46 45.188 46.999 -1.811 1
1 470 . 12 1 1 A 46 46 GLY N N 46 110.761 106.974 3.787 1
1 471 . 12 1 1 A 47 47 LYS H H 47 7.216 7.741 -0.525 1
1 472 . 12 1 1 A 47 47 LYS HA H 47 4.540 4.742 -0.202 1
1 481 . 12 1 1 A 47 47 LYS CA C 47 53.475 52.880 0.595 1
1 482 . 12 1 1 A 47 47 LYS CB C 47 33.325 34.016 -0.691 1
1 486 . 12 1 1 A 47 47 LYS N N 47 121.356 120.100 1.256 1
1 487 . 12 1 1 A 48 48 PRO HA H 48 4.181 4.268 -0.087 1
1 494 . 12 1 1 A 48 48 PRO C C 48 178.920 177.559 1.361 1
1 495 . 12 1 1 A 48 48 PRO CA C 48 63.239 63.803 -0.564 1
1 496 . 12 1 1 A 48 48 PRO CB C 48 31.523 31.420 0.103 1
1 499 . 12 1 1 A 49 49 GLY H H 49 9.752 8.595 1.157 1
1 500 . 12 1 1 A 49 49 GLY HA2 H 49 4.053 3.849 0.204 1
1 501 . 12 1 1 A 49 49 GLY HA3 H 49 3.374 3.901 -0.527 1
1 502 . 12 1 1 A 49 49 GLY C C 49 172.093 173.852 -1.759 1
1 503 . 12 1 1 A 49 49 GLY CA C 49 45.041 45.128 -0.087 1
1 504 . 12 1 1 A 49 49 GLY N N 49 112.415 112.795 -0.380 1
1 505 . 12 1 1 A 50 50 GLU H H 50 7.623 7.914 -0.291 1
1 506 . 12 1 1 A 50 50 GLU HA H 50 4.537 4.596 -0.059 1
1 511 . 12 1 1 A 50 50 GLU C C 50 173.297 175.018 -1.721 1
1 512 . 12 1 1 A 50 50 GLU CA C 50 55.174 55.729 -0.555 1
1 513 . 12 1 1 A 50 50 GLU CB C 50 31.651 30.196 1.455 1
1 515 . 12 1 1 A 50 50 GLU N N 50 121.600 121.708 -0.108 1
1 516 . 12 1 1 A 51 51 TYR H H 51 9.452 9.196 0.256 1
1 517 . 12 1 1 A 51 51 TYR HA H 51 5.382 5.458 -0.076 1
1 524 . 12 1 1 A 51 51 TYR C C 51 174.387 175.102 -0.715 1
1 525 . 12 1 1 A 51 51 TYR CA C 51 57.592 57.712 -0.120 1
1 526 . 12 1 1 A 51 51 TYR CB C 51 41.820 39.979 1.841 1
1 531 . 12 1 1 A 51 51 TYR N N 51 125.790 127.120 -1.330 1
1 532 . 12 1 1 A 52 52 VAL H H 52 9.471 9.441 0.030 1
1 533 . 12 1 1 A 52 52 VAL HA H 52 4.840 4.785 0.055 1
1 541 . 12 1 1 A 52 52 VAL C C 52 174.947 175.269 -0.322 1
1 542 . 12 1 1 A 52 52 VAL CA C 52 60.991 61.419 -0.428 1
1 543 . 12 1 1 A 52 52 VAL CB C 52 36.829 33.624 3.205 1
1 546 . 12 1 1 A 52 52 VAL N N 52 120.617 123.759 -3.142 1
1 547 . 12 1 1 A 53 53 LEU H H 53 9.457 9.362 0.095 1
1 548 . 12 1 1 A 53 53 LEU HA H 53 5.294 5.156 0.138 1
1 558 . 12 1 1 A 53 53 LEU C C 53 175.024 174.896 0.128 1
1 559 . 12 1 1 A 53 53 LEU CA C 53 53.904 54.731 -0.827 1
1 560 . 12 1 1 A 53 53 LEU CB C 53 44.756 44.198 0.558 1
1 564 . 12 1 1 A 53 53 LEU N N 53 127.725 131.380 -3.655 1
1 565 . 12 1 1 A 54 54 SER H H 54 9.461 9.319 0.142 1
1 566 . 12 1 1 A 54 54 SER HA H 54 5.691 5.531 0.160 1
1 569 . 12 1 1 A 54 54 SER C C 54 172.227 173.059 -0.832 1
1 570 . 12 1 1 A 54 54 SER CA C 54 58.551 57.751 0.800 1
1 571 . 12 1 1 A 54 54 SER CB C 54 65.738 65.412 0.326 1
1 572 . 12 1 1 A 54 54 SER N N 54 127.178 124.262 2.916 1
1 573 . 12 1 1 A 55 55 VAL H H 55 9.049 9.129 -0.080 1
1 574 . 12 1 1 A 55 55 VAL HA H 55 5.691 5.431 0.260 1
1 582 . 12 1 1 A 55 55 VAL C C 55 173.959 173.182 0.777 1
1 583 . 12 1 1 A 55 55 VAL CA C 55 58.398 59.720 -1.322 1
1 584 . 12 1 1 A 55 55 VAL CB C 55 36.262 35.438 0.824 1
1 587 . 12 1 1 A 55 55 VAL N N 55 120.619 125.617 -4.998 1
1 588 . 12 1 1 A 56 56 TYR H H 56 8.629 9.291 -0.662 1
1 589 . 12 1 1 A 56 56 TYR HA H 56 4.951 4.835 0.116 1
1 596 . 12 1 1 A 56 56 TYR C C 56 175.224 174.612 0.612 1
1 597 . 12 1 1 A 56 56 TYR CA C 56 56.684 56.710 -0.026 1
1 598 . 12 1 1 A 56 56 TYR CB C 56 39.646 38.578 1.068 1
1 603 . 12 1 1 A 56 56 TYR N N 56 127.444 130.314 -2.870 1
1 604 . 12 1 1 A 57 57 SER H H 57 8.869 8.681 0.188 1
1 605 . 12 1 1 A 57 57 SER HA H 57 4.739 4.834 -0.095 1
1 608 . 12 1 1 A 57 57 SER C C 57 174.492 172.775 1.717 1
1 609 . 12 1 1 A 57 57 SER CA C 57 57.591 56.964 0.627 1
1 610 . 12 1 1 A 57 57 SER CB C 57 64.281 66.371 -2.090 1
1 611 . 12 1 1 A 57 57 SER N N 57 122.165 123.024 -0.859 1
1 612 . 12 1 1 A 58 58 ASP H H 58 10.446 9.418 1.028 1
1 613 . 12 1 1 A 58 58 ASP HA H 58 4.382 4.283 0.099 1
1 616 . 12 1 1 A 58 58 ASP C C 58 176.398 176.108 0.290 1
1 617 . 12 1 1 A 58 58 ASP CA C 58 55.215 55.336 -0.121 1
1 618 . 12 1 1 A 58 58 ASP CB C 58 39.513 39.144 0.369 1
1 619 . 12 1 1 A 58 58 ASP N N 58 132.098 128.181 3.917 1
1 620 . 12 1 1 A 59 59 GLY H H 59 7.861 8.344 -0.483 1
1 621 . 12 1 1 A 59 59 GLY HA2 H 59 3.817 3.737 0.080 1
1 622 . 12 1 1 A 59 59 GLY HA3 H 59 4.086 3.765 0.321 1
1 623 . 12 1 1 A 59 59 GLY C C 59 173.111 173.347 -0.236 1
1 624 . 12 1 1 A 59 59 GLY CA C 59 45.486 45.191 0.295 1
1 625 . 12 1 1 A 59 59 GLY N N 59 102.674 104.962 -2.288 1
1 626 . 12 1 1 A 60 60 GLN H H 60 7.137 7.530 -0.393 1
1 627 . 12 1 1 A 60 60 GLN HA H 60 4.455 4.531 -0.076 1
1 634 . 12 1 1 A 60 60 GLN C C 60 173.549 174.782 -1.233 1
1 635 . 12 1 1 A 60 60 GLN CA C 60 53.388 53.563 -0.175 1
1 636 . 12 1 1 A 60 60 GLN CB C 60 32.373 31.194 1.179 1
1 638 . 12 1 1 A 60 60 GLN N N 60 116.206 119.242 -3.036 1
1 640 . 12 1 1 A 61 61 ARG H H 61 8.589 8.270 0.319 1
1 641 . 12 1 1 A 61 61 ARG HA H 61 4.740 4.318 0.422 1
1 649 . 12 1 1 A 61 61 ARG C C 61 174.458 174.706 -0.248 1
1 650 . 12 1 1 A 61 61 ARG CA C 61 57.116 55.548 1.568 1
1 651 . 12 1 1 A 61 61 ARG CB C 61 29.615 30.507 -0.892 1
1 654 . 12 1 1 A 61 61 ARG N N 61 120.467 121.683 -1.216 1
1 656 . 12 1 1 A 62 62 ARG H H 62 8.867 8.691 0.176 1
1 657 . 12 1 1 A 62 62 ARG HA H 62 4.297 4.271 0.026 1
1 665 . 12 1 1 A 62 62 ARG C C 62 173.485 175.511 -2.026 1
1 666 . 12 1 1 A 62 62 ARG CA C 62 53.355 55.235 -1.880 1
1 667 . 12 1 1 A 62 62 ARG CB C 62 33.028 30.521 2.507 1
1 670 . 12 1 1 A 62 62 ARG N N 62 122.641 124.447 -1.806 1
1 672 . 12 1 1 A 63 63 HIS H H 63 7.997 8.487 -0.490 1
1 673 . 12 1 1 A 63 63 HIS HA H 63 5.427 5.748 -0.321 1
1 678 . 12 1 1 A 63 63 HIS C C 63 174.946 173.961 0.985 1
1 679 . 12 1 1 A 63 63 HIS CA C 63 54.689 53.667 1.022 1
1 680 . 12 1 1 A 63 63 HIS CB C 63 33.008 32.255 0.753 1
1 683 . 12 1 1 A 63 63 HIS N N 63 119.064 120.881 -1.817 1
1 684 . 12 1 1 A 64 64 PHE H H 64 9.880 9.334 0.546 1
1 685 . 12 1 1 A 64 64 PHE HA H 64 4.824 5.025 -0.201 1
1 693 . 12 1 1 A 64 64 PHE C C 64 174.882 175.235 -0.353 1
1 694 . 12 1 1 A 64 64 PHE CA C 64 56.489 56.535 -0.046 1
1 695 . 12 1 1 A 64 64 PHE CB C 64 41.405 41.267 0.138 1
1 701 . 12 1 1 A 64 64 PHE N N 64 123.961 121.778 2.183 1
1 702 . 12 1 1 A 65 65 ILE H H 65 8.982 9.042 -0.060 1
1 703 . 12 1 1 A 65 65 ILE HA H 65 4.273 4.611 -0.338 1
1 713 . 12 1 1 A 65 65 ILE C C 65 176.556 175.986 0.570 1
1 714 . 12 1 1 A 65 65 ILE CA C 65 62.649 61.721 0.928 1
1 715 . 12 1 1 A 65 65 ILE CB C 65 38.296 38.104 0.192 1
1 719 . 12 1 1 A 65 65 ILE N N 65 126.601 124.775 1.826 1
1 720 . 12 1 1 A 66 66 ILE H H 66 8.947 9.214 -0.267 1
1 721 . 12 1 1 A 66 66 ILE HA H 66 3.780 4.057 -0.277 1
1 731 . 12 1 1 A 66 66 ILE C C 66 175.721 175.367 0.354 1
1 732 . 12 1 1 A 66 66 ILE CA C 66 62.960 60.596 2.364 1
1 733 . 12 1 1 A 66 66 ILE CB C 66 37.209 37.894 -0.685 1
1 737 . 12 1 1 A 66 66 ILE N N 66 130.139 129.212 0.927 1
1 738 . 12 1 1 A 67 67 GLN H H 67 8.410 8.711 -0.301 1
1 739 . 12 1 1 A 67 67 GLN HA H 67 4.422 4.840 -0.418 1
1 746 . 12 1 1 A 67 67 GLN C C 67 174.347 173.984 0.363 1
1 747 . 12 1 1 A 67 67 GLN CA C 67 55.867 55.513 0.354 1
1 748 . 12 1 1 A 67 67 GLN CB C 67 29.950 29.604 0.346 1
1 750 . 12 1 1 A 67 67 GLN N N 67 128.872 126.982 1.890 1
1 752 . 12 1 1 A 68 68 TYR H H 68 8.619 9.037 -0.418 1
1 753 . 12 1 1 A 68 68 TYR HA H 68 5.300 4.776 0.524 1
1 760 . 12 1 1 A 68 68 TYR C C 68 174.695 174.364 0.331 1
1 761 . 12 1 1 A 68 68 TYR CA C 68 55.579 56.628 -1.049 1
1 762 . 12 1 1 A 68 68 TYR CB C 68 39.479 38.490 0.989 1
1 767 . 12 1 1 A 68 68 TYR N N 68 124.772 126.315 -1.543 1
1 768 . 12 1 1 A 69 69 VAL H H 69 8.539 8.619 -0.080 1
1 769 . 12 1 1 A 69 69 VAL HA H 69 4.046 4.396 -0.350 1
1 777 . 12 1 1 A 69 69 VAL C C 69 175.010 174.967 0.043 1
1 778 . 12 1 1 A 69 69 VAL CA C 69 60.611 60.455 0.156 1
1 779 . 12 1 1 A 69 69 VAL CB C 69 35.358 34.257 1.101 1
1 782 . 12 1 1 A 69 69 VAL N N 69 126.652 126.980 -0.328 1
1 783 . 12 1 1 A 70 70 ASP H H 70 9.089 9.306 -0.217 1
1 784 . 12 1 1 A 70 70 ASP HA H 70 4.025 4.213 -0.188 1
1 787 . 12 1 1 A 70 70 ASP C C 70 174.813 175.043 -0.230 1
1 788 . 12 1 1 A 70 70 ASP CA C 70 55.623 55.461 0.162 1
1 789 . 12 1 1 A 70 70 ASP CB C 70 39.081 39.159 -0.078 1
1 790 . 12 1 1 A 70 70 ASP N N 70 128.327 127.431 0.896 1
1 791 . 12 1 1 A 71 71 ASN H H 71 8.128 8.096 0.032 1
1 792 . 12 1 1 A 71 71 ASN HA H 71 3.597 3.563 0.034 1
1 797 . 12 1 1 A 71 71 ASN C C 71 173.250 173.500 -0.250 1
1 798 . 12 1 1 A 71 71 ASN CA C 71 54.728 54.378 0.350 1
1 799 . 12 1 1 A 71 71 ASN CB C 71 37.601 37.011 0.590 1
1 800 . 12 1 1 A 71 71 ASN N N 71 107.230 108.105 -0.875 1
1 802 . 12 1 1 A 72 72 MET H H 72 7.256 7.279 -0.023 1
1 803 . 12 1 1 A 72 72 MET HA H 72 4.740 5.011 -0.271 1
1 808 . 12 1 1 A 72 72 MET C C 72 173.780 174.036 -0.256 1
1 809 . 12 1 1 A 72 72 MET CA C 72 53.703 54.083 -0.380 1
1 810 . 12 1 1 A 72 72 MET CB C 72 36.570 37.481 -0.911 1
1 812 . 12 1 1 A 72 72 MET N N 72 117.117 116.605 0.512 1
1 813 . 12 1 1 A 73 73 TYR H H 73 9.430 9.253 0.177 1
1 814 . 12 1 1 A 73 73 TYR HA H 73 5.718 5.197 0.521 1
1 821 . 12 1 1 A 73 73 TYR C C 73 176.140 175.578 0.562 1
1 822 . 12 1 1 A 73 73 TYR CA C 73 57.290 57.322 -0.032 1
1 823 . 12 1 1 A 73 73 TYR CB C 73 40.013 39.929 0.084 1
1 828 . 12 1 1 A 73 73 TYR N N 73 119.856 121.039 -1.183 1
1 829 . 12 1 1 A 74 74 ARG H H 74 9.038 8.549 0.489 1
1 830 . 12 1 1 A 74 74 ARG HA H 74 4.867 4.960 -0.093 1
1 838 . 12 1 1 A 74 74 ARG C C 74 173.954 175.026 -1.072 1
1 839 . 12 1 1 A 74 74 ARG CA C 74 54.887 54.883 0.004 1
1 840 . 12 1 1 A 74 74 ARG CB C 74 34.484 34.084 0.400 1
1 843 . 12 1 1 A 74 74 ARG N N 74 117.344 120.869 -3.525 1
1 845 . 12 1 1 A 75 75 PHE H H 75 9.005 8.890 0.115 1
1 846 . 12 1 1 A 75 75 PHE HA H 75 5.046 4.672 0.374 1
1 854 . 12 1 1 A 75 75 PHE C C 75 176.186 175.591 0.595 1
1 855 . 12 1 1 A 75 75 PHE CA C 75 59.658 59.233 0.425 1
1 856 . 12 1 1 A 75 75 PHE CB C 75 39.356 40.649 -1.293 1
1 862 . 12 1 1 A 75 75 PHE N N 75 117.865 120.204 -2.339 1
1 863 . 12 1 1 A 76 76 GLU H H 76 8.213 8.438 -0.225 1
1 864 . 12 1 1 A 76 76 GLU HA H 76 4.586 4.748 -0.162 1
1 869 . 12 1 1 A 76 76 GLU C C 76 175.238 177.590 -2.352 1
1 870 . 12 1 1 A 76 76 GLU CA C 76 55.994 57.952 -1.958 1
1 871 . 12 1 1 A 76 76 GLU CB C 76 31.805 31.288 0.517 1
1 873 . 12 1 1 A 76 76 GLU N N 76 116.834 119.058 -2.224 1
1 874 . 12 1 1 A 77 77 GLY H H 77 8.692 7.911 0.781 1
1 875 . 12 1 1 A 77 77 GLY HA2 H 77 4.166 4.075 0.091 1
1 876 . 12 1 1 A 77 77 GLY HA3 H 77 4.015 4.082 -0.067 1
1 877 . 12 1 1 A 77 77 GLY C C 77 173.784 174.860 -1.076 1
1 878 . 12 1 1 A 77 77 GLY CA C 77 45.505 46.273 -0.768 1
1 879 . 12 1 1 A 77 77 GLY N N 77 111.937 107.567 4.370 1
1 880 . 12 1 1 A 78 78 THR H H 78 8.332 7.842 0.490 1
1 881 . 12 1 1 A 78 78 THR HA H 78 3.900 4.183 -0.283 1
1 886 . 12 1 1 A 78 78 THR C C 78 173.591 174.214 -0.623 1
1 887 . 12 1 1 A 78 78 THR CA C 78 63.653 63.931 -0.278 1
1 888 . 12 1 1 A 78 78 THR CB C 78 69.649 69.044 0.605 1
1 890 . 12 1 1 A 78 78 THR N N 78 120.765 114.621 6.144 1
1 891 . 12 1 1 A 79 79 GLY H H 79 8.038 8.502 -0.464 1
1 892 . 12 1 1 A 79 79 GLY HA2 H 79 4.748 4.374 0.374 1
1 893 . 12 1 1 A 79 79 GLY HA3 H 79 3.546 4.523 -0.977 1
1 894 . 12 1 1 A 79 79 GLY C C 79 172.580 172.385 0.195 1
1 895 . 12 1 1 A 79 79 GLY CA C 79 44.661 44.173 0.488 1
1 896 . 12 1 1 A 79 79 GLY N N 79 109.887 113.808 -3.921 1
1 897 . 12 1 1 A 80 80 PHE H H 80 9.064 8.745 0.319 1
1 898 . 12 1 1 A 80 80 PHE HA H 80 4.886 5.055 -0.169 1
1 906 . 12 1 1 A 80 80 PHE C C 80 176.507 176.194 0.313 1
1 907 . 12 1 1 A 80 80 PHE CA C 80 57.257 56.705 0.552 1
1 908 . 12 1 1 A 80 80 PHE CB C 80 44.655 43.361 1.294 1
1 914 . 12 1 1 A 80 80 PHE N N 80 116.862 120.191 -3.329 1
1 915 . 12 1 1 A 81 81 SER H H 81 9.413 8.800 0.613 1
1 916 . 12 1 1 A 81 81 SER HA H 81 4.622 4.437 0.185 1
1 919 . 12 1 1 A 81 81 SER C C 81 173.735 175.061 -1.326 1
1 920 . 12 1 1 A 81 81 SER CA C 81 61.410 61.984 -0.574 1
1 921 . 12 1 1 A 81 81 SER CB C 81 64.165 63.331 0.834 1
1 922 . 12 1 1 A 81 81 SER N N 81 116.467 116.032 0.435 1
1 923 . 12 1 1 A 82 82 ASN H H 82 7.688 8.257 -0.569 1
1 924 . 12 1 1 A 82 82 ASN HA H 82 4.952 5.238 -0.286 1
1 929 . 12 1 1 A 82 82 ASN C C 82 173.303 175.774 -2.471 1
1 930 . 12 1 1 A 82 82 ASN CA C 82 52.086 52.313 -0.227 1
1 931 . 12 1 1 A 82 82 ASN CB C 82 41.258 40.751 0.507 1
1 932 . 12 1 1 A 82 82 ASN N N 82 113.355 117.473 -4.118 1
1 934 . 12 1 1 A 83 83 ILE H H 83 8.858 8.560 0.298 1
1 935 . 12 1 1 A 83 83 ILE HA H 83 3.571 3.777 -0.206 1
1 945 . 12 1 1 A 83 83 ILE CA C 83 66.416 65.591 0.825 1
1 946 . 12 1 1 A 83 83 ILE CB C 83 35.074 35.157 -0.083 1
1 950 . 12 1 1 A 83 83 ILE N N 83 118.908 123.675 -4.767 1
1 951 . 12 1 1 A 84 84 PRO HA H 84 4.411 4.738 -0.327 1
1 958 . 12 1 1 A 84 84 PRO C C 84 177.616 179.479 -1.863 1
1 959 . 12 1 1 A 84 84 PRO CA C 84 67.525 66.562 0.963 1
1 960 . 12 1 1 A 84 84 PRO CB C 84 31.029 30.905 0.124 1
1 963 . 12 1 1 A 85 85 GLN H H 85 8.405 8.343 0.062 1
1 964 . 12 1 1 A 85 85 GLN HA H 85 3.874 4.014 -0.140 1
1 971 . 12 1 1 A 85 85 GLN C C 85 178.213 178.257 -0.044 1
1 972 . 12 1 1 A 85 85 GLN CA C 85 59.495 58.501 0.994 1
1 973 . 12 1 1 A 85 85 GLN CB C 85 29.270 28.044 1.226 1
1 975 . 12 1 1 A 85 85 GLN N N 85 115.597 117.212 -1.615 1
1 977 . 12 1 1 A 86 86 LEU H H 86 7.136 8.092 -0.956 1
1 978 . 12 1 1 A 86 86 LEU HA H 86 3.589 3.780 -0.191 1
1 988 . 12 1 1 A 86 86 LEU C C 86 177.728 178.571 -0.843 1
1 989 . 12 1 1 A 86 86 LEU CA C 86 58.136 58.380 -0.244 1
1 990 . 12 1 1 A 86 86 LEU CB C 86 42.290 41.811 0.479 1
1 994 . 12 1 1 A 86 86 LEU N N 86 121.840 122.049 -0.209 1
1 995 . 12 1 1 A 87 87 ILE H H 87 8.323 8.074 0.249 1
1 996 . 12 1 1 A 87 87 ILE HA H 87 3.415 3.360 0.055 1
1 1006 . 12 1 1 A 87 87 ILE C C 87 178.064 177.730 0.334 1
1 1007 . 12 1 1 A 87 87 ILE CA C 87 61.458 65.610 -4.152 1
1 1008 . 12 1 1 A 87 87 ILE CB C 87 34.561 37.863 -3.302 1
1 1012 . 12 1 1 A 87 87 ILE N N 87 118.117 119.757 -1.640 1
1 1013 . 12 1 1 A 88 88 ASP H H 88 8.805 8.440 0.365 1
1 1014 . 12 1 1 A 88 88 ASP HA H 88 4.548 4.334 0.214 1
1 1017 . 12 1 1 A 88 88 ASP C C 88 179.265 178.184 1.081 1
1 1018 . 12 1 1 A 88 88 ASP CA C 88 58.099 57.414 0.685 1
1 1019 . 12 1 1 A 88 88 ASP CB C 88 42.166 41.948 0.218 1
1 1020 . 12 1 1 A 88 88 ASP N N 88 119.143 120.517 -1.374 1
1 1021 . 12 1 1 A 89 89 HIS H H 89 8.113 7.916 0.197 1
1 1022 . 12 1 1 A 89 89 HIS HA H 89 4.225 4.285 -0.060 1
1 1026 . 12 1 1 A 89 89 HIS C C 89 179.261 176.925 2.336 1
1 1027 . 12 1 1 A 89 89 HIS CA C 89 60.647 58.951 1.696 1
1 1028 . 12 1 1 A 89 89 HIS CB C 89 30.801 29.464 1.337 1
1 1030 . 12 1 1 A 89 89 HIS N N 89 119.595 119.055 0.540 1
1 1031 . 12 1 1 A 90 90 HIS H H 90 7.685 7.797 -0.112 1
1 1032 . 12 1 1 A 90 90 HIS HA H 90 3.628 4.194 -0.566 1
1 1036 . 12 1 1 A 90 90 HIS C C 90 178.454 177.554 0.900 1
1 1037 . 12 1 1 A 90 90 HIS CA C 90 61.797 59.466 2.331 1
1 1038 . 12 1 1 A 90 90 HIS CB C 90 28.165 29.919 -1.754 1
1 1040 . 12 1 1 A 90 90 HIS N N 90 120.061 116.506 3.555 1
1 1041 . 12 1 1 A 91 91 TYR H H 91 9.394 8.227 1.167 1
1 1042 . 12 1 1 A 91 91 TYR HA H 91 4.238 3.991 0.247 1
1 1049 . 12 1 1 A 91 91 TYR C C 91 176.443 177.669 -1.226 1
1 1050 . 12 1 1 A 91 91 TYR CA C 91 60.669 61.772 -1.103 1
1 1051 . 12 1 1 A 91 91 TYR CB C 91 39.169 39.047 0.122 1
1 1056 . 12 1 1 A 91 91 TYR N N 91 123.532 120.195 3.337 1
1 1057 . 12 1 1 A 92 92 THR H H 92 8.774 8.537 0.237 1
1 1058 . 12 1 1 A 92 92 THR HA H 92 3.866 4.123 -0.257 1
1 1063 . 12 1 1 A 92 92 THR C C 92 177.050 176.268 0.782 1
1 1064 . 12 1 1 A 92 92 THR CA C 92 65.240 65.418 -0.178 1
1 1065 . 12 1 1 A 92 92 THR CB C 92 69.298 68.044 1.254 1
1 1067 . 12 1 1 A 92 92 THR N N 92 112.000 113.053 -1.053 1
1 1068 . 12 1 1 A 93 93 THR H H 93 7.617 7.631 -0.014 1
1 1069 . 12 1 1 A 93 93 THR HA H 93 4.133 4.131 0.002 1
1 1074 . 12 1 1 A 93 93 THR C C 93 176.234 174.753 1.481 1
1 1075 . 12 1 1 A 93 93 THR CA C 93 63.527 62.541 0.986 1
1 1076 . 12 1 1 A 93 93 THR CB C 93 71.234 69.598 1.636 1
1 1078 . 12 1 1 A 93 93 THR N N 93 109.883 113.126 -3.243 1
1 1079 . 12 1 1 A 94 94 LYS H H 94 7.210 7.604 -0.394 1
1 1080 . 12 1 1 A 94 94 LYS HA H 94 3.830 3.775 0.055 1
1 1089 . 12 1 1 A 94 94 LYS C C 94 174.331 174.977 -0.646 1
1 1090 . 12 1 1 A 94 94 LYS CA C 94 56.776 57.358 -0.582 1
1 1091 . 12 1 1 A 94 94 LYS CB C 94 28.095 30.956 -2.861 1
1 1095 . 12 1 1 A 94 94 LYS N N 94 112.818 121.209 -8.391 1
1 1096 . 12 1 1 A 95 95 GLN H H 95 7.439 7.525 -0.086 1
1 1097 . 12 1 1 A 95 95 GLN HA H 95 4.216 4.816 -0.600 1
1 1104 . 12 1 1 A 95 95 GLN C C 95 179.087 175.464 3.623 1
1 1105 . 12 1 1 A 95 95 GLN CA C 95 56.378 53.919 2.459 1
1 1106 . 12 1 1 A 95 95 GLN CB C 95 28.542 30.822 -2.280 1
1 1108 . 12 1 1 A 95 95 GLN N N 95 117.860 118.130 -0.270 1
1 1110 . 12 1 1 A 96 96 VAL H H 96 8.520 8.551 -0.031 1
1 1111 . 12 1 1 A 96 96 VAL HA H 96 4.297 4.672 -0.375 1
1 1119 . 12 1 1 A 96 96 VAL C C 96 177.329 176.739 0.590 1
1 1120 . 12 1 1 A 96 96 VAL CA C 96 61.196 61.761 -0.565 1
1 1121 . 12 1 1 A 96 96 VAL CB C 96 32.735 33.319 -0.584 1
1 1124 . 12 1 1 A 96 96 VAL N N 96 124.208 119.181 5.027 1
1 1125 . 12 1 1 A 97 97 ILE H H 97 8.491 8.515 -0.024 1
1 1126 . 12 1 1 A 97 97 ILE HA H 97 2.995 3.549 -0.554 1
1 1136 . 12 1 1 A 97 97 ILE CA C 97 62.066 63.180 -1.114 1
1 1137 . 12 1 1 A 97 97 ILE CB C 97 36.117 37.989 -1.872 1
1 1141 . 12 1 1 A 97 97 ILE N N 97 119.561 124.099 -4.538 1
1 1142 . 12 1 1 A 98 98 THR HA H 98 4.460 4.582 -0.122 1
1 1147 . 12 1 1 A 98 98 THR C C 98 174.335 174.872 -0.537 1
1 1148 . 12 1 1 A 98 98 THR CA C 98 58.244 59.627 -1.383 1
1 1149 . 12 1 1 A 98 98 THR CB C 98 73.056 71.697 1.359 1
1 1151 . 12 1 1 A 99 99 LYS H H 99 9.761 9.083 0.678 1
1 1152 . 12 1 1 A 99 99 LYS HA H 99 3.911 4.087 -0.176 1
1 1161 . 12 1 1 A 99 99 LYS C C 99 179.594 178.318 1.276 1
1 1162 . 12 1 1 A 99 99 LYS CA C 99 59.661 58.395 1.266 1
1 1163 . 12 1 1 A 99 99 LYS CB C 99 31.978 32.082 -0.104 1
1 1167 . 12 1 1 A 99 99 LYS N N 99 125.750 122.179 3.571 1
1 1168 . 12 1 1 A 100 100 LYS H H 100 8.910 7.564 1.346 1
1 1169 . 12 1 1 A 100 100 LYS HA H 100 4.024 4.207 -0.183 1
1 1178 . 12 1 1 A 100 100 LYS C C 100 178.060 177.100 0.960 1
1 1179 . 12 1 1 A 100 100 LYS CA C 100 58.642 58.713 -0.071 1
1 1180 . 12 1 1 A 100 100 LYS CB C 100 32.750 32.587 0.163 1
1 1184 . 12 1 1 A 100 100 LYS N N 100 117.112 119.128 -2.016 1
1 1185 . 12 1 1 A 101 101 SER H H 101 7.721 7.482 0.239 1
1 1186 . 12 1 1 A 101 101 SER HA H 101 4.282 4.585 -0.303 1
1 1189 . 12 1 1 A 101 101 SER C C 101 176.403 174.739 1.664 1
1 1190 . 12 1 1 A 101 101 SER CA C 101 60.442 59.872 0.570 1
1 1191 . 12 1 1 A 101 101 SER CB C 101 63.775 65.626 -1.851 1
1 1192 . 12 1 1 A 101 101 SER N N 101 112.069 112.962 -0.893 1
1 1193 . 12 1 1 A 102 102 GLY H H 102 8.038 8.251 -0.213 1
1 1194 . 12 1 1 A 102 102 GLY HA2 H 102 4.024 3.911 0.113 1
1 1195 . 12 1 1 A 102 102 GLY HA3 H 102 3.713 3.938 -0.225 1
1 1196 . 12 1 1 A 102 102 GLY C C 102 173.991 174.268 -0.277 1
1 1197 . 12 1 1 A 102 102 GLY CA C 102 46.458 46.390 0.068 1
1 1198 . 12 1 1 A 102 102 GLY N N 102 111.144 108.506 2.638 1
1 1199 . 12 1 1 A 103 103 VAL H H 103 7.155 7.614 -0.459 1
1 1200 . 12 1 1 A 103 103 VAL HA H 103 3.652 4.259 -0.607 1
1 1208 . 12 1 1 A 103 103 VAL C C 103 173.805 174.980 -1.175 1
1 1209 . 12 1 1 A 103 103 VAL CA C 103 64.310 61.739 2.571 1
1 1210 . 12 1 1 A 103 103 VAL CB C 103 32.254 33.186 -0.932 1
1 1213 . 12 1 1 A 103 103 VAL N N 103 119.836 119.840 -0.004 1
1 1214 . 12 1 1 A 104 104 VAL H H 104 7.653 9.020 -1.367 1
1 1215 . 12 1 1 A 104 104 VAL HA H 104 4.048 4.429 -0.381 1
1 1223 . 12 1 1 A 104 104 VAL C C 104 175.708 174.413 1.295 1
1 1224 . 12 1 1 A 104 104 VAL CA C 104 60.275 60.918 -0.643 1
1 1225 . 12 1 1 A 104 104 VAL CB C 104 35.112 34.232 0.880 1
1 1228 . 12 1 1 A 104 104 VAL N N 104 125.859 127.943 -2.084 1
1 1229 . 12 1 1 A 105 105 LEU H H 105 8.616 8.326 0.290 1
1 1230 . 12 1 1 A 105 105 LEU HA H 105 3.905 4.747 -0.842 1
1 1240 . 12 1 1 A 105 105 LEU C C 105 175.380 175.760 -0.380 1
1 1241 . 12 1 1 A 105 105 LEU CA C 105 54.471 53.453 1.018 1
1 1242 . 12 1 1 A 105 105 LEU CB C 105 39.821 42.532 -2.711 1
1 1246 . 12 1 1 A 105 105 LEU N N 105 123.839 126.636 -2.797 1
1 1247 . 12 1 1 A 106 106 LEU H H 106 8.894 8.543 0.351 1
1 1248 . 12 1 1 A 106 106 LEU HA H 106 4.839 4.732 0.107 1
1 1258 . 12 1 1 A 106 106 LEU C C 106 176.930 176.476 0.454 1
1 1259 . 12 1 1 A 106 106 LEU CA C 106 56.288 53.139 3.149 1
1 1260 . 12 1 1 A 106 106 LEU CB C 106 45.237 45.464 -0.227 1
1 1264 . 12 1 1 A 106 106 LEU N N 106 120.590 121.219 -0.629 1
1 1265 . 12 1 1 A 107 107 ASN H H 107 8.124 8.794 -0.670 1
1 1266 . 12 1 1 A 107 107 ASN HA H 107 5.650 4.710 0.940 1
1 1271 . 12 1 1 A 107 107 ASN CA C 107 50.293 54.023 -3.730 1
1 1272 . 12 1 1 A 107 107 ASN CB C 107 41.223 36.213 5.010 1
1 1273 . 12 1 1 A 107 107 ASN N N 107 116.866 117.926 -1.060 1
1 1275 . 12 1 1 A 108 108 PRO HA H 108 2.926 3.795 -0.869 1
1 1282 . 12 1 1 A 108 108 PRO C C 108 176.671 175.828 0.843 1
1 1283 . 12 1 1 A 108 108 PRO CA C 108 60.804 62.503 -1.699 1
1 1284 . 12 1 1 A 108 108 PRO CB C 108 31.774 32.178 -0.404 1
1 1287 . 12 1 1 A 109 109 ILE H H 109 8.648 7.678 0.970 1
1 1288 . 12 1 1 A 109 109 ILE HA H 109 4.519 4.536 -0.017 1
1 1298 . 12 1 1 A 109 109 ILE CA C 109 55.070 58.387 -3.317 1
1 1299 . 12 1 1 A 109 109 ILE CB C 109 36.068 38.271 -2.203 1
1 1303 . 12 1 1 A 109 109 ILE N N 109 128.817 123.200 5.617 1
1 1304 . 12 1 1 A 110 110 PRO HA H 110 4.587 4.517 0.070 1
1 1311 . 12 1 1 A 110 110 PRO C C 110 177.013 176.851 0.162 1
1 1312 . 12 1 1 A 110 110 PRO CA C 110 61.850 62.951 -1.101 1
1 1313 . 12 1 1 A 110 110 PRO CB C 110 32.507 32.010 0.497 1
1 1316 . 12 1 1 A 111 111 LYS H H 111 8.038 8.156 -0.118 1
1 1317 . 12 1 1 A 111 111 LYS HA H 111 3.553 3.258 0.295 1
1 1326 . 12 1 1 A 111 111 LYS C C 111 176.123 175.414 0.709 1
1 1327 . 12 1 1 A 111 111 LYS CA C 111 56.220 55.681 0.539 1
1 1328 . 12 1 1 A 111 111 LYS CB C 111 32.373 32.400 -0.027 1
1 1332 . 12 1 1 A 111 111 LYS N N 111 120.147 118.888 1.259 1
1 1333 . 12 1 1 A 112 112 ASP H H 112 8.463 8.550 -0.087 1
1 1334 . 12 1 1 A 112 112 ASP HA H 112 4.523 4.852 -0.329 1
1 1337 . 12 1 1 A 112 112 ASP C C 112 175.986 175.831 0.155 1
1 1338 . 12 1 1 A 112 112 ASP CA C 112 54.256 53.799 0.457 1
1 1339 . 12 1 1 A 112 112 ASP CB C 112 41.563 41.228 0.335 1
1 1340 . 12 1 1 A 112 112 ASP N N 112 121.863 121.395 0.468 1
1 1341 . 12 1 1 A 113 113 LYS H H 113 8.059 8.720 -0.661 1
1 1342 . 12 1 1 A 113 113 LYS HA H 113 4.136 4.261 -0.125 1
1 1351 . 12 1 1 A 113 113 LYS C C 113 176.010 176.643 -0.633 1
1 1352 . 12 1 1 A 113 113 LYS CA C 113 56.253 57.695 -1.442 1
1 1353 . 12 1 1 A 113 113 LYS CB C 113 32.754 32.358 0.396 1
1 1357 . 12 1 1 A 113 113 LYS N N 113 121.725 125.268 -3.543 1
1 1358 . 12 1 1 A 114 114 LYS H H 114 8.225 7.382 0.843 1
1 1359 . 12 1 1 A 114 114 LYS HA H 114 4.169 4.315 -0.146 1
1 1368 . 12 1 1 A 114 114 LYS C C 114 176.198 177.345 -1.147 1
1 1369 . 12 1 1 A 114 114 LYS CA C 114 56.413 54.724 1.689 1
1 1370 . 12 1 1 A 114 114 LYS CB C 114 32.725 30.534 2.191 1
1 1374 . 12 1 1 A 114 114 LYS N N 114 121.857 119.789 2.068 1
1 1375 . 12 1 1 A 115 115 TRP H H 115 8.078 7.529 0.549 1
1 1376 . 12 1 1 A 115 115 TRP HA H 115 4.709 4.555 0.154 1
1 1385 . 12 1 1 A 115 115 TRP C C 115 175.119 177.550 -2.431 1
1 1386 . 12 1 1 A 115 115 TRP CA C 115 56.856 58.336 -1.480 1
1 1387 . 12 1 1 A 115 115 TRP CB C 115 29.474 28.506 0.968 1
1 1393 . 12 1 1 A 115 115 TRP N N 115 122.068 122.546 -0.478 1
1 1 . 13 1 1 A 10 10 HIS HA H 10 4.616 5.169 -0.553 1
1 4 . 13 1 1 A 10 10 HIS C C 10 174.981 172.627 2.354 1
1 5 . 13 1 1 A 10 10 HIS CA C 10 56.555 55.029 1.526 1
1 6 . 13 1 1 A 10 10 HIS CB C 10 30.231 31.784 -1.553 1
1 7 . 13 1 1 A 11 11 MET H H 11 8.103 8.968 -0.865 1
1 8 . 13 1 1 A 11 11 MET HA H 11 4.439 5.086 -0.647 1
1 13 . 13 1 1 A 11 11 MET C C 11 175.888 175.459 0.429 1
1 14 . 13 1 1 A 11 11 MET CA C 11 55.090 53.685 1.405 1
1 15 . 13 1 1 A 11 11 MET CB C 11 33.121 33.986 -0.865 1
1 17 . 13 1 1 A 11 11 MET N N 11 120.743 120.331 0.412 1
1 18 . 13 1 1 A 12 12 LYS H H 12 8.065 8.794 -0.729 1
1 19 . 13 1 1 A 12 12 LYS HA H 12 4.407 4.856 -0.449 1
1 28 . 13 1 1 A 12 12 LYS CA C 12 54.894 52.862 2.032 1
1 29 . 13 1 1 A 12 12 LYS CB C 12 31.863 34.857 -2.994 1
1 33 . 13 1 1 A 12 12 LYS N N 12 123.187 124.151 -0.964 1
1 34 . 13 1 1 A 13 13 PRO HA H 13 4.347 4.535 -0.188 1
1 41 . 13 1 1 A 13 13 PRO C C 13 176.891 177.439 -0.548 1
1 42 . 13 1 1 A 13 13 PRO CA C 13 62.542 62.177 0.365 1
1 43 . 13 1 1 A 13 13 PRO CB C 13 32.663 32.954 -0.291 1
1 46 . 13 1 1 A 14 14 LEU H H 14 8.339 8.768 -0.429 1
1 47 . 13 1 1 A 14 14 LEU HA H 14 3.373 3.835 -0.462 1
1 57 . 13 1 1 A 14 14 LEU C C 14 176.683 178.201 -1.518 1
1 58 . 13 1 1 A 14 14 LEU CA C 14 58.555 57.651 0.904 1
1 59 . 13 1 1 A 14 14 LEU CB C 14 41.828 41.188 0.640 1
1 63 . 13 1 1 A 14 14 LEU N N 14 123.191 123.575 -0.384 1
1 64 . 13 1 1 A 15 15 ALA H H 15 8.175 8.198 -0.023 1
1 65 . 13 1 1 A 15 15 ALA HA H 15 3.983 3.666 0.317 1
1 69 . 13 1 1 A 15 15 ALA C C 15 178.697 179.607 -0.910 1
1 70 . 13 1 1 A 15 15 ALA CA C 15 54.164 55.163 -0.999 1
1 71 . 13 1 1 A 15 15 ALA CB C 15 18.771 18.030 0.741 1
1 72 . 13 1 1 A 15 15 ALA N N 15 113.594 120.324 -6.730 1
1 73 . 13 1 1 A 16 16 GLU H H 16 7.458 7.395 0.063 1
1 74 . 13 1 1 A 16 16 GLU HA H 16 4.266 4.181 0.085 1
1 79 . 13 1 1 A 16 16 GLU C C 16 176.510 177.392 -0.882 1
1 80 . 13 1 1 A 16 16 GLU CA C 16 55.196 58.630 -3.434 1
1 81 . 13 1 1 A 16 16 GLU CB C 16 30.907 29.859 1.048 1
1 83 . 13 1 1 A 16 16 GLU N N 16 113.348 115.972 -2.624 1
1 84 . 13 1 1 A 17 17 GLN H H 17 7.501 7.131 0.370 1
1 85 . 13 1 1 A 17 17 GLN HA H 17 3.683 4.060 -0.377 1
1 92 . 13 1 1 A 17 17 GLN C C 17 178.053 176.844 1.209 1
1 93 . 13 1 1 A 17 17 GLN CA C 17 54.606 56.003 -1.397 1
1 94 . 13 1 1 A 17 17 GLN CB C 17 25.758 28.128 -2.370 1
1 96 . 13 1 1 A 17 17 GLN N N 17 119.411 118.539 0.872 1
1 98 . 13 1 1 A 18 18 ASP H H 18 8.949 8.771 0.178 1
1 99 . 13 1 1 A 18 18 ASP HA H 18 4.184 4.099 0.085 1
1 102 . 13 1 1 A 18 18 ASP C C 18 175.263 177.871 -2.608 1
1 103 . 13 1 1 A 18 18 ASP CA C 18 57.275 56.618 0.657 1
1 104 . 13 1 1 A 18 18 ASP CB C 18 40.620 39.875 0.745 1
1 105 . 13 1 1 A 18 18 ASP N N 18 124.676 123.967 0.709 1
1 106 . 13 1 1 A 19 19 TRP H H 19 6.068 7.417 -1.349 1
1 107 . 13 1 1 A 19 19 TRP HA H 19 5.045 4.735 0.310 1
1 116 . 13 1 1 A 19 19 TRP C C 19 175.902 176.397 -0.495 1
1 117 . 13 1 1 A 19 19 TRP CA C 19 53.542 58.103 -4.561 1
1 118 . 13 1 1 A 19 19 TRP CB C 19 29.179 28.558 0.621 1
1 124 . 13 1 1 A 19 19 TRP N N 19 107.757 116.672 -8.915 1
1 126 . 13 1 1 A 20 20 TYR H H 20 7.430 7.370 0.060 1
1 127 . 13 1 1 A 20 20 TYR HA H 20 5.601 5.361 0.240 1
1 132 . 13 1 1 A 20 20 TYR C C 20 175.498 174.523 0.975 1
1 133 . 13 1 1 A 20 20 TYR CA C 20 56.967 57.167 -0.200 1
1 134 . 13 1 1 A 20 20 TYR CB C 20 39.083 38.695 0.388 1
1 137 . 13 1 1 A 20 20 TYR N N 20 123.173 122.293 0.880 1
1 138 . 13 1 1 A 21 21 HIS H H 21 8.934 8.764 0.170 1
1 139 . 13 1 1 A 21 21 HIS HA H 21 4.295 4.607 -0.312 1
1 144 . 13 1 1 A 21 21 HIS C C 21 175.177 174.908 0.269 1
1 145 . 13 1 1 A 21 21 HIS CA C 21 56.572 53.900 2.672 1
1 146 . 13 1 1 A 21 21 HIS CB C 21 33.365 27.831 5.534 1
1 149 . 13 1 1 A 21 21 HIS N N 21 125.732 126.130 -0.398 1
1 150 . 13 1 1 A 22 22 GLY H H 22 5.280 8.093 -2.813 1
1 151 . 13 1 1 A 22 22 GLY HA2 H 22 3.905 3.652 0.253 1
1 152 . 13 1 1 A 22 22 GLY HA3 H 22 3.585 3.714 -0.129 1
1 153 . 13 1 1 A 22 22 GLY C C 22 174.411 174.017 0.394 1
1 154 . 13 1 1 A 22 22 GLY CA C 22 46.402 46.753 -0.351 1
1 155 . 13 1 1 A 22 22 GLY N N 22 104.568 109.198 -4.630 1
1 156 . 13 1 1 A 23 23 ALA H H 23 8.768 7.850 0.918 1
1 157 . 13 1 1 A 23 23 ALA HA H 23 5.171 4.293 0.878 1
1 161 . 13 1 1 A 23 23 ALA C C 23 177.180 176.372 0.808 1
1 162 . 13 1 1 A 23 23 ALA CA C 23 51.153 52.470 -1.317 1
1 163 . 13 1 1 A 23 23 ALA CB C 23 16.999 17.216 -0.217 1
1 164 . 13 1 1 A 23 23 ALA N N 23 130.297 116.310 13.987 1
1 165 . 13 1 1 A 24 24 ILE H H 24 7.267 7.512 -0.245 1
1 166 . 13 1 1 A 24 24 ILE HA H 24 4.460 4.307 0.153 1
1 176 . 13 1 1 A 24 24 ILE CA C 24 58.529 59.465 -0.936 1
1 177 . 13 1 1 A 24 24 ILE CB C 24 38.763 37.622 1.141 1
1 181 . 13 1 1 A 24 24 ILE N N 24 118.903 113.708 5.195 1
1 182 . 13 1 1 A 25 25 PRO HA H 25 4.224 4.467 -0.243 1
1 189 . 13 1 1 A 25 25 PRO C C 25 176.918 177.592 -0.674 1
1 190 . 13 1 1 A 25 25 PRO CA C 25 62.907 62.758 0.149 1
1 191 . 13 1 1 A 25 25 PRO CB C 25 32.671 32.574 0.097 1
1 194 . 13 1 1 A 26 26 ARG H H 26 8.781 9.067 -0.286 1
1 195 . 13 1 1 A 26 26 ARG HA H 26 3.472 3.866 -0.394 1
1 202 . 13 1 1 A 26 26 ARG C C 26 178.112 178.011 0.101 1
1 203 . 13 1 1 A 26 26 ARG CA C 26 60.863 59.473 1.390 1
1 204 . 13 1 1 A 26 26 ARG CB C 26 30.314 29.762 0.552 1
1 207 . 13 1 1 A 26 26 ARG N N 26 124.635 121.632 3.003 1
1 208 . 13 1 1 A 27 27 ILE H H 27 8.540 8.124 0.416 1
1 209 . 13 1 1 A 27 27 ILE HA H 27 3.787 3.615 0.172 1
1 219 . 13 1 1 A 27 27 ILE C C 27 177.390 177.618 -0.228 1
1 220 . 13 1 1 A 27 27 ILE CA C 27 64.329 65.252 -0.923 1
1 221 . 13 1 1 A 27 27 ILE CB C 27 37.413 38.028 -0.615 1
1 225 . 13 1 1 A 27 27 ILE N N 27 115.859 119.880 -4.021 1
1 226 . 13 1 1 A 28 28 GLU H H 28 6.953 8.564 -1.611 1
1 227 . 13 1 1 A 28 28 GLU HA H 28 4.067 3.985 0.082 1
1 232 . 13 1 1 A 28 28 GLU C C 28 179.006 179.201 -0.195 1
1 233 . 13 1 1 A 28 28 GLU CA C 28 58.985 59.650 -0.665 1
1 234 . 13 1 1 A 28 28 GLU CB C 28 29.316 29.236 0.080 1
1 236 . 13 1 1 A 28 28 GLU N N 28 120.554 119.035 1.519 1
1 237 . 13 1 1 A 29 29 ALA H H 29 7.999 8.291 -0.292 1
1 238 . 13 1 1 A 29 29 ALA HA H 29 3.822 3.990 -0.168 1
1 242 . 13 1 1 A 29 29 ALA C C 29 178.809 179.984 -1.175 1
1 243 . 13 1 1 A 29 29 ALA CA C 29 54.698 54.795 -0.097 1
1 244 . 13 1 1 A 29 29 ALA CB C 29 18.059 18.387 -0.328 1
1 245 . 13 1 1 A 29 29 ALA N N 29 120.122 122.467 -2.345 1
1 246 . 13 1 1 A 30 30 GLN H H 30 8.168 7.825 0.343 1
1 247 . 13 1 1 A 30 30 GLN HA H 30 3.811 4.163 -0.352 1
1 254 . 13 1 1 A 30 30 GLN C C 30 177.578 177.868 -0.290 1
1 255 . 13 1 1 A 30 30 GLN CA C 30 59.731 58.615 1.116 1
1 256 . 13 1 1 A 30 30 GLN CB C 30 28.161 28.528 -0.367 1
1 258 . 13 1 1 A 30 30 GLN N N 30 112.109 115.766 -3.657 1
1 260 . 13 1 1 A 31 31 GLU H H 31 7.248 8.245 -0.997 1
1 261 . 13 1 1 A 31 31 GLU HA H 31 4.063 4.024 0.039 1
1 266 . 13 1 1 A 31 31 GLU C C 31 177.423 179.029 -1.606 1
1 267 . 13 1 1 A 31 31 GLU CA C 31 57.650 59.136 -1.486 1
1 268 . 13 1 1 A 31 31 GLU CB C 31 29.757 29.365 0.392 1
1 270 . 13 1 1 A 31 31 GLU N N 31 115.340 119.549 -4.209 1
1 271 . 13 1 1 A 32 32 LEU H H 32 7.169 7.296 -0.127 1
1 272 . 13 1 1 A 32 32 LEU HA H 32 4.087 4.211 -0.124 1
1 282 . 13 1 1 A 32 32 LEU C C 32 175.850 177.123 -1.273 1
1 283 . 13 1 1 A 32 32 LEU CA C 32 55.580 57.048 -1.468 1
1 284 . 13 1 1 A 32 32 LEU CB C 32 42.910 41.445 1.465 1
1 288 . 13 1 1 A 32 32 LEU N N 32 116.367 114.168 2.199 1
1 289 . 13 1 1 A 33 33 LEU H H 33 7.062 7.610 -0.548 1
1 290 . 13 1 1 A 33 33 LEU HA H 33 4.431 4.238 0.193 1
1 300 . 13 1 1 A 33 33 LEU C C 33 174.837 177.061 -2.224 1
1 301 . 13 1 1 A 33 33 LEU CA C 33 53.521 55.071 -1.550 1
1 302 . 13 1 1 A 33 33 LEU CB C 33 43.301 41.140 2.161 1
1 306 . 13 1 1 A 33 33 LEU N N 33 118.568 122.557 -3.989 1
1 307 . 13 1 1 A 34 34 LYS H H 34 8.749 8.851 -0.102 1
1 308 . 13 1 1 A 34 34 LYS HA H 34 4.162 4.403 -0.241 1
1 317 . 13 1 1 A 34 34 LYS C C 34 174.378 175.582 -1.204 1
1 318 . 13 1 1 A 34 34 LYS CA C 34 56.575 56.250 0.325 1
1 319 . 13 1 1 A 34 34 LYS CB C 34 36.918 34.319 2.599 1
1 323 . 13 1 1 A 34 34 LYS N N 34 121.659 118.931 2.728 1
1 324 . 13 1 1 A 35 35 LYS H H 35 8.137 7.617 0.520 1
1 325 . 13 1 1 A 35 35 LYS HA H 35 4.011 4.491 -0.480 1
1 334 . 13 1 1 A 35 35 LYS C C 35 174.343 174.300 0.043 1
1 335 . 13 1 1 A 35 35 LYS CA C 35 53.960 54.397 -0.437 1
1 336 . 13 1 1 A 35 35 LYS CB C 35 35.587 35.383 0.204 1
1 340 . 13 1 1 A 35 35 LYS N N 35 119.354 116.133 3.221 1
1 341 . 13 1 1 A 36 36 GLN H H 36 8.394 8.608 -0.214 1
1 342 . 13 1 1 A 36 36 GLN HA H 36 4.187 4.415 -0.228 1
1 349 . 13 1 1 A 36 36 GLN C C 36 177.012 176.527 0.485 1
1 350 . 13 1 1 A 36 36 GLN CA C 36 57.750 57.541 0.209 1
1 351 . 13 1 1 A 36 36 GLN CB C 36 28.433 28.588 -0.155 1
1 353 . 13 1 1 A 36 36 GLN N N 36 120.248 122.322 -2.074 1
1 355 . 13 1 1 A 37 37 GLY H H 37 9.597 8.854 0.743 1
1 356 . 13 1 1 A 37 37 GLY HA2 H 37 4.486 4.120 0.366 1
1 357 . 13 1 1 A 37 37 GLY HA3 H 37 3.926 4.122 -0.196 1
1 358 . 13 1 1 A 37 37 GLY C C 37 176.285 174.525 1.760 1
1 359 . 13 1 1 A 37 37 GLY CA C 37 46.146 45.427 0.719 1
1 360 . 13 1 1 A 37 37 GLY N N 37 116.637 114.392 2.245 1
1 361 . 13 1 1 A 38 38 ASP H H 38 8.925 7.866 1.059 1
1 362 . 13 1 1 A 38 38 ASP HA H 38 5.697 4.650 1.047 1
1 365 . 13 1 1 A 38 38 ASP C C 38 176.181 175.690 0.491 1
1 366 . 13 1 1 A 38 38 ASP CA C 38 55.066 55.564 -0.498 1
1 367 . 13 1 1 A 38 38 ASP CB C 38 42.933 41.486 1.447 1
1 368 . 13 1 1 A 38 38 ASP N N 38 127.293 122.005 5.288 1
1 369 . 13 1 1 A 39 39 PHE H H 39 8.647 8.440 0.207 1
1 370 . 13 1 1 A 39 39 PHE HA H 39 6.025 5.749 0.276 1
1 378 . 13 1 1 A 39 39 PHE C C 39 170.948 173.018 -2.070 1
1 379 . 13 1 1 A 39 39 PHE CA C 39 56.376 56.145 0.231 1
1 380 . 13 1 1 A 39 39 PHE CB C 39 44.583 43.165 1.418 1
1 386 . 13 1 1 A 39 39 PHE N N 39 117.102 119.242 -2.140 1
1 387 . 13 1 1 A 40 40 LEU H H 40 9.186 9.055 0.131 1
1 388 . 13 1 1 A 40 40 LEU HA H 40 4.983 5.274 -0.291 1
1 398 . 13 1 1 A 40 40 LEU C C 40 174.787 174.395 0.392 1
1 399 . 13 1 1 A 40 40 LEU CA C 40 54.610 53.733 0.877 1
1 400 . 13 1 1 A 40 40 LEU CB C 40 44.330 45.873 -1.543 1
1 404 . 13 1 1 A 40 40 LEU N N 40 114.388 118.021 -3.633 1
1 405 . 13 1 1 A 41 41 VAL H H 41 9.390 9.361 0.029 1
1 406 . 13 1 1 A 41 41 VAL HA H 41 5.742 5.028 0.714 1
1 414 . 13 1 1 A 41 41 VAL C C 41 172.760 175.160 -2.400 1
1 415 . 13 1 1 A 41 41 VAL CA C 41 60.814 61.658 -0.844 1
1 416 . 13 1 1 A 41 41 VAL CB C 41 34.908 33.336 1.572 1
1 419 . 13 1 1 A 41 41 VAL N N 41 119.873 122.490 -2.617 1
1 420 . 13 1 1 A 42 42 ARG H H 42 9.598 9.163 0.435 1
1 421 . 13 1 1 A 42 42 ARG HA H 42 5.247 4.734 0.513 1
1 429 . 13 1 1 A 42 42 ARG C C 42 173.379 174.122 -0.743 1
1 430 . 13 1 1 A 42 42 ARG CA C 42 53.202 53.854 -0.652 1
1 431 . 13 1 1 A 42 42 ARG CB C 42 33.507 33.953 -0.446 1
1 434 . 13 1 1 A 42 42 ARG N N 42 124.179 124.608 -0.429 1
1 436 . 13 1 1 A 43 43 GLU H H 43 8.234 8.648 -0.414 1
1 437 . 13 1 1 A 43 43 GLU HA H 43 4.890 4.892 -0.002 1
1 442 . 13 1 1 A 43 43 GLU C C 43 176.929 176.165 0.764 1
1 443 . 13 1 1 A 43 43 GLU CA C 43 54.846 55.017 -0.171 1
1 444 . 13 1 1 A 43 43 GLU CB C 43 31.599 31.633 -0.034 1
1 446 . 13 1 1 A 43 43 GLU N N 43 124.103 123.031 1.072 1
1 447 . 13 1 1 A 44 44 SER H H 44 9.033 8.660 0.373 1
1 448 . 13 1 1 A 44 44 SER HA H 44 3.957 4.415 -0.458 1
1 451 . 13 1 1 A 44 44 SER C C 44 175.005 175.960 -0.955 1
1 452 . 13 1 1 A 44 44 SER CA C 44 59.393 57.460 1.933 1
1 453 . 13 1 1 A 44 44 SER CB C 44 63.619 63.942 -0.323 1
1 454 . 13 1 1 A 44 44 SER N N 44 124.316 120.494 3.822 1
1 455 . 13 1 1 A 45 45 HIS H H 45 8.461 8.727 -0.266 1
1 456 . 13 1 1 A 45 45 HIS HA H 45 4.132 4.297 -0.165 1
1 460 . 13 1 1 A 45 45 HIS C C 45 176.480 177.972 -1.492 1
1 461 . 13 1 1 A 45 45 HIS CA C 45 58.887 58.406 0.481 1
1 462 . 13 1 1 A 45 45 HIS CB C 45 30.180 28.892 1.288 1
1 464 . 13 1 1 A 45 45 HIS N N 45 127.694 126.154 1.540 1
1 465 . 13 1 1 A 46 46 GLY H H 46 8.513 7.948 0.565 1
1 466 . 13 1 1 A 46 46 GLY HA2 H 46 3.827 3.804 0.023 1
1 467 . 13 1 1 A 46 46 GLY HA3 H 46 3.827 3.815 0.012 1
1 468 . 13 1 1 A 46 46 GLY C C 46 173.630 174.349 -0.719 1
1 469 . 13 1 1 A 46 46 GLY CA C 46 45.188 46.736 -1.548 1
1 470 . 13 1 1 A 46 46 GLY N N 46 110.761 106.925 3.836 1
1 471 . 13 1 1 A 47 47 LYS H H 47 7.216 7.856 -0.640 1
1 472 . 13 1 1 A 47 47 LYS HA H 47 4.540 4.809 -0.269 1
1 481 . 13 1 1 A 47 47 LYS CA C 47 53.475 52.822 0.653 1
1 482 . 13 1 1 A 47 47 LYS CB C 47 33.325 34.195 -0.870 1
1 486 . 13 1 1 A 47 47 LYS N N 47 121.356 120.322 1.034 1
1 487 . 13 1 1 A 48 48 PRO HA H 48 4.181 4.267 -0.086 1
1 494 . 13 1 1 A 48 48 PRO C C 48 178.920 177.584 1.336 1
1 495 . 13 1 1 A 48 48 PRO CA C 48 63.239 63.917 -0.678 1
1 496 . 13 1 1 A 48 48 PRO CB C 48 31.523 31.536 -0.013 1
1 499 . 13 1 1 A 49 49 GLY H H 49 9.752 8.651 1.101 1
1 500 . 13 1 1 A 49 49 GLY HA2 H 49 4.053 3.957 0.096 1
1 501 . 13 1 1 A 49 49 GLY HA3 H 49 3.374 3.969 -0.595 1
1 502 . 13 1 1 A 49 49 GLY C C 49 172.093 174.199 -2.106 1
1 503 . 13 1 1 A 49 49 GLY CA C 49 45.041 45.099 -0.058 1
1 504 . 13 1 1 A 49 49 GLY N N 49 112.415 112.831 -0.416 1
1 505 . 13 1 1 A 50 50 GLU H H 50 7.623 7.966 -0.343 1
1 506 . 13 1 1 A 50 50 GLU HA H 50 4.537 4.430 0.107 1
1 511 . 13 1 1 A 50 50 GLU C C 50 173.297 175.219 -1.922 1
1 512 . 13 1 1 A 50 50 GLU CA C 50 55.174 56.042 -0.868 1
1 513 . 13 1 1 A 50 50 GLU CB C 50 31.651 29.632 2.019 1
1 515 . 13 1 1 A 50 50 GLU N N 50 121.600 121.988 -0.388 1
1 516 . 13 1 1 A 51 51 TYR H H 51 9.452 8.787 0.665 1
1 517 . 13 1 1 A 51 51 TYR HA H 51 5.382 5.520 -0.138 1
1 524 . 13 1 1 A 51 51 TYR C C 51 174.387 175.197 -0.810 1
1 525 . 13 1 1 A 51 51 TYR CA C 51 57.592 57.646 -0.054 1
1 526 . 13 1 1 A 51 51 TYR CB C 51 41.820 39.804 2.016 1
1 531 . 13 1 1 A 51 51 TYR N N 51 125.790 127.204 -1.414 1
1 532 . 13 1 1 A 52 52 VAL H H 52 9.471 9.388 0.083 1
1 533 . 13 1 1 A 52 52 VAL HA H 52 4.840 4.968 -0.128 1
1 541 . 13 1 1 A 52 52 VAL C C 52 174.947 174.757 0.190 1
1 542 . 13 1 1 A 52 52 VAL CA C 52 60.991 61.439 -0.448 1
1 543 . 13 1 1 A 52 52 VAL CB C 52 36.829 34.119 2.710 1
1 546 . 13 1 1 A 52 52 VAL N N 52 120.617 123.883 -3.266 1
1 547 . 13 1 1 A 53 53 LEU H H 53 9.457 9.445 0.012 1
1 548 . 13 1 1 A 53 53 LEU HA H 53 5.294 5.159 0.135 1
1 558 . 13 1 1 A 53 53 LEU C C 53 175.024 174.749 0.275 1
1 559 . 13 1 1 A 53 53 LEU CA C 53 53.904 54.283 -0.379 1
1 560 . 13 1 1 A 53 53 LEU CB C 53 44.756 43.473 1.283 1
1 564 . 13 1 1 A 53 53 LEU N N 53 127.725 131.235 -3.510 1
1 565 . 13 1 1 A 54 54 SER H H 54 9.461 9.188 0.273 1
1 566 . 13 1 1 A 54 54 SER HA H 54 5.691 5.543 0.148 1
1 569 . 13 1 1 A 54 54 SER C C 54 172.227 173.471 -1.244 1
1 570 . 13 1 1 A 54 54 SER CA C 54 58.551 57.799 0.752 1
1 571 . 13 1 1 A 54 54 SER CB C 54 65.738 64.020 1.718 1
1 572 . 13 1 1 A 54 54 SER N N 54 127.178 124.732 2.446 1
1 573 . 13 1 1 A 55 55 VAL H H 55 9.049 8.586 0.463 1
1 574 . 13 1 1 A 55 55 VAL HA H 55 5.691 5.292 0.399 1
1 582 . 13 1 1 A 55 55 VAL C C 55 173.959 173.127 0.832 1
1 583 . 13 1 1 A 55 55 VAL CA C 55 58.398 59.787 -1.389 1
1 584 . 13 1 1 A 55 55 VAL CB C 55 36.262 35.867 0.395 1
1 587 . 13 1 1 A 55 55 VAL N N 55 120.619 124.101 -3.482 1
1 588 . 13 1 1 A 56 56 TYR H H 56 8.629 9.317 -0.688 1
1 589 . 13 1 1 A 56 56 TYR HA H 56 4.951 4.931 0.020 1
1 596 . 13 1 1 A 56 56 TYR C C 56 175.224 174.409 0.815 1
1 597 . 13 1 1 A 56 56 TYR CA C 56 56.684 56.560 0.124 1
1 598 . 13 1 1 A 56 56 TYR CB C 56 39.646 38.795 0.851 1
1 603 . 13 1 1 A 56 56 TYR N N 56 127.444 130.154 -2.710 1
1 604 . 13 1 1 A 57 57 SER H H 57 8.869 8.751 0.118 1
1 605 . 13 1 1 A 57 57 SER HA H 57 4.739 5.165 -0.426 1
1 608 . 13 1 1 A 57 57 SER C C 57 174.492 172.914 1.578 1
1 609 . 13 1 1 A 57 57 SER CA C 57 57.591 56.743 0.848 1
1 610 . 13 1 1 A 57 57 SER CB C 57 64.281 66.119 -1.838 1
1 611 . 13 1 1 A 57 57 SER N N 57 122.165 123.015 -0.850 1
1 612 . 13 1 1 A 58 58 ASP H H 58 10.446 9.336 1.110 1
1 613 . 13 1 1 A 58 58 ASP HA H 58 4.382 4.288 0.094 1
1 616 . 13 1 1 A 58 58 ASP C C 58 176.398 176.159 0.239 1
1 617 . 13 1 1 A 58 58 ASP CA C 58 55.215 55.255 -0.040 1
1 618 . 13 1 1 A 58 58 ASP CB C 58 39.513 39.246 0.267 1
1 619 . 13 1 1 A 58 58 ASP N N 58 132.098 128.249 3.849 1
1 620 . 13 1 1 A 59 59 GLY H H 59 7.861 8.458 -0.597 1
1 621 . 13 1 1 A 59 59 GLY HA2 H 59 3.817 3.662 0.155 1
1 622 . 13 1 1 A 59 59 GLY HA3 H 59 4.086 3.748 0.338 1
1 623 . 13 1 1 A 59 59 GLY C C 59 173.111 173.256 -0.145 1
1 624 . 13 1 1 A 59 59 GLY CA C 59 45.486 45.118 0.368 1
1 625 . 13 1 1 A 59 59 GLY N N 59 102.674 104.819 -2.145 1
1 626 . 13 1 1 A 60 60 GLN H H 60 7.137 7.674 -0.537 1
1 627 . 13 1 1 A 60 60 GLN HA H 60 4.455 4.488 -0.033 1
1 634 . 13 1 1 A 60 60 GLN C C 60 173.549 174.892 -1.343 1
1 635 . 13 1 1 A 60 60 GLN CA C 60 53.388 53.684 -0.296 1
1 636 . 13 1 1 A 60 60 GLN CB C 60 32.373 30.833 1.540 1
1 638 . 13 1 1 A 60 60 GLN N N 60 116.206 119.182 -2.976 1
1 640 . 13 1 1 A 61 61 ARG H H 61 8.589 8.356 0.233 1
1 641 . 13 1 1 A 61 61 ARG HA H 61 4.740 4.372 0.368 1
1 649 . 13 1 1 A 61 61 ARG C C 61 174.458 174.553 -0.095 1
1 650 . 13 1 1 A 61 61 ARG CA C 61 57.116 55.500 1.616 1
1 651 . 13 1 1 A 61 61 ARG CB C 61 29.615 30.628 -1.013 1
1 654 . 13 1 1 A 61 61 ARG N N 61 120.467 121.969 -1.502 1
1 656 . 13 1 1 A 62 62 ARG H H 62 8.867 8.888 -0.021 1
1 657 . 13 1 1 A 62 62 ARG HA H 62 4.297 4.280 0.017 1
1 665 . 13 1 1 A 62 62 ARG C C 62 173.485 175.181 -1.696 1
1 666 . 13 1 1 A 62 62 ARG CA C 62 53.355 55.766 -2.411 1
1 667 . 13 1 1 A 62 62 ARG CB C 62 33.028 31.408 1.620 1
1 670 . 13 1 1 A 62 62 ARG N N 62 122.641 124.610 -1.969 1
1 672 . 13 1 1 A 63 63 HIS H H 63 7.997 8.131 -0.134 1
1 673 . 13 1 1 A 63 63 HIS HA H 63 5.427 5.024 0.403 1
1 678 . 13 1 1 A 63 63 HIS C C 63 174.946 174.036 0.910 1
1 679 . 13 1 1 A 63 63 HIS CA C 63 54.689 54.298 0.391 1
1 680 . 13 1 1 A 63 63 HIS CB C 63 33.008 32.597 0.411 1
1 683 . 13 1 1 A 63 63 HIS N N 63 119.064 118.155 0.909 1
1 684 . 13 1 1 A 64 64 PHE H H 64 9.880 9.268 0.612 1
1 685 . 13 1 1 A 64 64 PHE HA H 64 4.824 5.026 -0.202 1
1 693 . 13 1 1 A 64 64 PHE C C 64 174.882 175.185 -0.303 1
1 694 . 13 1 1 A 64 64 PHE CA C 64 56.489 56.477 0.012 1
1 695 . 13 1 1 A 64 64 PHE CB C 64 41.405 40.740 0.665 1
1 701 . 13 1 1 A 64 64 PHE N N 64 123.961 122.124 1.837 1
1 702 . 13 1 1 A 65 65 ILE H H 65 8.982 8.991 -0.009 1
1 703 . 13 1 1 A 65 65 ILE HA H 65 4.273 4.516 -0.243 1
1 713 . 13 1 1 A 65 65 ILE C C 65 176.556 176.026 0.530 1
1 714 . 13 1 1 A 65 65 ILE CA C 65 62.649 62.006 0.643 1
1 715 . 13 1 1 A 65 65 ILE CB C 65 38.296 38.015 0.281 1
1 719 . 13 1 1 A 65 65 ILE N N 65 126.601 125.661 0.940 1
1 720 . 13 1 1 A 66 66 ILE H H 66 8.947 8.923 0.024 1
1 721 . 13 1 1 A 66 66 ILE HA H 66 3.780 4.735 -0.955 1
1 731 . 13 1 1 A 66 66 ILE C C 66 175.721 175.914 -0.193 1
1 732 . 13 1 1 A 66 66 ILE CA C 66 62.960 61.078 1.882 1
1 733 . 13 1 1 A 66 66 ILE CB C 66 37.209 38.528 -1.319 1
1 737 . 13 1 1 A 66 66 ILE N N 66 130.139 128.958 1.181 1
1 738 . 13 1 1 A 67 67 GLN H H 67 8.410 8.919 -0.509 1
1 739 . 13 1 1 A 67 67 GLN HA H 67 4.422 5.009 -0.587 1
1 746 . 13 1 1 A 67 67 GLN C C 67 174.347 174.229 0.118 1
1 747 . 13 1 1 A 67 67 GLN CA C 67 55.867 55.245 0.622 1
1 748 . 13 1 1 A 67 67 GLN CB C 67 29.950 31.052 -1.102 1
1 750 . 13 1 1 A 67 67 GLN N N 67 128.872 126.846 2.026 1
1 752 . 13 1 1 A 68 68 TYR H H 68 8.619 8.790 -0.171 1
1 753 . 13 1 1 A 68 68 TYR HA H 68 5.300 5.240 0.060 1
1 760 . 13 1 1 A 68 68 TYR C C 68 174.695 173.968 0.727 1
1 761 . 13 1 1 A 68 68 TYR CA C 68 55.579 55.458 0.121 1
1 762 . 13 1 1 A 68 68 TYR CB C 68 39.479 40.608 -1.129 1
1 767 . 13 1 1 A 68 68 TYR N N 68 124.772 123.926 0.846 1
1 768 . 13 1 1 A 69 69 VAL H H 69 8.539 8.553 -0.014 1
1 769 . 13 1 1 A 69 69 VAL HA H 69 4.046 4.249 -0.203 1
1 777 . 13 1 1 A 69 69 VAL C C 69 175.010 175.440 -0.430 1
1 778 . 13 1 1 A 69 69 VAL CA C 69 60.611 60.905 -0.294 1
1 779 . 13 1 1 A 69 69 VAL CB C 69 35.358 34.389 0.969 1
1 782 . 13 1 1 A 69 69 VAL N N 69 126.652 127.474 -0.822 1
1 783 . 13 1 1 A 70 70 ASP H H 70 9.089 9.254 -0.165 1
1 784 . 13 1 1 A 70 70 ASP HA H 70 4.025 4.132 -0.107 1
1 787 . 13 1 1 A 70 70 ASP C C 70 174.813 175.101 -0.288 1
1 788 . 13 1 1 A 70 70 ASP CA C 70 55.623 55.377 0.246 1
1 789 . 13 1 1 A 70 70 ASP CB C 70 39.081 38.587 0.494 1
1 790 . 13 1 1 A 70 70 ASP N N 70 128.327 129.223 -0.896 1
1 791 . 13 1 1 A 71 71 ASN H H 71 8.128 8.148 -0.020 1
1 792 . 13 1 1 A 71 71 ASN HA H 71 3.597 4.028 -0.431 1
1 797 . 13 1 1 A 71 71 ASN C C 71 173.250 174.095 -0.845 1
1 798 . 13 1 1 A 71 71 ASN CA C 71 54.728 54.518 0.210 1
1 799 . 13 1 1 A 71 71 ASN CB C 71 37.601 36.928 0.673 1
1 800 . 13 1 1 A 71 71 ASN N N 71 107.230 107.256 -0.026 1
1 802 . 13 1 1 A 72 72 MET H H 72 7.256 7.523 -0.267 1
1 803 . 13 1 1 A 72 72 MET HA H 72 4.740 4.828 -0.088 1
1 808 . 13 1 1 A 72 72 MET C C 72 173.780 174.903 -1.123 1
1 809 . 13 1 1 A 72 72 MET CA C 72 53.703 53.897 -0.194 1
1 810 . 13 1 1 A 72 72 MET CB C 72 36.570 34.211 2.359 1
1 812 . 13 1 1 A 72 72 MET N N 72 117.117 118.363 -1.246 1
1 813 . 13 1 1 A 73 73 TYR H H 73 9.430 9.259 0.171 1
1 814 . 13 1 1 A 73 73 TYR HA H 73 5.718 5.278 0.440 1
1 821 . 13 1 1 A 73 73 TYR C C 73 176.140 175.877 0.263 1
1 822 . 13 1 1 A 73 73 TYR CA C 73 57.290 58.264 -0.974 1
1 823 . 13 1 1 A 73 73 TYR CB C 73 40.013 39.544 0.469 1
1 828 . 13 1 1 A 73 73 TYR N N 73 119.856 123.231 -3.375 1
1 829 . 13 1 1 A 74 74 ARG H H 74 9.038 9.107 -0.069 1
1 830 . 13 1 1 A 74 74 ARG HA H 74 4.867 4.998 -0.131 1
1 838 . 13 1 1 A 74 74 ARG C C 74 173.954 175.690 -1.736 1
1 839 . 13 1 1 A 74 74 ARG CA C 74 54.887 54.128 0.759 1
1 840 . 13 1 1 A 74 74 ARG CB C 74 34.484 33.946 0.538 1
1 843 . 13 1 1 A 74 74 ARG N N 74 117.344 120.665 -3.321 1
1 845 . 13 1 1 A 75 75 PHE H H 75 9.005 8.914 0.091 1
1 846 . 13 1 1 A 75 75 PHE HA H 75 5.046 4.495 0.551 1
1 854 . 13 1 1 A 75 75 PHE C C 75 176.186 176.990 -0.804 1
1 855 . 13 1 1 A 75 75 PHE CA C 75 59.658 60.591 -0.933 1
1 856 . 13 1 1 A 75 75 PHE CB C 75 39.356 40.049 -0.693 1
1 862 . 13 1 1 A 75 75 PHE N N 75 117.865 121.365 -3.500 1
1 863 . 13 1 1 A 76 76 GLU H H 76 8.213 8.264 -0.051 1
1 864 . 13 1 1 A 76 76 GLU HA H 76 4.586 4.620 -0.034 1
1 869 . 13 1 1 A 76 76 GLU C C 76 175.238 177.774 -2.536 1
1 870 . 13 1 1 A 76 76 GLU CA C 76 55.994 56.956 -0.962 1
1 871 . 13 1 1 A 76 76 GLU CB C 76 31.805 31.388 0.417 1
1 873 . 13 1 1 A 76 76 GLU N N 76 116.834 115.453 1.381 1
1 874 . 13 1 1 A 77 77 GLY H H 77 8.692 7.720 0.972 1
1 875 . 13 1 1 A 77 77 GLY HA2 H 77 4.166 4.095 0.071 1
1 876 . 13 1 1 A 77 77 GLY HA3 H 77 4.015 4.097 -0.082 1
1 877 . 13 1 1 A 77 77 GLY C C 77 173.784 174.527 -0.743 1
1 878 . 13 1 1 A 77 77 GLY CA C 77 45.505 46.164 -0.659 1
1 879 . 13 1 1 A 77 77 GLY N N 77 111.937 107.607 4.330 1
1 880 . 13 1 1 A 78 78 THR H H 78 8.332 7.857 0.475 1
1 881 . 13 1 1 A 78 78 THR HA H 78 3.900 4.251 -0.351 1
1 886 . 13 1 1 A 78 78 THR C C 78 173.591 174.497 -0.906 1
1 887 . 13 1 1 A 78 78 THR CA C 78 63.653 63.152 0.501 1
1 888 . 13 1 1 A 78 78 THR CB C 78 69.649 69.152 0.497 1
1 890 . 13 1 1 A 78 78 THR N N 78 120.765 115.085 5.680 1
1 891 . 13 1 1 A 79 79 GLY H H 79 8.038 8.508 -0.470 1
1 892 . 13 1 1 A 79 79 GLY HA2 H 79 4.748 4.357 0.391 1
1 893 . 13 1 1 A 79 79 GLY HA3 H 79 3.546 4.497 -0.951 1
1 894 . 13 1 1 A 79 79 GLY C C 79 172.580 172.012 0.568 1
1 895 . 13 1 1 A 79 79 GLY CA C 79 44.661 45.629 -0.968 1
1 896 . 13 1 1 A 79 79 GLY N N 79 109.887 112.794 -2.907 1
1 897 . 13 1 1 A 80 80 PHE H H 80 9.064 8.455 0.609 1
1 898 . 13 1 1 A 80 80 PHE HA H 80 4.886 4.982 -0.096 1
1 906 . 13 1 1 A 80 80 PHE C C 80 176.507 176.183 0.324 1
1 907 . 13 1 1 A 80 80 PHE CA C 80 57.257 56.741 0.516 1
1 908 . 13 1 1 A 80 80 PHE CB C 80 44.655 42.658 1.997 1
1 914 . 13 1 1 A 80 80 PHE N N 80 116.862 119.543 -2.681 1
1 915 . 13 1 1 A 81 81 SER H H 81 9.413 8.751 0.662 1
1 916 . 13 1 1 A 81 81 SER HA H 81 4.622 4.771 -0.149 1
1 919 . 13 1 1 A 81 81 SER C C 81 173.735 174.768 -1.033 1
1 920 . 13 1 1 A 81 81 SER CA C 81 61.410 61.555 -0.145 1
1 921 . 13 1 1 A 81 81 SER CB C 81 64.165 63.431 0.734 1
1 922 . 13 1 1 A 81 81 SER N N 81 116.467 116.258 0.209 1
1 923 . 13 1 1 A 82 82 ASN H H 82 7.688 8.159 -0.471 1
1 924 . 13 1 1 A 82 82 ASN HA H 82 4.952 5.233 -0.281 1
1 929 . 13 1 1 A 82 82 ASN C C 82 173.303 175.561 -2.258 1
1 930 . 13 1 1 A 82 82 ASN CA C 82 52.086 52.187 -0.101 1
1 931 . 13 1 1 A 82 82 ASN CB C 82 41.258 40.778 0.480 1
1 932 . 13 1 1 A 82 82 ASN N N 82 113.355 117.304 -3.949 1
1 934 . 13 1 1 A 83 83 ILE H H 83 8.858 8.664 0.194 1
1 935 . 13 1 1 A 83 83 ILE HA H 83 3.571 3.741 -0.170 1
1 945 . 13 1 1 A 83 83 ILE CA C 83 66.416 65.217 1.199 1
1 946 . 13 1 1 A 83 83 ILE CB C 83 35.074 34.563 0.511 1
1 950 . 13 1 1 A 83 83 ILE N N 83 118.908 123.619 -4.711 1
1 951 . 13 1 1 A 84 84 PRO HA H 84 4.411 4.700 -0.289 1
1 958 . 13 1 1 A 84 84 PRO C C 84 177.616 179.373 -1.757 1
1 959 . 13 1 1 A 84 84 PRO CA C 84 67.525 66.652 0.873 1
1 960 . 13 1 1 A 84 84 PRO CB C 84 31.029 30.994 0.035 1
1 963 . 13 1 1 A 85 85 GLN H H 85 8.405 8.380 0.025 1
1 964 . 13 1 1 A 85 85 GLN HA H 85 3.874 4.008 -0.134 1
1 971 . 13 1 1 A 85 85 GLN C C 85 178.213 178.319 -0.106 1
1 972 . 13 1 1 A 85 85 GLN CA C 85 59.495 58.452 1.043 1
1 973 . 13 1 1 A 85 85 GLN CB C 85 29.270 28.284 0.986 1
1 975 . 13 1 1 A 85 85 GLN N N 85 115.597 117.239 -1.642 1
1 977 . 13 1 1 A 86 86 LEU H H 86 7.136 8.197 -1.061 1
1 978 . 13 1 1 A 86 86 LEU HA H 86 3.589 3.659 -0.070 1
1 988 . 13 1 1 A 86 86 LEU C C 86 177.728 178.439 -0.711 1
1 989 . 13 1 1 A 86 86 LEU CA C 86 58.136 58.333 -0.197 1
1 990 . 13 1 1 A 86 86 LEU CB C 86 42.290 41.772 0.518 1
1 994 . 13 1 1 A 86 86 LEU N N 86 121.840 121.923 -0.083 1
1 995 . 13 1 1 A 87 87 ILE H H 87 8.323 7.882 0.441 1
1 996 . 13 1 1 A 87 87 ILE HA H 87 3.415 3.377 0.038 1
1 1006 . 13 1 1 A 87 87 ILE C C 87 178.064 177.640 0.424 1
1 1007 . 13 1 1 A 87 87 ILE CA C 87 61.458 65.322 -3.864 1
1 1008 . 13 1 1 A 87 87 ILE CB C 87 34.561 37.635 -3.074 1
1 1012 . 13 1 1 A 87 87 ILE N N 87 118.117 119.500 -1.383 1
1 1013 . 13 1 1 A 88 88 ASP H H 88 8.805 8.292 0.513 1
1 1014 . 13 1 1 A 88 88 ASP HA H 88 4.548 4.195 0.353 1
1 1017 . 13 1 1 A 88 88 ASP C C 88 179.265 178.114 1.151 1
1 1018 . 13 1 1 A 88 88 ASP CA C 88 58.099 57.290 0.809 1
1 1019 . 13 1 1 A 88 88 ASP CB C 88 42.166 41.877 0.289 1
1 1020 . 13 1 1 A 88 88 ASP N N 88 119.143 120.392 -1.249 1
1 1021 . 13 1 1 A 89 89 HIS H H 89 8.113 7.964 0.149 1
1 1022 . 13 1 1 A 89 89 HIS HA H 89 4.225 4.316 -0.091 1
1 1026 . 13 1 1 A 89 89 HIS C C 89 179.261 177.224 2.037 1
1 1027 . 13 1 1 A 89 89 HIS CA C 89 60.647 58.873 1.774 1
1 1028 . 13 1 1 A 89 89 HIS CB C 89 30.801 29.392 1.409 1
1 1030 . 13 1 1 A 89 89 HIS N N 89 119.595 119.058 0.537 1
1 1031 . 13 1 1 A 90 90 HIS H H 90 7.685 7.756 -0.071 1
1 1032 . 13 1 1 A 90 90 HIS HA H 90 3.628 4.074 -0.446 1
1 1036 . 13 1 1 A 90 90 HIS C C 90 178.454 177.515 0.939 1
1 1037 . 13 1 1 A 90 90 HIS CA C 90 61.797 60.149 1.648 1
1 1038 . 13 1 1 A 90 90 HIS CB C 90 28.165 29.792 -1.627 1
1 1040 . 13 1 1 A 90 90 HIS N N 90 120.061 117.362 2.699 1
1 1041 . 13 1 1 A 91 91 TYR H H 91 9.394 8.288 1.106 1
1 1042 . 13 1 1 A 91 91 TYR HA H 91 4.238 3.832 0.406 1
1 1049 . 13 1 1 A 91 91 TYR C C 91 176.443 177.818 -1.375 1
1 1050 . 13 1 1 A 91 91 TYR CA C 91 60.669 61.827 -1.158 1
1 1051 . 13 1 1 A 91 91 TYR CB C 91 39.169 39.016 0.153 1
1 1056 . 13 1 1 A 91 91 TYR N N 91 123.532 120.136 3.396 1
1 1057 . 13 1 1 A 92 92 THR H H 92 8.774 8.428 0.346 1
1 1058 . 13 1 1 A 92 92 THR HA H 92 3.866 3.975 -0.109 1
1 1063 . 13 1 1 A 92 92 THR C C 92 177.050 175.711 1.339 1
1 1064 . 13 1 1 A 92 92 THR CA C 92 65.240 65.022 0.218 1
1 1065 . 13 1 1 A 92 92 THR CB C 92 69.298 68.669 0.629 1
1 1067 . 13 1 1 A 92 92 THR N N 92 112.000 112.446 -0.446 1
1 1068 . 13 1 1 A 93 93 THR H H 93 7.617 7.201 0.416 1
1 1069 . 13 1 1 A 93 93 THR HA H 93 4.133 4.224 -0.091 1
1 1074 . 13 1 1 A 93 93 THR C C 93 176.234 174.932 1.302 1
1 1075 . 13 1 1 A 93 93 THR CA C 93 63.527 61.722 1.805 1
1 1076 . 13 1 1 A 93 93 THR CB C 93 71.234 69.810 1.424 1
1 1078 . 13 1 1 A 93 93 THR N N 93 109.883 110.529 -0.646 1
1 1079 . 13 1 1 A 94 94 LYS H H 94 7.210 7.725 -0.515 1
1 1080 . 13 1 1 A 94 94 LYS HA H 94 3.830 3.716 0.114 1
1 1089 . 13 1 1 A 94 94 LYS C C 94 174.331 175.040 -0.709 1
1 1090 . 13 1 1 A 94 94 LYS CA C 94 56.776 57.448 -0.672 1
1 1091 . 13 1 1 A 94 94 LYS CB C 94 28.095 31.303 -3.208 1
1 1095 . 13 1 1 A 94 94 LYS N N 94 112.818 121.278 -8.460 1
1 1096 . 13 1 1 A 95 95 GLN H H 95 7.439 7.548 -0.109 1
1 1097 . 13 1 1 A 95 95 GLN HA H 95 4.216 4.561 -0.345 1
1 1104 . 13 1 1 A 95 95 GLN C C 95 179.087 175.713 3.374 1
1 1105 . 13 1 1 A 95 95 GLN CA C 95 56.378 55.066 1.312 1
1 1106 . 13 1 1 A 95 95 GLN CB C 95 28.542 30.478 -1.936 1
1 1108 . 13 1 1 A 95 95 GLN N N 95 117.860 119.091 -1.231 1
1 1110 . 13 1 1 A 96 96 VAL H H 96 8.520 8.498 0.022 1
1 1111 . 13 1 1 A 96 96 VAL HA H 96 4.297 4.837 -0.540 1
1 1119 . 13 1 1 A 96 96 VAL C C 96 177.329 176.532 0.797 1
1 1120 . 13 1 1 A 96 96 VAL CA C 96 61.196 61.513 -0.317 1
1 1121 . 13 1 1 A 96 96 VAL CB C 96 32.735 33.536 -0.801 1
1 1124 . 13 1 1 A 96 96 VAL N N 96 124.208 118.706 5.502 1
1 1125 . 13 1 1 A 97 97 ILE H H 97 8.491 8.666 -0.175 1
1 1126 . 13 1 1 A 97 97 ILE HA H 97 2.995 3.633 -0.638 1
1 1136 . 13 1 1 A 97 97 ILE CA C 97 62.066 62.706 -0.640 1
1 1137 . 13 1 1 A 97 97 ILE CB C 97 36.117 37.838 -1.721 1
1 1141 . 13 1 1 A 97 97 ILE N N 97 119.561 123.546 -3.985 1
1 1142 . 13 1 1 A 98 98 THR HA H 98 4.460 4.494 -0.034 1
1 1147 . 13 1 1 A 98 98 THR C C 98 174.335 174.882 -0.547 1
1 1148 . 13 1 1 A 98 98 THR CA C 98 58.244 59.269 -1.025 1
1 1149 . 13 1 1 A 98 98 THR CB C 98 73.056 71.329 1.727 1
1 1151 . 13 1 1 A 99 99 LYS H H 99 9.761 9.187 0.574 1
1 1152 . 13 1 1 A 99 99 LYS HA H 99 3.911 3.971 -0.060 1
1 1161 . 13 1 1 A 99 99 LYS C C 99 179.594 178.450 1.144 1
1 1162 . 13 1 1 A 99 99 LYS CA C 99 59.661 59.784 -0.123 1
1 1163 . 13 1 1 A 99 99 LYS CB C 99 31.978 32.031 -0.053 1
1 1167 . 13 1 1 A 99 99 LYS N N 99 125.750 122.735 3.015 1
1 1168 . 13 1 1 A 100 100 LYS H H 100 8.910 7.449 1.461 1
1 1169 . 13 1 1 A 100 100 LYS HA H 100 4.024 4.061 -0.037 1
1 1178 . 13 1 1 A 100 100 LYS C C 100 178.060 177.953 0.107 1
1 1179 . 13 1 1 A 100 100 LYS CA C 100 58.642 58.784 -0.142 1
1 1180 . 13 1 1 A 100 100 LYS CB C 100 32.750 32.492 0.258 1
1 1184 . 13 1 1 A 100 100 LYS N N 100 117.112 120.542 -3.430 1
1 1185 . 13 1 1 A 101 101 SER H H 101 7.721 7.642 0.079 1
1 1186 . 13 1 1 A 101 101 SER HA H 101 4.282 4.617 -0.335 1
1 1189 . 13 1 1 A 101 101 SER C C 101 176.403 175.795 0.608 1
1 1190 . 13 1 1 A 101 101 SER CA C 101 60.442 58.591 1.851 1
1 1191 . 13 1 1 A 101 101 SER CB C 101 63.775 65.154 -1.379 1
1 1192 . 13 1 1 A 101 101 SER N N 101 112.069 110.439 1.630 1
1 1193 . 13 1 1 A 102 102 GLY H H 102 8.038 8.404 -0.366 1
1 1194 . 13 1 1 A 102 102 GLY HA2 H 102 4.024 3.872 0.152 1
1 1195 . 13 1 1 A 102 102 GLY HA3 H 102 3.713 3.892 -0.179 1
1 1196 . 13 1 1 A 102 102 GLY C C 102 173.991 174.544 -0.553 1
1 1197 . 13 1 1 A 102 102 GLY CA C 102 46.458 46.300 0.158 1
1 1198 . 13 1 1 A 102 102 GLY N N 102 111.144 110.600 0.544 1
1 1199 . 13 1 1 A 103 103 VAL H H 103 7.155 7.511 -0.356 1
1 1200 . 13 1 1 A 103 103 VAL HA H 103 3.652 3.986 -0.334 1
1 1208 . 13 1 1 A 103 103 VAL C C 103 173.805 175.220 -1.415 1
1 1209 . 13 1 1 A 103 103 VAL CA C 103 64.310 62.877 1.433 1
1 1210 . 13 1 1 A 103 103 VAL CB C 103 32.254 31.831 0.423 1
1 1213 . 13 1 1 A 103 103 VAL N N 103 119.836 120.974 -1.138 1
1 1214 . 13 1 1 A 104 104 VAL H H 104 7.653 9.139 -1.486 1
1 1215 . 13 1 1 A 104 104 VAL HA H 104 4.048 4.441 -0.393 1
1 1223 . 13 1 1 A 104 104 VAL C C 104 175.708 174.490 1.218 1
1 1224 . 13 1 1 A 104 104 VAL CA C 104 60.275 60.851 -0.576 1
1 1225 . 13 1 1 A 104 104 VAL CB C 104 35.112 34.035 1.077 1
1 1228 . 13 1 1 A 104 104 VAL N N 104 125.859 128.641 -2.782 1
1 1229 . 13 1 1 A 105 105 LEU H H 105 8.616 8.492 0.124 1
1 1230 . 13 1 1 A 105 105 LEU HA H 105 3.905 4.681 -0.776 1
1 1240 . 13 1 1 A 105 105 LEU C C 105 175.380 175.842 -0.462 1
1 1241 . 13 1 1 A 105 105 LEU CA C 105 54.471 53.844 0.627 1
1 1242 . 13 1 1 A 105 105 LEU CB C 105 39.821 41.111 -1.290 1
1 1246 . 13 1 1 A 105 105 LEU N N 105 123.839 126.839 -3.000 1
1 1247 . 13 1 1 A 106 106 LEU H H 106 8.894 8.550 0.344 1
1 1248 . 13 1 1 A 106 106 LEU HA H 106 4.839 4.998 -0.159 1
1 1258 . 13 1 1 A 106 106 LEU C C 106 176.930 176.304 0.626 1
1 1259 . 13 1 1 A 106 106 LEU CA C 106 56.288 53.066 3.222 1
1 1260 . 13 1 1 A 106 106 LEU CB C 106 45.237 45.502 -0.265 1
1 1264 . 13 1 1 A 106 106 LEU N N 106 120.590 121.430 -0.840 1
1 1265 . 13 1 1 A 107 107 ASN H H 107 8.124 8.984 -0.860 1
1 1266 . 13 1 1 A 107 107 ASN HA H 107 5.650 4.625 1.025 1
1 1271 . 13 1 1 A 107 107 ASN CA C 107 50.293 53.955 -3.662 1
1 1272 . 13 1 1 A 107 107 ASN CB C 107 41.223 36.190 5.033 1
1 1273 . 13 1 1 A 107 107 ASN N N 107 116.866 117.599 -0.733 1
1 1275 . 13 1 1 A 108 108 PRO HA H 108 2.926 3.883 -0.957 1
1 1282 . 13 1 1 A 108 108 PRO C C 108 176.671 175.317 1.354 1
1 1283 . 13 1 1 A 108 108 PRO CA C 108 60.804 62.571 -1.767 1
1 1284 . 13 1 1 A 108 108 PRO CB C 108 31.774 32.088 -0.314 1
1 1287 . 13 1 1 A 109 109 ILE H H 109 8.648 8.072 0.576 1
1 1288 . 13 1 1 A 109 109 ILE HA H 109 4.519 4.456 0.063 1
1 1298 . 13 1 1 A 109 109 ILE CA C 109 55.070 58.613 -3.543 1
1 1299 . 13 1 1 A 109 109 ILE CB C 109 36.068 38.546 -2.478 1
1 1303 . 13 1 1 A 109 109 ILE N N 109 128.817 122.335 6.482 1
1 1304 . 13 1 1 A 110 110 PRO HA H 110 4.587 4.636 -0.049 1
1 1311 . 13 1 1 A 110 110 PRO C C 110 177.013 176.004 1.009 1
1 1312 . 13 1 1 A 110 110 PRO CA C 110 61.850 62.171 -0.321 1
1 1313 . 13 1 1 A 110 110 PRO CB C 110 32.507 33.114 -0.607 1
1 1316 . 13 1 1 A 111 111 LYS H H 111 8.038 8.436 -0.398 1
1 1317 . 13 1 1 A 111 111 LYS HA H 111 3.553 4.842 -1.289 1
1 1326 . 13 1 1 A 111 111 LYS C C 111 176.123 174.560 1.563 1
1 1327 . 13 1 1 A 111 111 LYS CA C 111 56.220 54.288 1.932 1
1 1328 . 13 1 1 A 111 111 LYS CB C 111 32.373 35.556 -3.183 1
1 1332 . 13 1 1 A 111 111 LYS N N 111 120.147 116.488 3.659 1
1 1333 . 13 1 1 A 112 112 ASP H H 112 8.463 8.502 -0.039 1
1 1334 . 13 1 1 A 112 112 ASP HA H 112 4.523 4.619 -0.096 1
1 1337 . 13 1 1 A 112 112 ASP C C 112 175.986 176.257 -0.271 1
1 1338 . 13 1 1 A 112 112 ASP CA C 112 54.256 54.090 0.166 1
1 1339 . 13 1 1 A 112 112 ASP CB C 112 41.563 41.587 -0.024 1
1 1340 . 13 1 1 A 112 112 ASP N N 112 121.863 122.755 -0.892 1
1 1341 . 13 1 1 A 113 113 LYS H H 113 8.059 8.423 -0.364 1
1 1342 . 13 1 1 A 113 113 LYS HA H 113 4.136 4.278 -0.142 1
1 1351 . 13 1 1 A 113 113 LYS C C 113 176.010 175.197 0.813 1
1 1352 . 13 1 1 A 113 113 LYS CA C 113 56.253 55.717 0.536 1
1 1353 . 13 1 1 A 113 113 LYS CB C 113 32.754 30.900 1.854 1
1 1357 . 13 1 1 A 113 113 LYS N N 113 121.725 122.015 -0.290 1
1 1358 . 13 1 1 A 114 114 LYS H H 114 8.225 7.746 0.479 1
1 1359 . 13 1 1 A 114 114 LYS HA H 114 4.169 4.951 -0.782 1
1 1368 . 13 1 1 A 114 114 LYS C C 114 176.198 175.314 0.884 1
1 1369 . 13 1 1 A 114 114 LYS CA C 114 56.413 54.484 1.929 1
1 1370 . 13 1 1 A 114 114 LYS CB C 114 32.725 36.181 -3.456 1
1 1374 . 13 1 1 A 114 114 LYS N N 114 121.857 119.320 2.537 1
1 1375 . 13 1 1 A 115 115 TRP H H 115 8.078 8.753 -0.675 1
1 1376 . 13 1 1 A 115 115 TRP HA H 115 4.709 4.899 -0.190 1
1 1385 . 13 1 1 A 115 115 TRP C C 115 175.119 176.564 -1.445 1
1 1386 . 13 1 1 A 115 115 TRP CA C 115 56.856 57.341 -0.485 1
1 1387 . 13 1 1 A 115 115 TRP CB C 115 29.474 31.040 -1.566 1
1 1393 . 13 1 1 A 115 115 TRP N N 115 122.068 119.548 2.520 1
1 1 . 14 1 1 A 10 10 HIS HA H 10 4.616 4.938 -0.322 1
1 4 . 14 1 1 A 10 10 HIS C C 10 174.981 174.952 0.029 1
1 5 . 14 1 1 A 10 10 HIS CA C 10 56.555 54.638 1.917 1
1 6 . 14 1 1 A 10 10 HIS CB C 10 30.231 29.863 0.368 1
1 7 . 14 1 1 A 11 11 MET H H 11 8.103 7.086 1.017 1
1 8 . 14 1 1 A 11 11 MET HA H 11 4.439 5.004 -0.565 1
1 13 . 14 1 1 A 11 11 MET C C 11 175.888 175.419 0.469 1
1 14 . 14 1 1 A 11 11 MET CA C 11 55.090 53.814 1.276 1
1 15 . 14 1 1 A 11 11 MET CB C 11 33.121 33.107 0.014 1
1 17 . 14 1 1 A 11 11 MET N N 11 120.743 120.330 0.413 1
1 18 . 14 1 1 A 12 12 LYS H H 12 8.065 8.576 -0.511 1
1 19 . 14 1 1 A 12 12 LYS HA H 12 4.407 4.705 -0.298 1
1 28 . 14 1 1 A 12 12 LYS CA C 12 54.894 52.868 2.026 1
1 29 . 14 1 1 A 12 12 LYS CB C 12 31.863 33.823 -1.960 1
1 33 . 14 1 1 A 12 12 LYS N N 12 123.187 123.513 -0.326 1
1 34 . 14 1 1 A 13 13 PRO HA H 13 4.347 4.472 -0.125 1
1 41 . 14 1 1 A 13 13 PRO C C 13 176.891 177.713 -0.822 1
1 42 . 14 1 1 A 13 13 PRO CA C 13 62.542 62.483 0.059 1
1 43 . 14 1 1 A 13 13 PRO CB C 13 32.663 32.478 0.185 1
1 46 . 14 1 1 A 14 14 LEU H H 14 8.339 8.755 -0.416 1
1 47 . 14 1 1 A 14 14 LEU HA H 14 3.373 3.896 -0.523 1
1 57 . 14 1 1 A 14 14 LEU C C 14 176.683 178.163 -1.480 1
1 58 . 14 1 1 A 14 14 LEU CA C 14 58.555 57.645 0.910 1
1 59 . 14 1 1 A 14 14 LEU CB C 14 41.828 41.002 0.826 1
1 63 . 14 1 1 A 14 14 LEU N N 14 123.191 124.807 -1.616 1
1 64 . 14 1 1 A 15 15 ALA H H 15 8.175 7.781 0.394 1
1 65 . 14 1 1 A 15 15 ALA HA H 15 3.983 4.008 -0.025 1
1 69 . 14 1 1 A 15 15 ALA C C 15 178.697 178.835 -0.138 1
1 70 . 14 1 1 A 15 15 ALA CA C 15 54.164 54.555 -0.391 1
1 71 . 14 1 1 A 15 15 ALA CB C 15 18.771 18.444 0.327 1
1 72 . 14 1 1 A 15 15 ALA N N 15 113.594 119.843 -6.249 1
1 73 . 14 1 1 A 16 16 GLU H H 16 7.458 7.632 -0.174 1
1 74 . 14 1 1 A 16 16 GLU HA H 16 4.266 4.405 -0.139 1
1 79 . 14 1 1 A 16 16 GLU C C 16 176.510 176.605 -0.095 1
1 80 . 14 1 1 A 16 16 GLU CA C 16 55.196 56.172 -0.976 1
1 81 . 14 1 1 A 16 16 GLU CB C 16 30.907 30.175 0.732 1
1 83 . 14 1 1 A 16 16 GLU N N 16 113.348 115.139 -1.791 1
1 84 . 14 1 1 A 17 17 GLN H H 17 7.501 7.071 0.430 1
1 85 . 14 1 1 A 17 17 GLN HA H 17 3.683 3.960 -0.277 1
1 92 . 14 1 1 A 17 17 GLN C C 17 178.053 176.644 1.409 1
1 93 . 14 1 1 A 17 17 GLN CA C 17 54.606 55.321 -0.715 1
1 94 . 14 1 1 A 17 17 GLN CB C 17 25.758 28.131 -2.373 1
1 96 . 14 1 1 A 17 17 GLN N N 17 119.411 119.721 -0.310 1
1 98 . 14 1 1 A 18 18 ASP H H 18 8.949 8.537 0.412 1
1 99 . 14 1 1 A 18 18 ASP HA H 18 4.184 4.063 0.121 1
1 102 . 14 1 1 A 18 18 ASP C C 18 175.263 177.726 -2.463 1
1 103 . 14 1 1 A 18 18 ASP CA C 18 57.275 56.670 0.605 1
1 104 . 14 1 1 A 18 18 ASP CB C 18 40.620 39.758 0.862 1
1 105 . 14 1 1 A 18 18 ASP N N 18 124.676 123.921 0.755 1
1 106 . 14 1 1 A 19 19 TRP H H 19 6.068 7.147 -1.079 1
1 107 . 14 1 1 A 19 19 TRP HA H 19 5.045 4.562 0.483 1
1 116 . 14 1 1 A 19 19 TRP C C 19 175.902 176.387 -0.485 1
1 117 . 14 1 1 A 19 19 TRP CA C 19 53.542 57.797 -4.255 1
1 118 . 14 1 1 A 19 19 TRP CB C 19 29.179 28.843 0.336 1
1 124 . 14 1 1 A 19 19 TRP N N 19 107.757 116.716 -8.959 1
1 126 . 14 1 1 A 20 20 TYR H H 20 7.430 7.536 -0.106 1
1 127 . 14 1 1 A 20 20 TYR HA H 20 5.601 5.463 0.138 1
1 132 . 14 1 1 A 20 20 TYR C C 20 175.498 174.443 1.055 1
1 133 . 14 1 1 A 20 20 TYR CA C 20 56.967 56.849 0.118 1
1 134 . 14 1 1 A 20 20 TYR CB C 20 39.083 38.481 0.602 1
1 137 . 14 1 1 A 20 20 TYR N N 20 123.173 122.456 0.717 1
1 138 . 14 1 1 A 21 21 HIS H H 21 8.934 8.758 0.176 1
1 139 . 14 1 1 A 21 21 HIS HA H 21 4.295 4.549 -0.254 1
1 144 . 14 1 1 A 21 21 HIS C C 21 175.177 174.584 0.593 1
1 145 . 14 1 1 A 21 21 HIS CA C 21 56.572 53.891 2.681 1
1 146 . 14 1 1 A 21 21 HIS CB C 21 33.365 27.465 5.900 1
1 149 . 14 1 1 A 21 21 HIS N N 21 125.732 126.685 -0.953 1
1 150 . 14 1 1 A 22 22 GLY H H 22 5.280 7.780 -2.500 1
1 151 . 14 1 1 A 22 22 GLY HA2 H 22 3.905 3.601 0.304 1
1 152 . 14 1 1 A 22 22 GLY HA3 H 22 3.585 3.672 -0.087 1
1 153 . 14 1 1 A 22 22 GLY C C 22 174.411 174.023 0.388 1
1 154 . 14 1 1 A 22 22 GLY CA C 22 46.402 46.791 -0.389 1
1 155 . 14 1 1 A 22 22 GLY N N 22 104.568 109.039 -4.471 1
1 156 . 14 1 1 A 23 23 ALA H H 23 8.768 7.946 0.822 1
1 157 . 14 1 1 A 23 23 ALA HA H 23 5.171 4.156 1.015 1
1 161 . 14 1 1 A 23 23 ALA C C 23 177.180 176.581 0.599 1
1 162 . 14 1 1 A 23 23 ALA CA C 23 51.153 52.550 -1.397 1
1 163 . 14 1 1 A 23 23 ALA CB C 23 16.999 17.299 -0.300 1
1 164 . 14 1 1 A 23 23 ALA N N 23 130.297 115.304 14.993 1
1 165 . 14 1 1 A 24 24 ILE H H 24 7.267 7.589 -0.322 1
1 166 . 14 1 1 A 24 24 ILE HA H 24 4.460 4.402 0.058 1
1 176 . 14 1 1 A 24 24 ILE CA C 24 58.529 59.628 -1.099 1
1 177 . 14 1 1 A 24 24 ILE CB C 24 38.763 37.694 1.069 1
1 181 . 14 1 1 A 24 24 ILE N N 24 118.903 113.805 5.098 1
1 182 . 14 1 1 A 25 25 PRO HA H 25 4.224 4.648 -0.424 1
1 189 . 14 1 1 A 25 25 PRO C C 25 176.918 177.726 -0.808 1
1 190 . 14 1 1 A 25 25 PRO CA C 25 62.907 62.865 0.042 1
1 191 . 14 1 1 A 25 25 PRO CB C 25 32.671 32.703 -0.032 1
1 194 . 14 1 1 A 26 26 ARG H H 26 8.781 9.120 -0.339 1
1 195 . 14 1 1 A 26 26 ARG HA H 26 3.472 3.923 -0.451 1
1 202 . 14 1 1 A 26 26 ARG C C 26 178.112 177.992 0.120 1
1 203 . 14 1 1 A 26 26 ARG CA C 26 60.863 59.553 1.310 1
1 204 . 14 1 1 A 26 26 ARG CB C 26 30.314 29.832 0.482 1
1 207 . 14 1 1 A 26 26 ARG N N 26 124.635 122.531 2.104 1
1 208 . 14 1 1 A 27 27 ILE H H 27 8.540 8.186 0.354 1
1 209 . 14 1 1 A 27 27 ILE HA H 27 3.787 3.677 0.110 1
1 219 . 14 1 1 A 27 27 ILE C C 27 177.390 177.396 -0.006 1
1 220 . 14 1 1 A 27 27 ILE CA C 27 64.329 64.999 -0.670 1
1 221 . 14 1 1 A 27 27 ILE CB C 27 37.413 37.970 -0.557 1
1 225 . 14 1 1 A 27 27 ILE N N 27 115.859 119.993 -4.134 1
1 226 . 14 1 1 A 28 28 GLU H H 28 6.953 8.560 -1.607 1
1 227 . 14 1 1 A 28 28 GLU HA H 28 4.067 4.012 0.055 1
1 232 . 14 1 1 A 28 28 GLU C C 28 179.006 179.120 -0.114 1
1 233 . 14 1 1 A 28 28 GLU CA C 28 58.985 59.732 -0.747 1
1 234 . 14 1 1 A 28 28 GLU CB C 28 29.316 29.174 0.142 1
1 236 . 14 1 1 A 28 28 GLU N N 28 120.554 119.215 1.339 1
1 237 . 14 1 1 A 29 29 ALA H H 29 7.999 8.083 -0.084 1
1 238 . 14 1 1 A 29 29 ALA HA H 29 3.822 3.971 -0.149 1
1 242 . 14 1 1 A 29 29 ALA C C 29 178.809 179.669 -0.860 1
1 243 . 14 1 1 A 29 29 ALA CA C 29 54.698 55.266 -0.568 1
1 244 . 14 1 1 A 29 29 ALA CB C 29 18.059 18.232 -0.173 1
1 245 . 14 1 1 A 29 29 ALA N N 29 120.122 122.687 -2.565 1
1 246 . 14 1 1 A 30 30 GLN H H 30 8.168 7.881 0.287 1
1 247 . 14 1 1 A 30 30 GLN HA H 30 3.811 4.082 -0.271 1
1 254 . 14 1 1 A 30 30 GLN C C 30 177.578 177.714 -0.136 1
1 255 . 14 1 1 A 30 30 GLN CA C 30 59.731 58.489 1.242 1
1 256 . 14 1 1 A 30 30 GLN CB C 30 28.161 28.068 0.093 1
1 258 . 14 1 1 A 30 30 GLN N N 30 112.109 116.269 -4.160 1
1 260 . 14 1 1 A 31 31 GLU H H 31 7.248 8.183 -0.935 1
1 261 . 14 1 1 A 31 31 GLU HA H 31 4.063 4.094 -0.031 1
1 266 . 14 1 1 A 31 31 GLU C C 31 177.423 178.447 -1.024 1
1 267 . 14 1 1 A 31 31 GLU CA C 31 57.650 59.077 -1.427 1
1 268 . 14 1 1 A 31 31 GLU CB C 31 29.757 29.295 0.462 1
1 270 . 14 1 1 A 31 31 GLU N N 31 115.340 119.222 -3.882 1
1 271 . 14 1 1 A 32 32 LEU H H 32 7.169 7.259 -0.090 1
1 272 . 14 1 1 A 32 32 LEU HA H 32 4.087 4.525 -0.438 1
1 282 . 14 1 1 A 32 32 LEU C C 32 175.850 175.903 -0.053 1
1 283 . 14 1 1 A 32 32 LEU CA C 32 55.580 54.790 0.790 1
1 284 . 14 1 1 A 32 32 LEU CB C 32 42.910 41.537 1.373 1
1 288 . 14 1 1 A 32 32 LEU N N 32 116.367 113.307 3.060 1
1 289 . 14 1 1 A 33 33 LEU H H 33 7.062 7.575 -0.513 1
1 290 . 14 1 1 A 33 33 LEU HA H 33 4.431 4.530 -0.099 1
1 300 . 14 1 1 A 33 33 LEU C C 33 174.837 176.976 -2.139 1
1 301 . 14 1 1 A 33 33 LEU CA C 33 53.521 54.236 -0.715 1
1 302 . 14 1 1 A 33 33 LEU CB C 33 43.301 41.956 1.345 1
1 306 . 14 1 1 A 33 33 LEU N N 33 118.568 121.774 -3.206 1
1 307 . 14 1 1 A 34 34 LYS H H 34 8.749 8.540 0.209 1
1 308 . 14 1 1 A 34 34 LYS HA H 34 4.162 4.367 -0.205 1
1 317 . 14 1 1 A 34 34 LYS C C 34 174.378 174.959 -0.581 1
1 318 . 14 1 1 A 34 34 LYS CA C 34 56.575 56.067 0.508 1
1 319 . 14 1 1 A 34 34 LYS CB C 34 36.918 34.508 2.410 1
1 323 . 14 1 1 A 34 34 LYS N N 34 121.659 117.808 3.851 1
1 324 . 14 1 1 A 35 35 LYS H H 35 8.137 7.308 0.829 1
1 325 . 14 1 1 A 35 35 LYS HA H 35 4.011 4.424 -0.413 1
1 334 . 14 1 1 A 35 35 LYS C C 35 174.343 174.875 -0.532 1
1 335 . 14 1 1 A 35 35 LYS CA C 35 53.960 54.413 -0.453 1
1 336 . 14 1 1 A 35 35 LYS CB C 35 35.587 35.383 0.204 1
1 340 . 14 1 1 A 35 35 LYS N N 35 119.354 115.918 3.436 1
1 341 . 14 1 1 A 36 36 GLN H H 36 8.394 8.637 -0.243 1
1 342 . 14 1 1 A 36 36 GLN HA H 36 4.187 4.394 -0.207 1
1 349 . 14 1 1 A 36 36 GLN C C 36 177.012 176.627 0.385 1
1 350 . 14 1 1 A 36 36 GLN CA C 36 57.750 57.824 -0.074 1
1 351 . 14 1 1 A 36 36 GLN CB C 36 28.433 28.398 0.035 1
1 353 . 14 1 1 A 36 36 GLN N N 36 120.248 123.119 -2.871 1
1 355 . 14 1 1 A 37 37 GLY H H 37 9.597 9.118 0.479 1
1 356 . 14 1 1 A 37 37 GLY HA2 H 37 4.486 4.109 0.377 1
1 357 . 14 1 1 A 37 37 GLY HA3 H 37 3.926 4.109 -0.183 1
1 358 . 14 1 1 A 37 37 GLY C C 37 176.285 174.404 1.881 1
1 359 . 14 1 1 A 37 37 GLY CA C 37 46.146 45.246 0.900 1
1 360 . 14 1 1 A 37 37 GLY N N 37 116.637 114.794 1.843 1
1 361 . 14 1 1 A 38 38 ASP H H 38 8.925 8.017 0.908 1
1 362 . 14 1 1 A 38 38 ASP HA H 38 5.697 4.700 0.997 1
1 365 . 14 1 1 A 38 38 ASP C C 38 176.181 175.778 0.403 1
1 366 . 14 1 1 A 38 38 ASP CA C 38 55.066 55.428 -0.362 1
1 367 . 14 1 1 A 38 38 ASP CB C 38 42.933 41.055 1.878 1
1 368 . 14 1 1 A 38 38 ASP N N 38 127.293 122.121 5.172 1
1 369 . 14 1 1 A 39 39 PHE H H 39 8.647 8.757 -0.110 1
1 370 . 14 1 1 A 39 39 PHE HA H 39 6.025 5.796 0.229 1
1 378 . 14 1 1 A 39 39 PHE C C 39 170.948 172.943 -1.995 1
1 379 . 14 1 1 A 39 39 PHE CA C 39 56.376 55.925 0.451 1
1 380 . 14 1 1 A 39 39 PHE CB C 39 44.583 42.947 1.636 1
1 386 . 14 1 1 A 39 39 PHE N N 39 117.102 120.640 -3.538 1
1 387 . 14 1 1 A 40 40 LEU H H 40 9.186 9.090 0.096 1
1 388 . 14 1 1 A 40 40 LEU HA H 40 4.983 5.227 -0.244 1
1 398 . 14 1 1 A 40 40 LEU C C 40 174.787 174.446 0.341 1
1 399 . 14 1 1 A 40 40 LEU CA C 40 54.610 54.093 0.517 1
1 400 . 14 1 1 A 40 40 LEU CB C 40 44.330 45.846 -1.516 1
1 404 . 14 1 1 A 40 40 LEU N N 40 114.388 117.720 -3.332 1
1 405 . 14 1 1 A 41 41 VAL H H 41 9.390 9.422 -0.032 1
1 406 . 14 1 1 A 41 41 VAL HA H 41 5.742 5.100 0.642 1
1 414 . 14 1 1 A 41 41 VAL C C 41 172.760 175.204 -2.444 1
1 415 . 14 1 1 A 41 41 VAL CA C 41 60.814 61.418 -0.604 1
1 416 . 14 1 1 A 41 41 VAL CB C 41 34.908 33.578 1.330 1
1 419 . 14 1 1 A 41 41 VAL N N 41 119.873 121.756 -1.883 1
1 420 . 14 1 1 A 42 42 ARG H H 42 9.598 9.169 0.429 1
1 421 . 14 1 1 A 42 42 ARG HA H 42 5.247 4.867 0.380 1
1 429 . 14 1 1 A 42 42 ARG C C 42 173.379 174.588 -1.209 1
1 430 . 14 1 1 A 42 42 ARG CA C 42 53.202 54.025 -0.823 1
1 431 . 14 1 1 A 42 42 ARG CB C 42 33.507 33.826 -0.319 1
1 434 . 14 1 1 A 42 42 ARG N N 42 124.179 124.746 -0.567 1
1 436 . 14 1 1 A 43 43 GLU H H 43 8.234 8.516 -0.282 1
1 437 . 14 1 1 A 43 43 GLU HA H 43 4.890 4.225 0.665 1
1 442 . 14 1 1 A 43 43 GLU C C 43 176.929 176.352 0.577 1
1 443 . 14 1 1 A 43 43 GLU CA C 43 54.846 56.203 -1.357 1
1 444 . 14 1 1 A 43 43 GLU CB C 43 31.599 30.704 0.895 1
1 446 . 14 1 1 A 43 43 GLU N N 43 124.103 123.932 0.171 1
1 447 . 14 1 1 A 44 44 SER H H 44 9.033 8.586 0.447 1
1 448 . 14 1 1 A 44 44 SER HA H 44 3.957 4.424 -0.467 1
1 451 . 14 1 1 A 44 44 SER C C 44 175.005 175.564 -0.559 1
1 452 . 14 1 1 A 44 44 SER CA C 44 59.393 57.468 1.925 1
1 453 . 14 1 1 A 44 44 SER CB C 44 63.619 64.162 -0.543 1
1 454 . 14 1 1 A 44 44 SER N N 44 124.316 120.541 3.775 1
1 455 . 14 1 1 A 45 45 HIS H H 45 8.461 8.581 -0.120 1
1 456 . 14 1 1 A 45 45 HIS HA H 45 4.132 4.148 -0.016 1
1 460 . 14 1 1 A 45 45 HIS C C 45 176.480 177.954 -1.474 1
1 461 . 14 1 1 A 45 45 HIS CA C 45 58.887 58.711 0.176 1
1 462 . 14 1 1 A 45 45 HIS CB C 45 30.180 29.315 0.865 1
1 464 . 14 1 1 A 45 45 HIS N N 45 127.694 126.026 1.668 1
1 465 . 14 1 1 A 46 46 GLY H H 46 8.513 8.287 0.226 1
1 466 . 14 1 1 A 46 46 GLY HA2 H 46 3.827 3.911 -0.084 1
1 467 . 14 1 1 A 46 46 GLY HA3 H 46 3.827 3.919 -0.092 1
1 468 . 14 1 1 A 46 46 GLY C C 46 173.630 174.394 -0.764 1
1 469 . 14 1 1 A 46 46 GLY CA C 46 45.188 46.914 -1.726 1
1 470 . 14 1 1 A 46 46 GLY N N 46 110.761 106.744 4.017 1
1 471 . 14 1 1 A 47 47 LYS H H 47 7.216 7.445 -0.229 1
1 472 . 14 1 1 A 47 47 LYS HA H 47 4.540 4.845 -0.305 1
1 481 . 14 1 1 A 47 47 LYS CA C 47 53.475 52.916 0.559 1
1 482 . 14 1 1 A 47 47 LYS CB C 47 33.325 34.439 -1.114 1
1 486 . 14 1 1 A 47 47 LYS N N 47 121.356 120.193 1.163 1
1 487 . 14 1 1 A 48 48 PRO HA H 48 4.181 4.254 -0.073 1
1 494 . 14 1 1 A 48 48 PRO C C 48 178.920 177.563 1.357 1
1 495 . 14 1 1 A 48 48 PRO CA C 48 63.239 63.636 -0.397 1
1 496 . 14 1 1 A 48 48 PRO CB C 48 31.523 31.352 0.171 1
1 499 . 14 1 1 A 49 49 GLY H H 49 9.752 8.594 1.158 1
1 500 . 14 1 1 A 49 49 GLY HA2 H 49 4.053 3.950 0.103 1
1 501 . 14 1 1 A 49 49 GLY HA3 H 49 3.374 4.026 -0.652 1
1 502 . 14 1 1 A 49 49 GLY C C 49 172.093 174.039 -1.946 1
1 503 . 14 1 1 A 49 49 GLY CA C 49 45.041 45.215 -0.174 1
1 504 . 14 1 1 A 49 49 GLY N N 49 112.415 112.699 -0.284 1
1 505 . 14 1 1 A 50 50 GLU H H 50 7.623 7.804 -0.181 1
1 506 . 14 1 1 A 50 50 GLU HA H 50 4.537 4.567 -0.030 1
1 511 . 14 1 1 A 50 50 GLU C C 50 173.297 174.848 -1.551 1
1 512 . 14 1 1 A 50 50 GLU CA C 50 55.174 55.767 -0.593 1
1 513 . 14 1 1 A 50 50 GLU CB C 50 31.651 29.824 1.827 1
1 515 . 14 1 1 A 50 50 GLU N N 50 121.600 121.828 -0.228 1
1 516 . 14 1 1 A 51 51 TYR H H 51 9.452 9.237 0.215 1
1 517 . 14 1 1 A 51 51 TYR HA H 51 5.382 5.358 0.024 1
1 524 . 14 1 1 A 51 51 TYR C C 51 174.387 175.352 -0.965 1
1 525 . 14 1 1 A 51 51 TYR CA C 51 57.592 57.778 -0.186 1
1 526 . 14 1 1 A 51 51 TYR CB C 51 41.820 40.199 1.621 1
1 531 . 14 1 1 A 51 51 TYR N N 51 125.790 126.979 -1.189 1
1 532 . 14 1 1 A 52 52 VAL H H 52 9.471 9.506 -0.035 1
1 533 . 14 1 1 A 52 52 VAL HA H 52 4.840 5.135 -0.295 1
1 541 . 14 1 1 A 52 52 VAL C C 52 174.947 174.826 0.121 1
1 542 . 14 1 1 A 52 52 VAL CA C 52 60.991 61.314 -0.323 1
1 543 . 14 1 1 A 52 52 VAL CB C 52 36.829 34.483 2.346 1
1 546 . 14 1 1 A 52 52 VAL N N 52 120.617 123.543 -2.926 1
1 547 . 14 1 1 A 53 53 LEU H H 53 9.457 9.517 -0.060 1
1 548 . 14 1 1 A 53 53 LEU HA H 53 5.294 5.100 0.194 1
1 558 . 14 1 1 A 53 53 LEU C C 53 175.024 175.726 -0.702 1
1 559 . 14 1 1 A 53 53 LEU CA C 53 53.904 54.183 -0.279 1
1 560 . 14 1 1 A 53 53 LEU CB C 53 44.756 43.443 1.313 1
1 564 . 14 1 1 A 53 53 LEU N N 53 127.725 131.254 -3.529 1
1 565 . 14 1 1 A 54 54 SER H H 54 9.461 9.034 0.427 1
1 566 . 14 1 1 A 54 54 SER HA H 54 5.691 5.855 -0.164 1
1 569 . 14 1 1 A 54 54 SER C C 54 172.227 173.242 -1.015 1
1 570 . 14 1 1 A 54 54 SER CA C 54 58.551 56.588 1.963 1
1 571 . 14 1 1 A 54 54 SER CB C 54 65.738 64.757 0.981 1
1 572 . 14 1 1 A 54 54 SER N N 54 127.178 121.688 5.490 1
1 573 . 14 1 1 A 55 55 VAL H H 55 9.049 8.521 0.528 1
1 574 . 14 1 1 A 55 55 VAL HA H 55 5.691 5.305 0.386 1
1 582 . 14 1 1 A 55 55 VAL C C 55 173.959 173.240 0.719 1
1 583 . 14 1 1 A 55 55 VAL CA C 55 58.398 59.850 -1.452 1
1 584 . 14 1 1 A 55 55 VAL CB C 55 36.262 35.955 0.307 1
1 587 . 14 1 1 A 55 55 VAL N N 55 120.619 122.474 -1.855 1
1 588 . 14 1 1 A 56 56 TYR H H 56 8.629 9.296 -0.667 1
1 589 . 14 1 1 A 56 56 TYR HA H 56 4.951 4.650 0.301 1
1 596 . 14 1 1 A 56 56 TYR C C 56 175.224 174.292 0.932 1
1 597 . 14 1 1 A 56 56 TYR CA C 56 56.684 56.871 -0.187 1
1 598 . 14 1 1 A 56 56 TYR CB C 56 39.646 38.613 1.033 1
1 603 . 14 1 1 A 56 56 TYR N N 56 127.444 129.995 -2.551 1
1 604 . 14 1 1 A 57 57 SER H H 57 8.869 8.942 -0.073 1
1 605 . 14 1 1 A 57 57 SER HA H 57 4.739 5.457 -0.718 1
1 608 . 14 1 1 A 57 57 SER C C 57 174.492 173.094 1.398 1
1 609 . 14 1 1 A 57 57 SER CA C 57 57.591 56.728 0.863 1
1 610 . 14 1 1 A 57 57 SER CB C 57 64.281 65.538 -1.257 1
1 611 . 14 1 1 A 57 57 SER N N 57 122.165 123.418 -1.253 1
1 612 . 14 1 1 A 58 58 ASP H H 58 10.446 9.502 0.944 1
1 613 . 14 1 1 A 58 58 ASP HA H 58 4.382 4.353 0.029 1
1 616 . 14 1 1 A 58 58 ASP C C 58 176.398 176.142 0.256 1
1 617 . 14 1 1 A 58 58 ASP CA C 58 55.215 55.373 -0.158 1
1 618 . 14 1 1 A 58 58 ASP CB C 58 39.513 39.588 -0.075 1
1 619 . 14 1 1 A 58 58 ASP N N 58 132.098 128.892 3.206 1
1 620 . 14 1 1 A 59 59 GLY H H 59 7.861 8.058 -0.197 1
1 621 . 14 1 1 A 59 59 GLY HA2 H 59 3.817 3.690 0.127 1
1 622 . 14 1 1 A 59 59 GLY HA3 H 59 4.086 3.740 0.346 1
1 623 . 14 1 1 A 59 59 GLY C C 59 173.111 173.082 0.029 1
1 624 . 14 1 1 A 59 59 GLY CA C 59 45.486 45.138 0.348 1
1 625 . 14 1 1 A 59 59 GLY N N 59 102.674 103.786 -1.112 1
1 626 . 14 1 1 A 60 60 GLN H H 60 7.137 7.516 -0.379 1
1 627 . 14 1 1 A 60 60 GLN HA H 60 4.455 4.348 0.107 1
1 634 . 14 1 1 A 60 60 GLN C C 60 173.549 175.332 -1.783 1
1 635 . 14 1 1 A 60 60 GLN CA C 60 53.388 54.915 -1.527 1
1 636 . 14 1 1 A 60 60 GLN CB C 60 32.373 29.866 2.507 1
1 638 . 14 1 1 A 60 60 GLN N N 60 116.206 119.617 -3.411 1
1 640 . 14 1 1 A 61 61 ARG H H 61 8.589 8.396 0.193 1
1 641 . 14 1 1 A 61 61 ARG HA H 61 4.740 4.412 0.328 1
1 649 . 14 1 1 A 61 61 ARG C C 61 174.458 174.986 -0.528 1
1 650 . 14 1 1 A 61 61 ARG CA C 61 57.116 55.738 1.378 1
1 651 . 14 1 1 A 61 61 ARG CB C 61 29.615 30.624 -1.009 1
1 654 . 14 1 1 A 61 61 ARG N N 61 120.467 122.533 -2.066 1
1 656 . 14 1 1 A 62 62 ARG H H 62 8.867 8.706 0.161 1
1 657 . 14 1 1 A 62 62 ARG HA H 62 4.297 4.215 0.082 1
1 665 . 14 1 1 A 62 62 ARG C C 62 173.485 175.525 -2.040 1
1 666 . 14 1 1 A 62 62 ARG CA C 62 53.355 55.842 -2.487 1
1 667 . 14 1 1 A 62 62 ARG CB C 62 33.028 30.863 2.165 1
1 670 . 14 1 1 A 62 62 ARG N N 62 122.641 124.640 -1.999 1
1 672 . 14 1 1 A 63 63 HIS H H 63 7.997 8.365 -0.368 1
1 673 . 14 1 1 A 63 63 HIS HA H 63 5.427 5.029 0.398 1
1 678 . 14 1 1 A 63 63 HIS C C 63 174.946 173.970 0.976 1
1 679 . 14 1 1 A 63 63 HIS CA C 63 54.689 54.145 0.544 1
1 680 . 14 1 1 A 63 63 HIS CB C 63 33.008 31.975 1.033 1
1 683 . 14 1 1 A 63 63 HIS N N 63 119.064 118.443 0.621 1
1 684 . 14 1 1 A 64 64 PHE H H 64 9.880 9.243 0.637 1
1 685 . 14 1 1 A 64 64 PHE HA H 64 4.824 5.009 -0.185 1
1 693 . 14 1 1 A 64 64 PHE C C 64 174.882 175.225 -0.343 1
1 694 . 14 1 1 A 64 64 PHE CA C 64 56.489 56.172 0.317 1
1 695 . 14 1 1 A 64 64 PHE CB C 64 41.405 41.890 -0.485 1
1 701 . 14 1 1 A 64 64 PHE N N 64 123.961 121.971 1.990 1
1 702 . 14 1 1 A 65 65 ILE H H 65 8.982 9.180 -0.198 1
1 703 . 14 1 1 A 65 65 ILE HA H 65 4.273 4.729 -0.456 1
1 713 . 14 1 1 A 65 65 ILE C C 65 176.556 175.759 0.797 1
1 714 . 14 1 1 A 65 65 ILE CA C 65 62.649 60.774 1.875 1
1 715 . 14 1 1 A 65 65 ILE CB C 65 38.296 39.136 -0.840 1
1 719 . 14 1 1 A 65 65 ILE N N 65 126.601 123.865 2.736 1
1 720 . 14 1 1 A 66 66 ILE H H 66 8.947 9.144 -0.197 1
1 721 . 14 1 1 A 66 66 ILE HA H 66 3.780 4.317 -0.537 1
1 731 . 14 1 1 A 66 66 ILE C C 66 175.721 175.458 0.263 1
1 732 . 14 1 1 A 66 66 ILE CA C 66 62.960 60.637 2.323 1
1 733 . 14 1 1 A 66 66 ILE CB C 66 37.209 38.369 -1.160 1
1 737 . 14 1 1 A 66 66 ILE N N 66 130.139 129.617 0.522 1
1 738 . 14 1 1 A 67 67 GLN H H 67 8.410 8.788 -0.378 1
1 739 . 14 1 1 A 67 67 GLN HA H 67 4.422 4.915 -0.493 1
1 746 . 14 1 1 A 67 67 GLN C C 67 174.347 174.186 0.161 1
1 747 . 14 1 1 A 67 67 GLN CA C 67 55.867 55.202 0.665 1
1 748 . 14 1 1 A 67 67 GLN CB C 67 29.950 30.729 -0.779 1
1 750 . 14 1 1 A 67 67 GLN N N 67 128.872 127.067 1.805 1
1 752 . 14 1 1 A 68 68 TYR H H 68 8.619 8.825 -0.206 1
1 753 . 14 1 1 A 68 68 TYR HA H 68 5.300 4.952 0.348 1
1 760 . 14 1 1 A 68 68 TYR C C 68 174.695 174.241 0.454 1
1 761 . 14 1 1 A 68 68 TYR CA C 68 55.579 55.966 -0.387 1
1 762 . 14 1 1 A 68 68 TYR CB C 68 39.479 39.583 -0.104 1
1 767 . 14 1 1 A 68 68 TYR N N 68 124.772 124.635 0.137 1
1 768 . 14 1 1 A 69 69 VAL H H 69 8.539 8.542 -0.003 1
1 769 . 14 1 1 A 69 69 VAL HA H 69 4.046 4.370 -0.324 1
1 777 . 14 1 1 A 69 69 VAL C C 69 175.010 175.197 -0.187 1
1 778 . 14 1 1 A 69 69 VAL CA C 69 60.611 60.721 -0.110 1
1 779 . 14 1 1 A 69 69 VAL CB C 69 35.358 34.297 1.061 1
1 782 . 14 1 1 A 69 69 VAL N N 69 126.652 127.740 -1.088 1
1 783 . 14 1 1 A 70 70 ASP H H 70 9.089 9.342 -0.253 1
1 784 . 14 1 1 A 70 70 ASP HA H 70 4.025 4.207 -0.182 1
1 787 . 14 1 1 A 70 70 ASP C C 70 174.813 174.984 -0.171 1
1 788 . 14 1 1 A 70 70 ASP CA C 70 55.623 55.442 0.181 1
1 789 . 14 1 1 A 70 70 ASP CB C 70 39.081 39.070 0.011 1
1 790 . 14 1 1 A 70 70 ASP N N 70 128.327 128.617 -0.290 1
1 791 . 14 1 1 A 71 71 ASN H H 71 8.128 8.072 0.056 1
1 792 . 14 1 1 A 71 71 ASN HA H 71 3.597 3.507 0.090 1
1 797 . 14 1 1 A 71 71 ASN C C 71 173.250 173.713 -0.463 1
1 798 . 14 1 1 A 71 71 ASN CA C 71 54.728 54.262 0.466 1
1 799 . 14 1 1 A 71 71 ASN CB C 71 37.601 37.194 0.407 1
1 800 . 14 1 1 A 71 71 ASN N N 71 107.230 107.822 -0.592 1
1 802 . 14 1 1 A 72 72 MET H H 72 7.256 7.525 -0.269 1
1 803 . 14 1 1 A 72 72 MET HA H 72 4.740 4.789 -0.049 1
1 808 . 14 1 1 A 72 72 MET C C 72 173.780 174.436 -0.656 1
1 809 . 14 1 1 A 72 72 MET CA C 72 53.703 54.173 -0.470 1
1 810 . 14 1 1 A 72 72 MET CB C 72 36.570 35.115 1.455 1
1 812 . 14 1 1 A 72 72 MET N N 72 117.117 117.144 -0.027 1
1 813 . 14 1 1 A 73 73 TYR H H 73 9.430 9.068 0.362 1
1 814 . 14 1 1 A 73 73 TYR HA H 73 5.718 5.162 0.556 1
1 821 . 14 1 1 A 73 73 TYR C C 73 176.140 175.831 0.309 1
1 822 . 14 1 1 A 73 73 TYR CA C 73 57.290 57.864 -0.574 1
1 823 . 14 1 1 A 73 73 TYR CB C 73 40.013 39.588 0.425 1
1 828 . 14 1 1 A 73 73 TYR N N 73 119.856 122.221 -2.365 1
1 829 . 14 1 1 A 74 74 ARG H H 74 9.038 8.773 0.265 1
1 830 . 14 1 1 A 74 74 ARG HA H 74 4.867 4.930 -0.063 1
1 838 . 14 1 1 A 74 74 ARG C C 74 173.954 174.867 -0.913 1
1 839 . 14 1 1 A 74 74 ARG CA C 74 54.887 54.513 0.374 1
1 840 . 14 1 1 A 74 74 ARG CB C 74 34.484 34.015 0.469 1
1 843 . 14 1 1 A 74 74 ARG N N 74 117.344 120.892 -3.548 1
1 845 . 14 1 1 A 75 75 PHE H H 75 9.005 8.752 0.253 1
1 846 . 14 1 1 A 75 75 PHE HA H 75 5.046 4.609 0.437 1
1 854 . 14 1 1 A 75 75 PHE C C 75 176.186 176.866 -0.680 1
1 855 . 14 1 1 A 75 75 PHE CA C 75 59.658 59.790 -0.132 1
1 856 . 14 1 1 A 75 75 PHE CB C 75 39.356 39.984 -0.628 1
1 862 . 14 1 1 A 75 75 PHE N N 75 117.865 120.270 -2.405 1
1 863 . 14 1 1 A 76 76 GLU H H 76 8.213 8.396 -0.183 1
1 864 . 14 1 1 A 76 76 GLU HA H 76 4.586 4.441 0.145 1
1 869 . 14 1 1 A 76 76 GLU C C 76 175.238 178.490 -3.252 1
1 870 . 14 1 1 A 76 76 GLU CA C 76 55.994 58.360 -2.366 1
1 871 . 14 1 1 A 76 76 GLU CB C 76 31.805 30.556 1.249 1
1 873 . 14 1 1 A 76 76 GLU N N 76 116.834 117.138 -0.304 1
1 874 . 14 1 1 A 77 77 GLY H H 77 8.692 7.983 0.709 1
1 875 . 14 1 1 A 77 77 GLY HA2 H 77 4.166 4.138 0.028 1
1 876 . 14 1 1 A 77 77 GLY HA3 H 77 4.015 4.142 -0.127 1
1 877 . 14 1 1 A 77 77 GLY C C 77 173.784 174.308 -0.524 1
1 878 . 14 1 1 A 77 77 GLY CA C 77 45.505 45.725 -0.220 1
1 879 . 14 1 1 A 77 77 GLY N N 77 111.937 107.374 4.563 1
1 880 . 14 1 1 A 78 78 THR H H 78 8.332 7.686 0.646 1
1 881 . 14 1 1 A 78 78 THR HA H 78 3.900 4.136 -0.236 1
1 886 . 14 1 1 A 78 78 THR C C 78 173.591 173.685 -0.094 1
1 887 . 14 1 1 A 78 78 THR CA C 78 63.653 62.952 0.701 1
1 888 . 14 1 1 A 78 78 THR CB C 78 69.649 68.268 1.381 1
1 890 . 14 1 1 A 78 78 THR N N 78 120.765 115.868 4.897 1
1 891 . 14 1 1 A 79 79 GLY H H 79 8.038 8.265 -0.227 1
1 892 . 14 1 1 A 79 79 GLY HA2 H 79 4.748 4.208 0.540 1
1 893 . 14 1 1 A 79 79 GLY HA3 H 79 3.546 4.330 -0.784 1
1 894 . 14 1 1 A 79 79 GLY C C 79 172.580 172.277 0.303 1
1 895 . 14 1 1 A 79 79 GLY CA C 79 44.661 43.819 0.842 1
1 896 . 14 1 1 A 79 79 GLY N N 79 109.887 113.366 -3.479 1
1 897 . 14 1 1 A 80 80 PHE H H 80 9.064 8.400 0.664 1
1 898 . 14 1 1 A 80 80 PHE HA H 80 4.886 4.940 -0.054 1
1 906 . 14 1 1 A 80 80 PHE C C 80 176.507 175.865 0.642 1
1 907 . 14 1 1 A 80 80 PHE CA C 80 57.257 56.664 0.593 1
1 908 . 14 1 1 A 80 80 PHE CB C 80 44.655 43.448 1.207 1
1 914 . 14 1 1 A 80 80 PHE N N 80 116.862 119.653 -2.791 1
1 915 . 14 1 1 A 81 81 SER H H 81 9.413 8.912 0.501 1
1 916 . 14 1 1 A 81 81 SER HA H 81 4.622 4.346 0.276 1
1 919 . 14 1 1 A 81 81 SER C C 81 173.735 173.882 -0.147 1
1 920 . 14 1 1 A 81 81 SER CA C 81 61.410 60.842 0.568 1
1 921 . 14 1 1 A 81 81 SER CB C 81 64.165 63.080 1.085 1
1 922 . 14 1 1 A 81 81 SER N N 81 116.467 117.370 -0.903 1
1 923 . 14 1 1 A 82 82 ASN H H 82 7.688 8.105 -0.417 1
1 924 . 14 1 1 A 82 82 ASN HA H 82 4.952 5.238 -0.286 1
1 929 . 14 1 1 A 82 82 ASN C C 82 173.303 175.568 -2.265 1
1 930 . 14 1 1 A 82 82 ASN CA C 82 52.086 52.228 -0.142 1
1 931 . 14 1 1 A 82 82 ASN CB C 82 41.258 40.748 0.510 1
1 932 . 14 1 1 A 82 82 ASN N N 82 113.355 116.192 -2.837 1
1 934 . 14 1 1 A 83 83 ILE H H 83 8.858 8.735 0.123 1
1 935 . 14 1 1 A 83 83 ILE HA H 83 3.571 3.749 -0.178 1
1 945 . 14 1 1 A 83 83 ILE CA C 83 66.416 65.371 1.045 1
1 946 . 14 1 1 A 83 83 ILE CB C 83 35.074 34.910 0.164 1
1 950 . 14 1 1 A 83 83 ILE N N 83 118.908 123.561 -4.653 1
1 951 . 14 1 1 A 84 84 PRO HA H 84 4.411 4.689 -0.278 1
1 958 . 14 1 1 A 84 84 PRO C C 84 177.616 179.446 -1.830 1
1 959 . 14 1 1 A 84 84 PRO CA C 84 67.525 66.410 1.115 1
1 960 . 14 1 1 A 84 84 PRO CB C 84 31.029 30.891 0.138 1
1 963 . 14 1 1 A 85 85 GLN H H 85 8.405 8.379 0.026 1
1 964 . 14 1 1 A 85 85 GLN HA H 85 3.874 4.108 -0.234 1
1 971 . 14 1 1 A 85 85 GLN C C 85 178.213 178.372 -0.159 1
1 972 . 14 1 1 A 85 85 GLN CA C 85 59.495 58.650 0.845 1
1 973 . 14 1 1 A 85 85 GLN CB C 85 29.270 28.166 1.104 1
1 975 . 14 1 1 A 85 85 GLN N N 85 115.597 117.592 -1.995 1
1 977 . 14 1 1 A 86 86 LEU H H 86 7.136 8.151 -1.015 1
1 978 . 14 1 1 A 86 86 LEU HA H 86 3.589 3.733 -0.144 1
1 988 . 14 1 1 A 86 86 LEU C C 86 177.728 178.408 -0.680 1
1 989 . 14 1 1 A 86 86 LEU CA C 86 58.136 58.391 -0.255 1
1 990 . 14 1 1 A 86 86 LEU CB C 86 42.290 41.751 0.539 1
1 994 . 14 1 1 A 86 86 LEU N N 86 121.840 122.200 -0.360 1
1 995 . 14 1 1 A 87 87 ILE H H 87 8.323 7.902 0.421 1
1 996 . 14 1 1 A 87 87 ILE HA H 87 3.415 3.371 0.044 1
1 1006 . 14 1 1 A 87 87 ILE C C 87 178.064 177.721 0.343 1
1 1007 . 14 1 1 A 87 87 ILE CA C 87 61.458 65.211 -3.753 1
1 1008 . 14 1 1 A 87 87 ILE CB C 87 34.561 37.215 -2.654 1
1 1012 . 14 1 1 A 87 87 ILE N N 87 118.117 119.563 -1.446 1
1 1013 . 14 1 1 A 88 88 ASP H H 88 8.805 8.440 0.365 1
1 1014 . 14 1 1 A 88 88 ASP HA H 88 4.548 4.329 0.219 1
1 1017 . 14 1 1 A 88 88 ASP C C 88 179.265 178.763 0.502 1
1 1018 . 14 1 1 A 88 88 ASP CA C 88 58.099 57.291 0.808 1
1 1019 . 14 1 1 A 88 88 ASP CB C 88 42.166 41.791 0.375 1
1 1020 . 14 1 1 A 88 88 ASP N N 88 119.143 120.642 -1.499 1
1 1021 . 14 1 1 A 89 89 HIS H H 89 8.113 8.099 0.014 1
1 1022 . 14 1 1 A 89 89 HIS HA H 89 4.225 4.065 0.160 1
1 1026 . 14 1 1 A 89 89 HIS C C 89 179.261 177.574 1.687 1
1 1027 . 14 1 1 A 89 89 HIS CA C 89 60.647 60.013 0.634 1
1 1028 . 14 1 1 A 89 89 HIS CB C 89 30.801 29.598 1.203 1
1 1030 . 14 1 1 A 89 89 HIS N N 89 119.595 117.367 2.228 1
1 1031 . 14 1 1 A 90 90 HIS H H 90 7.685 7.780 -0.095 1
1 1032 . 14 1 1 A 90 90 HIS HA H 90 3.628 4.145 -0.517 1
1 1036 . 14 1 1 A 90 90 HIS C C 90 178.454 177.617 0.837 1
1 1037 . 14 1 1 A 90 90 HIS CA C 90 61.797 59.456 2.341 1
1 1038 . 14 1 1 A 90 90 HIS CB C 90 28.165 30.154 -1.989 1
1 1040 . 14 1 1 A 90 90 HIS N N 90 120.061 117.616 2.445 1
1 1041 . 14 1 1 A 91 91 TYR H H 91 9.394 8.501 0.893 1
1 1042 . 14 1 1 A 91 91 TYR HA H 91 4.238 4.060 0.178 1
1 1049 . 14 1 1 A 91 91 TYR C C 91 176.443 177.323 -0.880 1
1 1050 . 14 1 1 A 91 91 TYR CA C 91 60.669 61.375 -0.706 1
1 1051 . 14 1 1 A 91 91 TYR CB C 91 39.169 38.518 0.651 1
1 1056 . 14 1 1 A 91 91 TYR N N 91 123.532 120.182 3.350 1
1 1057 . 14 1 1 A 92 92 THR H H 92 8.774 8.614 0.160 1
1 1058 . 14 1 1 A 92 92 THR HA H 92 3.866 4.063 -0.197 1
1 1063 . 14 1 1 A 92 92 THR C C 92 177.050 176.500 0.550 1
1 1064 . 14 1 1 A 92 92 THR CA C 92 65.240 65.484 -0.244 1
1 1065 . 14 1 1 A 92 92 THR CB C 92 69.298 68.027 1.271 1
1 1067 . 14 1 1 A 92 92 THR N N 92 112.000 112.521 -0.521 1
1 1068 . 14 1 1 A 93 93 THR H H 93 7.617 7.570 0.047 1
1 1069 . 14 1 1 A 93 93 THR HA H 93 4.133 4.175 -0.042 1
1 1074 . 14 1 1 A 93 93 THR C C 93 176.234 175.103 1.131 1
1 1075 . 14 1 1 A 93 93 THR CA C 93 63.527 63.018 0.509 1
1 1076 . 14 1 1 A 93 93 THR CB C 93 71.234 70.040 1.194 1
1 1078 . 14 1 1 A 93 93 THR N N 93 109.883 113.070 -3.187 1
1 1079 . 14 1 1 A 94 94 LYS H H 94 7.210 7.638 -0.428 1
1 1080 . 14 1 1 A 94 94 LYS HA H 94 3.830 3.764 0.066 1
1 1089 . 14 1 1 A 94 94 LYS C C 94 174.331 175.059 -0.728 1
1 1090 . 14 1 1 A 94 94 LYS CA C 94 56.776 57.338 -0.562 1
1 1091 . 14 1 1 A 94 94 LYS CB C 94 28.095 31.093 -2.998 1
1 1095 . 14 1 1 A 94 94 LYS N N 94 112.818 121.367 -8.549 1
1 1096 . 14 1 1 A 95 95 GLN H H 95 7.439 7.579 -0.140 1
1 1097 . 14 1 1 A 95 95 GLN HA H 95 4.216 4.635 -0.419 1
1 1104 . 14 1 1 A 95 95 GLN C C 95 179.087 175.352 3.735 1
1 1105 . 14 1 1 A 95 95 GLN CA C 95 56.378 54.365 2.013 1
1 1106 . 14 1 1 A 95 95 GLN CB C 95 28.542 30.649 -2.107 1
1 1108 . 14 1 1 A 95 95 GLN N N 95 117.860 118.799 -0.939 1
1 1110 . 14 1 1 A 96 96 VAL H H 96 8.520 8.491 0.029 1
1 1111 . 14 1 1 A 96 96 VAL HA H 96 4.297 4.757 -0.460 1
1 1119 . 14 1 1 A 96 96 VAL C C 96 177.329 176.449 0.880 1
1 1120 . 14 1 1 A 96 96 VAL CA C 96 61.196 61.073 0.123 1
1 1121 . 14 1 1 A 96 96 VAL CB C 96 32.735 33.727 -0.992 1
1 1124 . 14 1 1 A 96 96 VAL N N 96 124.208 118.870 5.338 1
1 1125 . 14 1 1 A 97 97 ILE H H 97 8.491 8.425 0.066 1
1 1126 . 14 1 1 A 97 97 ILE HA H 97 2.995 3.710 -0.715 1
1 1136 . 14 1 1 A 97 97 ILE CA C 97 62.066 63.195 -1.129 1
1 1137 . 14 1 1 A 97 97 ILE CB C 97 36.117 37.720 -1.603 1
1 1141 . 14 1 1 A 97 97 ILE N N 97 119.561 123.647 -4.086 1
1 1142 . 14 1 1 A 98 98 THR HA H 98 4.460 4.538 -0.078 1
1 1147 . 14 1 1 A 98 98 THR C C 98 174.335 175.064 -0.729 1
1 1148 . 14 1 1 A 98 98 THR CA C 98 58.244 59.491 -1.247 1
1 1149 . 14 1 1 A 98 98 THR CB C 98 73.056 70.808 2.248 1
1 1151 . 14 1 1 A 99 99 LYS H H 99 9.761 9.105 0.656 1
1 1152 . 14 1 1 A 99 99 LYS HA H 99 3.911 4.064 -0.153 1
1 1161 . 14 1 1 A 99 99 LYS C C 99 179.594 178.458 1.136 1
1 1162 . 14 1 1 A 99 99 LYS CA C 99 59.661 58.597 1.064 1
1 1163 . 14 1 1 A 99 99 LYS CB C 99 31.978 32.041 -0.063 1
1 1167 . 14 1 1 A 99 99 LYS N N 99 125.750 122.833 2.917 1
1 1168 . 14 1 1 A 100 100 LYS H H 100 8.910 7.718 1.192 1
1 1169 . 14 1 1 A 100 100 LYS HA H 100 4.024 4.123 -0.099 1
1 1178 . 14 1 1 A 100 100 LYS C C 100 178.060 178.135 -0.075 1
1 1179 . 14 1 1 A 100 100 LYS CA C 100 58.642 59.191 -0.549 1
1 1180 . 14 1 1 A 100 100 LYS CB C 100 32.750 32.569 0.181 1
1 1184 . 14 1 1 A 100 100 LYS N N 100 117.112 119.389 -2.277 1
1 1185 . 14 1 1 A 101 101 SER H H 101 7.721 7.521 0.200 1
1 1186 . 14 1 1 A 101 101 SER HA H 101 4.282 4.499 -0.217 1
1 1189 . 14 1 1 A 101 101 SER C C 101 176.403 175.299 1.104 1
1 1190 . 14 1 1 A 101 101 SER CA C 101 60.442 59.494 0.948 1
1 1191 . 14 1 1 A 101 101 SER CB C 101 63.775 64.131 -0.356 1
1 1192 . 14 1 1 A 101 101 SER N N 101 112.069 111.265 0.804 1
1 1193 . 14 1 1 A 102 102 GLY H H 102 8.038 8.438 -0.400 1
1 1194 . 14 1 1 A 102 102 GLY HA2 H 102 4.024 3.898 0.126 1
1 1195 . 14 1 1 A 102 102 GLY HA3 H 102 3.713 3.919 -0.206 1
1 1196 . 14 1 1 A 102 102 GLY C C 102 173.991 174.546 -0.555 1
1 1197 . 14 1 1 A 102 102 GLY CA C 102 46.458 46.574 -0.116 1
1 1198 . 14 1 1 A 102 102 GLY N N 102 111.144 108.992 2.152 1
1 1199 . 14 1 1 A 103 103 VAL H H 103 7.155 7.947 -0.792 1
1 1200 . 14 1 1 A 103 103 VAL HA H 103 3.652 4.046 -0.394 1
1 1208 . 14 1 1 A 103 103 VAL C C 103 173.805 175.058 -1.253 1
1 1209 . 14 1 1 A 103 103 VAL CA C 103 64.310 62.520 1.790 1
1 1210 . 14 1 1 A 103 103 VAL CB C 103 32.254 32.450 -0.196 1
1 1213 . 14 1 1 A 103 103 VAL N N 103 119.836 120.157 -0.321 1
1 1214 . 14 1 1 A 104 104 VAL H H 104 7.653 9.113 -1.460 1
1 1215 . 14 1 1 A 104 104 VAL HA H 104 4.048 4.489 -0.441 1
1 1223 . 14 1 1 A 104 104 VAL C C 104 175.708 174.595 1.113 1
1 1224 . 14 1 1 A 104 104 VAL CA C 104 60.275 61.010 -0.735 1
1 1225 . 14 1 1 A 104 104 VAL CB C 104 35.112 34.422 0.690 1
1 1228 . 14 1 1 A 104 104 VAL N N 104 125.859 128.173 -2.314 1
1 1229 . 14 1 1 A 105 105 LEU H H 105 8.616 8.419 0.197 1
1 1230 . 14 1 1 A 105 105 LEU HA H 105 3.905 4.594 -0.689 1
1 1240 . 14 1 1 A 105 105 LEU C C 105 175.380 175.575 -0.195 1
1 1241 . 14 1 1 A 105 105 LEU CA C 105 54.471 53.790 0.681 1
1 1242 . 14 1 1 A 105 105 LEU CB C 105 39.821 41.058 -1.237 1
1 1246 . 14 1 1 A 105 105 LEU N N 105 123.839 126.458 -2.619 1
1 1247 . 14 1 1 A 106 106 LEU H H 106 8.894 8.459 0.435 1
1 1248 . 14 1 1 A 106 106 LEU HA H 106 4.839 4.922 -0.083 1
1 1258 . 14 1 1 A 106 106 LEU C C 106 176.930 176.293 0.637 1
1 1259 . 14 1 1 A 106 106 LEU CA C 106 56.288 52.851 3.437 1
1 1260 . 14 1 1 A 106 106 LEU CB C 106 45.237 45.561 -0.324 1
1 1264 . 14 1 1 A 106 106 LEU N N 106 120.590 120.857 -0.267 1
1 1265 . 14 1 1 A 107 107 ASN H H 107 8.124 8.924 -0.800 1
1 1266 . 14 1 1 A 107 107 ASN HA H 107 5.650 4.614 1.036 1
1 1271 . 14 1 1 A 107 107 ASN CA C 107 50.293 53.950 -3.657 1
1 1272 . 14 1 1 A 107 107 ASN CB C 107 41.223 36.210 5.013 1
1 1273 . 14 1 1 A 107 107 ASN N N 107 116.866 117.519 -0.653 1
1 1275 . 14 1 1 A 108 108 PRO HA H 108 2.926 4.104 -1.178 1
1 1282 . 14 1 1 A 108 108 PRO C C 108 176.671 175.760 0.911 1
1 1283 . 14 1 1 A 108 108 PRO CA C 108 60.804 62.786 -1.982 1
1 1284 . 14 1 1 A 108 108 PRO CB C 108 31.774 32.065 -0.291 1
1 1287 . 14 1 1 A 109 109 ILE H H 109 8.648 7.630 1.018 1
1 1288 . 14 1 1 A 109 109 ILE HA H 109 4.519 4.539 -0.020 1
1 1298 . 14 1 1 A 109 109 ILE CA C 109 55.070 58.349 -3.279 1
1 1299 . 14 1 1 A 109 109 ILE CB C 109 36.068 38.307 -2.239 1
1 1303 . 14 1 1 A 109 109 ILE N N 109 128.817 123.132 5.685 1
1 1304 . 14 1 1 A 110 110 PRO HA H 110 4.587 4.376 0.211 1
1 1311 . 14 1 1 A 110 110 PRO C C 110 177.013 176.873 0.140 1
1 1312 . 14 1 1 A 110 110 PRO CA C 110 61.850 62.917 -1.067 1
1 1313 . 14 1 1 A 110 110 PRO CB C 110 32.507 31.788 0.719 1
1 1316 . 14 1 1 A 111 111 LYS H H 111 8.038 7.963 0.075 1
1 1317 . 14 1 1 A 111 111 LYS HA H 111 3.553 2.757 0.796 1
1 1326 . 14 1 1 A 111 111 LYS C C 111 176.123 175.221 0.902 1
1 1327 . 14 1 1 A 111 111 LYS CA C 111 56.220 55.641 0.579 1
1 1328 . 14 1 1 A 111 111 LYS CB C 111 32.373 32.303 0.070 1
1 1332 . 14 1 1 A 111 111 LYS N N 111 120.147 118.123 2.024 1
1 1333 . 14 1 1 A 112 112 ASP H H 112 8.463 8.427 0.036 1
1 1334 . 14 1 1 A 112 112 ASP HA H 112 4.523 4.483 0.040 1
1 1337 . 14 1 1 A 112 112 ASP C C 112 175.986 175.657 0.329 1
1 1338 . 14 1 1 A 112 112 ASP CA C 112 54.256 53.423 0.833 1
1 1339 . 14 1 1 A 112 112 ASP CB C 112 41.563 39.316 2.247 1
1 1340 . 14 1 1 A 112 112 ASP N N 112 121.863 120.370 1.493 1
1 1341 . 14 1 1 A 113 113 LYS H H 113 8.059 7.614 0.445 1
1 1342 . 14 1 1 A 113 113 LYS HA H 113 4.136 3.758 0.378 1
1 1351 . 14 1 1 A 113 113 LYS C C 113 176.010 176.200 -0.190 1
1 1352 . 14 1 1 A 113 113 LYS CA C 113 56.253 56.035 0.218 1
1 1353 . 14 1 1 A 113 113 LYS CB C 113 32.754 32.553 0.201 1
1 1357 . 14 1 1 A 113 113 LYS N N 113 121.725 123.372 -1.647 1
1 1358 . 14 1 1 A 114 114 LYS H H 114 8.225 7.330 0.895 1
1 1359 . 14 1 1 A 114 114 LYS HA H 114 4.169 4.283 -0.114 1
1 1368 . 14 1 1 A 114 114 LYS C C 114 176.198 176.469 -0.271 1
1 1369 . 14 1 1 A 114 114 LYS CA C 114 56.413 55.571 0.842 1
1 1370 . 14 1 1 A 114 114 LYS CB C 114 32.725 32.838 -0.113 1
1 1374 . 14 1 1 A 114 114 LYS N N 114 121.857 121.637 0.220 1
1 1375 . 14 1 1 A 115 115 TRP H H 115 8.078 8.625 -0.547 1
1 1376 . 14 1 1 A 115 115 TRP HA H 115 4.709 4.756 -0.047 1
1 1385 . 14 1 1 A 115 115 TRP C C 115 175.119 175.902 -0.783 1
1 1386 . 14 1 1 A 115 115 TRP CA C 115 56.856 56.554 0.302 1
1 1387 . 14 1 1 A 115 115 TRP CB C 115 29.474 27.775 1.699 1
1 1393 . 14 1 1 A 115 115 TRP N N 115 122.068 127.037 -4.969 1
1 1 . 15 1 1 A 10 10 HIS HA H 10 4.616 4.557 0.059 1
1 4 . 15 1 1 A 10 10 HIS C C 10 174.981 174.437 0.544 1
1 5 . 15 1 1 A 10 10 HIS CA C 10 56.555 57.419 -0.864 1
1 6 . 15 1 1 A 10 10 HIS CB C 10 30.231 30.782 -0.551 1
1 7 . 15 1 1 A 11 11 MET H H 11 8.103 7.789 0.314 1
1 8 . 15 1 1 A 11 11 MET HA H 11 4.439 4.818 -0.379 1
1 13 . 15 1 1 A 11 11 MET C C 11 175.888 174.181 1.707 1
1 14 . 15 1 1 A 11 11 MET CA C 11 55.090 54.565 0.525 1
1 15 . 15 1 1 A 11 11 MET CB C 11 33.121 35.961 -2.840 1
1 17 . 15 1 1 A 11 11 MET N N 11 120.743 117.459 3.284 1
1 18 . 15 1 1 A 12 12 LYS H H 12 8.065 8.684 -0.619 1
1 19 . 15 1 1 A 12 12 LYS HA H 12 4.407 4.632 -0.225 1
1 28 . 15 1 1 A 12 12 LYS CA C 12 54.894 53.741 1.153 1
1 29 . 15 1 1 A 12 12 LYS CB C 12 31.863 31.895 -0.032 1
1 33 . 15 1 1 A 12 12 LYS N N 12 123.187 125.814 -2.627 1
1 34 . 15 1 1 A 13 13 PRO HA H 13 4.347 4.456 -0.109 1
1 41 . 15 1 1 A 13 13 PRO C C 13 176.891 177.460 -0.569 1
1 42 . 15 1 1 A 13 13 PRO CA C 13 62.542 62.370 0.172 1
1 43 . 15 1 1 A 13 13 PRO CB C 13 32.663 32.666 -0.003 1
1 46 . 15 1 1 A 14 14 LEU H H 14 8.339 8.755 -0.416 1
1 47 . 15 1 1 A 14 14 LEU HA H 14 3.373 3.849 -0.476 1
1 57 . 15 1 1 A 14 14 LEU C C 14 176.683 178.112 -1.429 1
1 58 . 15 1 1 A 14 14 LEU CA C 14 58.555 57.599 0.956 1
1 59 . 15 1 1 A 14 14 LEU CB C 14 41.828 41.000 0.828 1
1 63 . 15 1 1 A 14 14 LEU N N 14 123.191 124.002 -0.811 1
1 64 . 15 1 1 A 15 15 ALA H H 15 8.175 7.806 0.369 1
1 65 . 15 1 1 A 15 15 ALA HA H 15 3.983 4.212 -0.229 1
1 69 . 15 1 1 A 15 15 ALA C C 15 178.697 177.997 0.700 1
1 70 . 15 1 1 A 15 15 ALA CA C 15 54.164 54.377 -0.213 1
1 71 . 15 1 1 A 15 15 ALA CB C 15 18.771 18.272 0.499 1
1 72 . 15 1 1 A 15 15 ALA N N 15 113.594 119.647 -6.053 1
1 73 . 15 1 1 A 16 16 GLU H H 16 7.458 7.770 -0.312 1
1 74 . 15 1 1 A 16 16 GLU HA H 16 4.266 4.283 -0.017 1
1 79 . 15 1 1 A 16 16 GLU C C 16 176.510 176.651 -0.141 1
1 80 . 15 1 1 A 16 16 GLU CA C 16 55.196 56.559 -1.363 1
1 81 . 15 1 1 A 16 16 GLU CB C 16 30.907 30.260 0.647 1
1 83 . 15 1 1 A 16 16 GLU N N 16 113.348 115.744 -2.396 1
1 84 . 15 1 1 A 17 17 GLN H H 17 7.501 7.019 0.482 1
1 85 . 15 1 1 A 17 17 GLN HA H 17 3.683 3.956 -0.273 1
1 92 . 15 1 1 A 17 17 GLN C C 17 178.053 176.105 1.948 1
1 93 . 15 1 1 A 17 17 GLN CA C 17 54.606 55.517 -0.911 1
1 94 . 15 1 1 A 17 17 GLN CB C 17 25.758 28.471 -2.713 1
1 96 . 15 1 1 A 17 17 GLN N N 17 119.411 119.426 -0.015 1
1 98 . 15 1 1 A 18 18 ASP H H 18 8.949 8.528 0.421 1
1 99 . 15 1 1 A 18 18 ASP HA H 18 4.184 4.132 0.052 1
1 102 . 15 1 1 A 18 18 ASP C C 18 175.263 178.283 -3.020 1
1 103 . 15 1 1 A 18 18 ASP CA C 18 57.275 56.760 0.515 1
1 104 . 15 1 1 A 18 18 ASP CB C 18 40.620 40.163 0.457 1
1 105 . 15 1 1 A 18 18 ASP N N 18 124.676 124.059 0.617 1
1 106 . 15 1 1 A 19 19 TRP H H 19 6.068 7.265 -1.197 1
1 107 . 15 1 1 A 19 19 TRP HA H 19 5.045 4.558 0.487 1
1 116 . 15 1 1 A 19 19 TRP C C 19 175.902 176.380 -0.478 1
1 117 . 15 1 1 A 19 19 TRP CA C 19 53.542 57.927 -4.385 1
1 118 . 15 1 1 A 19 19 TRP CB C 19 29.179 28.636 0.543 1
1 124 . 15 1 1 A 19 19 TRP N N 19 107.757 118.438 -10.681 1
1 126 . 15 1 1 A 20 20 TYR H H 20 7.430 7.412 0.018 1
1 127 . 15 1 1 A 20 20 TYR HA H 20 5.601 5.289 0.312 1
1 132 . 15 1 1 A 20 20 TYR C C 20 175.498 175.702 -0.204 1
1 133 . 15 1 1 A 20 20 TYR CA C 20 56.967 56.826 0.141 1
1 134 . 15 1 1 A 20 20 TYR CB C 20 39.083 38.410 0.673 1
1 137 . 15 1 1 A 20 20 TYR N N 20 123.173 122.095 1.078 1
1 138 . 15 1 1 A 21 21 HIS H H 21 8.934 8.952 -0.018 1
1 139 . 15 1 1 A 21 21 HIS HA H 21 4.295 4.139 0.156 1
1 144 . 15 1 1 A 21 21 HIS C C 21 175.177 175.065 0.112 1
1 145 . 15 1 1 A 21 21 HIS CA C 21 56.572 56.865 -0.293 1
1 146 . 15 1 1 A 21 21 HIS CB C 21 33.365 32.441 0.924 1
1 149 . 15 1 1 A 21 21 HIS N N 21 125.732 127.426 -1.694 1
1 150 . 15 1 1 A 22 22 GLY H H 22 5.280 6.739 -1.459 1
1 151 . 15 1 1 A 22 22 GLY HA2 H 22 3.905 3.377 0.528 1
1 152 . 15 1 1 A 22 22 GLY HA3 H 22 3.585 3.707 -0.122 1
1 153 . 15 1 1 A 22 22 GLY C C 22 174.411 174.367 0.044 1
1 154 . 15 1 1 A 22 22 GLY CA C 22 46.402 44.385 2.017 1
1 155 . 15 1 1 A 22 22 GLY N N 22 104.568 106.852 -2.284 1
1 156 . 15 1 1 A 23 23 ALA H H 23 8.768 8.281 0.487 1
1 157 . 15 1 1 A 23 23 ALA HA H 23 5.171 4.628 0.543 1
1 161 . 15 1 1 A 23 23 ALA C C 23 177.180 177.123 0.057 1
1 162 . 15 1 1 A 23 23 ALA CA C 23 51.153 51.566 -0.413 1
1 163 . 15 1 1 A 23 23 ALA CB C 23 16.999 17.456 -0.457 1
1 164 . 15 1 1 A 23 23 ALA N N 23 130.297 125.885 4.412 1
1 165 . 15 1 1 A 24 24 ILE H H 24 7.267 7.337 -0.070 1
1 166 . 15 1 1 A 24 24 ILE HA H 24 4.460 4.503 -0.043 1
1 176 . 15 1 1 A 24 24 ILE CA C 24 58.529 59.529 -1.000 1
1 177 . 15 1 1 A 24 24 ILE CB C 24 38.763 37.883 0.880 1
1 181 . 15 1 1 A 24 24 ILE N N 24 118.903 115.424 3.479 1
1 182 . 15 1 1 A 25 25 PRO HA H 25 4.224 4.456 -0.232 1
1 189 . 15 1 1 A 25 25 PRO C C 25 176.918 177.753 -0.835 1
1 190 . 15 1 1 A 25 25 PRO CA C 25 62.907 62.835 0.072 1
1 191 . 15 1 1 A 25 25 PRO CB C 25 32.671 32.669 0.002 1
1 194 . 15 1 1 A 26 26 ARG H H 26 8.781 8.982 -0.201 1
1 195 . 15 1 1 A 26 26 ARG HA H 26 3.472 3.874 -0.402 1
1 202 . 15 1 1 A 26 26 ARG C C 26 178.112 177.997 0.115 1
1 203 . 15 1 1 A 26 26 ARG CA C 26 60.863 59.459 1.404 1
1 204 . 15 1 1 A 26 26 ARG CB C 26 30.314 29.859 0.455 1
1 207 . 15 1 1 A 26 26 ARG N N 26 124.635 122.745 1.890 1
1 208 . 15 1 1 A 27 27 ILE H H 27 8.540 8.105 0.435 1
1 209 . 15 1 1 A 27 27 ILE HA H 27 3.787 3.686 0.101 1
1 219 . 15 1 1 A 27 27 ILE C C 27 177.390 177.561 -0.171 1
1 220 . 15 1 1 A 27 27 ILE CA C 27 64.329 64.722 -0.393 1
1 221 . 15 1 1 A 27 27 ILE CB C 27 37.413 37.979 -0.566 1
1 225 . 15 1 1 A 27 27 ILE N N 27 115.859 119.928 -4.069 1
1 226 . 15 1 1 A 28 28 GLU H H 28 6.953 8.453 -1.500 1
1 227 . 15 1 1 A 28 28 GLU HA H 28 4.067 4.035 0.032 1
1 232 . 15 1 1 A 28 28 GLU C C 28 179.006 179.414 -0.408 1
1 233 . 15 1 1 A 28 28 GLU CA C 28 58.985 59.489 -0.504 1
1 234 . 15 1 1 A 28 28 GLU CB C 28 29.316 29.096 0.220 1
1 236 . 15 1 1 A 28 28 GLU N N 28 120.554 119.490 1.064 1
1 237 . 15 1 1 A 29 29 ALA H H 29 7.999 7.833 0.166 1
1 238 . 15 1 1 A 29 29 ALA HA H 29 3.822 4.022 -0.200 1
1 242 . 15 1 1 A 29 29 ALA C C 29 178.809 179.697 -0.888 1
1 243 . 15 1 1 A 29 29 ALA CA C 29 54.698 54.953 -0.255 1
1 244 . 15 1 1 A 29 29 ALA CB C 29 18.059 18.418 -0.359 1
1 245 . 15 1 1 A 29 29 ALA N N 29 120.122 122.720 -2.598 1
1 246 . 15 1 1 A 30 30 GLN H H 30 8.168 7.831 0.337 1
1 247 . 15 1 1 A 30 30 GLN HA H 30 3.811 4.202 -0.391 1
1 254 . 15 1 1 A 30 30 GLN C C 30 177.578 178.068 -0.490 1
1 255 . 15 1 1 A 30 30 GLN CA C 30 59.731 58.434 1.297 1
1 256 . 15 1 1 A 30 30 GLN CB C 30 28.161 29.082 -0.921 1
1 258 . 15 1 1 A 30 30 GLN N N 30 112.109 115.849 -3.740 1
1 260 . 15 1 1 A 31 31 GLU H H 31 7.248 8.214 -0.966 1
1 261 . 15 1 1 A 31 31 GLU HA H 31 4.063 4.055 0.008 1
1 266 . 15 1 1 A 31 31 GLU C C 31 177.423 178.650 -1.227 1
1 267 . 15 1 1 A 31 31 GLU CA C 31 57.650 59.106 -1.456 1
1 268 . 15 1 1 A 31 31 GLU CB C 31 29.757 29.480 0.277 1
1 270 . 15 1 1 A 31 31 GLU N N 31 115.340 119.220 -3.880 1
1 271 . 15 1 1 A 32 32 LEU H H 32 7.169 7.707 -0.538 1
1 272 . 15 1 1 A 32 32 LEU HA H 32 4.087 4.481 -0.394 1
1 282 . 15 1 1 A 32 32 LEU C C 32 175.850 176.344 -0.494 1
1 283 . 15 1 1 A 32 32 LEU CA C 32 55.580 54.999 0.581 1
1 284 . 15 1 1 A 32 32 LEU CB C 32 42.910 41.856 1.054 1
1 288 . 15 1 1 A 32 32 LEU N N 32 116.367 113.816 2.551 1
1 289 . 15 1 1 A 33 33 LEU H H 33 7.062 7.645 -0.583 1
1 290 . 15 1 1 A 33 33 LEU HA H 33 4.431 4.521 -0.090 1
1 300 . 15 1 1 A 33 33 LEU C C 33 174.837 176.973 -2.136 1
1 301 . 15 1 1 A 33 33 LEU CA C 33 53.521 54.425 -0.904 1
1 302 . 15 1 1 A 33 33 LEU CB C 33 43.301 42.232 1.069 1
1 306 . 15 1 1 A 33 33 LEU N N 33 118.568 121.908 -3.340 1
1 307 . 15 1 1 A 34 34 LYS H H 34 8.749 8.560 0.189 1
1 308 . 15 1 1 A 34 34 LYS HA H 34 4.162 4.129 0.033 1
1 317 . 15 1 1 A 34 34 LYS C C 34 174.378 175.611 -1.233 1
1 318 . 15 1 1 A 34 34 LYS CA C 34 56.575 56.257 0.318 1
1 319 . 15 1 1 A 34 34 LYS CB C 34 36.918 34.544 2.374 1
1 323 . 15 1 1 A 34 34 LYS N N 34 121.659 118.155 3.504 1
1 324 . 15 1 1 A 35 35 LYS H H 35 8.137 7.429 0.708 1
1 325 . 15 1 1 A 35 35 LYS HA H 35 4.011 4.679 -0.668 1
1 334 . 15 1 1 A 35 35 LYS C C 35 174.343 176.153 -1.810 1
1 335 . 15 1 1 A 35 35 LYS CA C 35 53.960 55.380 -1.420 1
1 336 . 15 1 1 A 35 35 LYS CB C 35 35.587 34.376 1.211 1
1 340 . 15 1 1 A 35 35 LYS N N 35 119.354 116.777 2.577 1
1 341 . 15 1 1 A 36 36 GLN H H 36 8.394 8.693 -0.299 1
1 342 . 15 1 1 A 36 36 GLN HA H 36 4.187 4.367 -0.180 1
1 349 . 15 1 1 A 36 36 GLN C C 36 177.012 176.518 0.494 1
1 350 . 15 1 1 A 36 36 GLN CA C 36 57.750 57.464 0.286 1
1 351 . 15 1 1 A 36 36 GLN CB C 36 28.433 28.503 -0.070 1
1 353 . 15 1 1 A 36 36 GLN N N 36 120.248 122.929 -2.681 1
1 355 . 15 1 1 A 37 37 GLY H H 37 9.597 8.565 1.032 1
1 356 . 15 1 1 A 37 37 GLY HA2 H 37 4.486 4.140 0.346 1
1 357 . 15 1 1 A 37 37 GLY HA3 H 37 3.926 4.143 -0.217 1
1 358 . 15 1 1 A 37 37 GLY C C 37 176.285 174.687 1.598 1
1 359 . 15 1 1 A 37 37 GLY CA C 37 46.146 45.456 0.690 1
1 360 . 15 1 1 A 37 37 GLY N N 37 116.637 113.280 3.357 1
1 361 . 15 1 1 A 38 38 ASP H H 38 8.925 7.920 1.005 1
1 362 . 15 1 1 A 38 38 ASP HA H 38 5.697 4.703 0.994 1
1 365 . 15 1 1 A 38 38 ASP C C 38 176.181 175.793 0.388 1
1 366 . 15 1 1 A 38 38 ASP CA C 38 55.066 55.550 -0.484 1
1 367 . 15 1 1 A 38 38 ASP CB C 38 42.933 41.290 1.643 1
1 368 . 15 1 1 A 38 38 ASP N N 38 127.293 121.945 5.348 1
1 369 . 15 1 1 A 39 39 PHE H H 39 8.647 8.568 0.079 1
1 370 . 15 1 1 A 39 39 PHE HA H 39 6.025 6.003 0.022 1
1 378 . 15 1 1 A 39 39 PHE C C 39 170.948 173.038 -2.090 1
1 379 . 15 1 1 A 39 39 PHE CA C 39 56.376 56.055 0.321 1
1 380 . 15 1 1 A 39 39 PHE CB C 39 44.583 42.883 1.700 1
1 386 . 15 1 1 A 39 39 PHE N N 39 117.102 119.825 -2.723 1
1 387 . 15 1 1 A 40 40 LEU H H 40 9.186 9.018 0.168 1
1 388 . 15 1 1 A 40 40 LEU HA H 40 4.983 5.019 -0.036 1
1 398 . 15 1 1 A 40 40 LEU C C 40 174.787 174.434 0.353 1
1 399 . 15 1 1 A 40 40 LEU CA C 40 54.610 54.077 0.533 1
1 400 . 15 1 1 A 40 40 LEU CB C 40 44.330 45.665 -1.335 1
1 404 . 15 1 1 A 40 40 LEU N N 40 114.388 117.194 -2.806 1
1 405 . 15 1 1 A 41 41 VAL H H 41 9.390 9.402 -0.012 1
1 406 . 15 1 1 A 41 41 VAL HA H 41 5.742 5.133 0.609 1
1 414 . 15 1 1 A 41 41 VAL C C 41 172.760 175.174 -2.414 1
1 415 . 15 1 1 A 41 41 VAL CA C 41 60.814 61.490 -0.676 1
1 416 . 15 1 1 A 41 41 VAL CB C 41 34.908 33.570 1.338 1
1 419 . 15 1 1 A 41 41 VAL N N 41 119.873 121.606 -1.733 1
1 420 . 15 1 1 A 42 42 ARG H H 42 9.598 9.176 0.422 1
1 421 . 15 1 1 A 42 42 ARG HA H 42 5.247 5.381 -0.134 1
1 429 . 15 1 1 A 42 42 ARG C C 42 173.379 174.149 -0.770 1
1 430 . 15 1 1 A 42 42 ARG CA C 42 53.202 53.851 -0.649 1
1 431 . 15 1 1 A 42 42 ARG CB C 42 33.507 34.174 -0.667 1
1 434 . 15 1 1 A 42 42 ARG N N 42 124.179 124.654 -0.475 1
1 436 . 15 1 1 A 43 43 GLU H H 43 8.234 8.835 -0.601 1
1 437 . 15 1 1 A 43 43 GLU HA H 43 4.890 4.706 0.184 1
1 442 . 15 1 1 A 43 43 GLU C C 43 176.929 176.133 0.796 1
1 443 . 15 1 1 A 43 43 GLU CA C 43 54.846 54.768 0.078 1
1 444 . 15 1 1 A 43 43 GLU CB C 43 31.599 31.977 -0.378 1
1 446 . 15 1 1 A 43 43 GLU N N 43 124.103 122.075 2.028 1
1 447 . 15 1 1 A 44 44 SER H H 44 9.033 8.964 0.069 1
1 448 . 15 1 1 A 44 44 SER HA H 44 3.957 4.593 -0.636 1
1 451 . 15 1 1 A 44 44 SER C C 44 175.005 174.819 0.186 1
1 452 . 15 1 1 A 44 44 SER CA C 44 59.393 59.192 0.201 1
1 453 . 15 1 1 A 44 44 SER CB C 44 63.619 63.951 -0.332 1
1 454 . 15 1 1 A 44 44 SER N N 44 124.316 121.285 3.031 1
1 455 . 15 1 1 A 45 45 HIS H H 45 8.461 8.932 -0.471 1
1 456 . 15 1 1 A 45 45 HIS HA H 45 4.132 4.165 -0.033 1
1 460 . 15 1 1 A 45 45 HIS C C 45 176.480 176.809 -0.329 1
1 461 . 15 1 1 A 45 45 HIS CA C 45 58.887 58.943 -0.056 1
1 462 . 15 1 1 A 45 45 HIS CB C 45 30.180 30.455 -0.275 1
1 464 . 15 1 1 A 45 45 HIS N N 45 127.694 123.427 4.267 1
1 465 . 15 1 1 A 46 46 GLY H H 46 8.513 8.171 0.342 1
1 466 . 15 1 1 A 46 46 GLY HA2 H 46 3.827 3.902 -0.075 1
1 467 . 15 1 1 A 46 46 GLY HA3 H 46 3.827 3.904 -0.077 1
1 468 . 15 1 1 A 46 46 GLY C C 46 173.630 173.940 -0.310 1
1 469 . 15 1 1 A 46 46 GLY CA C 46 45.188 45.461 -0.273 1
1 470 . 15 1 1 A 46 46 GLY N N 46 110.761 106.820 3.941 1
1 471 . 15 1 1 A 47 47 LYS H H 47 7.216 7.658 -0.442 1
1 472 . 15 1 1 A 47 47 LYS HA H 47 4.540 4.733 -0.193 1
1 481 . 15 1 1 A 47 47 LYS CA C 47 53.475 53.125 0.350 1
1 482 . 15 1 1 A 47 47 LYS CB C 47 33.325 33.761 -0.436 1
1 486 . 15 1 1 A 47 47 LYS N N 47 121.356 120.893 0.463 1
1 487 . 15 1 1 A 48 48 PRO HA H 48 4.181 4.250 -0.069 1
1 494 . 15 1 1 A 48 48 PRO C C 48 178.920 177.626 1.294 1
1 495 . 15 1 1 A 48 48 PRO CA C 48 63.239 63.681 -0.442 1
1 496 . 15 1 1 A 48 48 PRO CB C 48 31.523 31.292 0.231 1
1 499 . 15 1 1 A 49 49 GLY H H 49 9.752 8.661 1.091 1
1 500 . 15 1 1 A 49 49 GLY HA2 H 49 4.053 3.884 0.169 1
1 501 . 15 1 1 A 49 49 GLY HA3 H 49 3.374 4.002 -0.628 1
1 502 . 15 1 1 A 49 49 GLY C C 49 172.093 173.573 -1.480 1
1 503 . 15 1 1 A 49 49 GLY CA C 49 45.041 45.169 -0.128 1
1 504 . 15 1 1 A 49 49 GLY N N 49 112.415 112.695 -0.280 1
1 505 . 15 1 1 A 50 50 GLU H H 50 7.623 7.474 0.149 1
1 506 . 15 1 1 A 50 50 GLU HA H 50 4.537 4.869 -0.332 1
1 511 . 15 1 1 A 50 50 GLU C C 50 173.297 174.628 -1.331 1
1 512 . 15 1 1 A 50 50 GLU CA C 50 55.174 55.221 -0.047 1
1 513 . 15 1 1 A 50 50 GLU CB C 50 31.651 31.460 0.191 1
1 515 . 15 1 1 A 50 50 GLU N N 50 121.600 121.197 0.403 1
1 516 . 15 1 1 A 51 51 TYR H H 51 9.452 9.327 0.125 1
1 517 . 15 1 1 A 51 51 TYR HA H 51 5.382 5.344 0.038 1
1 524 . 15 1 1 A 51 51 TYR C C 51 174.387 175.110 -0.723 1
1 525 . 15 1 1 A 51 51 TYR CA C 51 57.592 56.781 0.811 1
1 526 . 15 1 1 A 51 51 TYR CB C 51 41.820 41.410 0.410 1
1 531 . 15 1 1 A 51 51 TYR N N 51 125.790 127.071 -1.281 1
1 532 . 15 1 1 A 52 52 VAL H H 52 9.471 9.676 -0.205 1
1 533 . 15 1 1 A 52 52 VAL HA H 52 4.840 4.866 -0.026 1
1 541 . 15 1 1 A 52 52 VAL C C 52 174.947 174.860 0.087 1
1 542 . 15 1 1 A 52 52 VAL CA C 52 60.991 61.395 -0.404 1
1 543 . 15 1 1 A 52 52 VAL CB C 52 36.829 34.043 2.786 1
1 546 . 15 1 1 A 52 52 VAL N N 52 120.617 122.364 -1.747 1
1 547 . 15 1 1 A 53 53 LEU H H 53 9.457 9.356 0.101 1
1 548 . 15 1 1 A 53 53 LEU HA H 53 5.294 5.149 0.145 1
1 558 . 15 1 1 A 53 53 LEU C C 53 175.024 174.815 0.209 1
1 559 . 15 1 1 A 53 53 LEU CA C 53 53.904 54.082 -0.178 1
1 560 . 15 1 1 A 53 53 LEU CB C 53 44.756 43.646 1.110 1
1 564 . 15 1 1 A 53 53 LEU N N 53 127.725 131.272 -3.547 1
1 565 . 15 1 1 A 54 54 SER H H 54 9.461 9.319 0.142 1
1 566 . 15 1 1 A 54 54 SER HA H 54 5.691 5.333 0.358 1
1 569 . 15 1 1 A 54 54 SER C C 54 172.227 173.224 -0.997 1
1 570 . 15 1 1 A 54 54 SER CA C 54 58.551 57.961 0.590 1
1 571 . 15 1 1 A 54 54 SER CB C 54 65.738 64.019 1.719 1
1 572 . 15 1 1 A 54 54 SER N N 54 127.178 124.908 2.270 1
1 573 . 15 1 1 A 55 55 VAL H H 55 9.049 9.018 0.031 1
1 574 . 15 1 1 A 55 55 VAL HA H 55 5.691 5.392 0.299 1
1 582 . 15 1 1 A 55 55 VAL C C 55 173.959 173.052 0.907 1
1 583 . 15 1 1 A 55 55 VAL CA C 55 58.398 59.789 -1.391 1
1 584 . 15 1 1 A 55 55 VAL CB C 55 36.262 35.810 0.452 1
1 587 . 15 1 1 A 55 55 VAL N N 55 120.619 125.209 -4.590 1
1 588 . 15 1 1 A 56 56 TYR H H 56 8.629 9.226 -0.597 1
1 589 . 15 1 1 A 56 56 TYR HA H 56 4.951 4.890 0.061 1
1 596 . 15 1 1 A 56 56 TYR C C 56 175.224 174.353 0.871 1
1 597 . 15 1 1 A 56 56 TYR CA C 56 56.684 56.450 0.234 1
1 598 . 15 1 1 A 56 56 TYR CB C 56 39.646 38.751 0.895 1
1 603 . 15 1 1 A 56 56 TYR N N 56 127.444 130.146 -2.702 1
1 604 . 15 1 1 A 57 57 SER H H 57 8.869 8.912 -0.043 1
1 605 . 15 1 1 A 57 57 SER HA H 57 4.739 5.332 -0.593 1
1 608 . 15 1 1 A 57 57 SER C C 57 174.492 172.811 1.681 1
1 609 . 15 1 1 A 57 57 SER CA C 57 57.591 56.711 0.880 1
1 610 . 15 1 1 A 57 57 SER CB C 57 64.281 66.143 -1.862 1
1 611 . 15 1 1 A 57 57 SER N N 57 122.165 122.881 -0.716 1
1 612 . 15 1 1 A 58 58 ASP H H 58 10.446 9.199 1.247 1
1 613 . 15 1 1 A 58 58 ASP HA H 58 4.382 4.304 0.078 1
1 616 . 15 1 1 A 58 58 ASP C C 58 176.398 176.055 0.343 1
1 617 . 15 1 1 A 58 58 ASP CA C 58 55.215 55.281 -0.066 1
1 618 . 15 1 1 A 58 58 ASP CB C 58 39.513 39.305 0.208 1
1 619 . 15 1 1 A 58 58 ASP N N 58 132.098 128.018 4.080 1
1 620 . 15 1 1 A 59 59 GLY H H 59 7.861 8.386 -0.525 1
1 621 . 15 1 1 A 59 59 GLY HA2 H 59 3.817 3.731 0.086 1
1 622 . 15 1 1 A 59 59 GLY HA3 H 59 4.086 3.767 0.319 1
1 623 . 15 1 1 A 59 59 GLY C C 59 173.111 173.345 -0.234 1
1 624 . 15 1 1 A 59 59 GLY CA C 59 45.486 45.280 0.206 1
1 625 . 15 1 1 A 59 59 GLY N N 59 102.674 104.620 -1.946 1
1 626 . 15 1 1 A 60 60 GLN H H 60 7.137 7.742 -0.605 1
1 627 . 15 1 1 A 60 60 GLN HA H 60 4.455 4.451 0.004 1
1 634 . 15 1 1 A 60 60 GLN C C 60 173.549 175.118 -1.569 1
1 635 . 15 1 1 A 60 60 GLN CA C 60 53.388 54.046 -0.658 1
1 636 . 15 1 1 A 60 60 GLN CB C 60 32.373 30.464 1.909 1
1 638 . 15 1 1 A 60 60 GLN N N 60 116.206 119.594 -3.388 1
1 640 . 15 1 1 A 61 61 ARG H H 61 8.589 8.329 0.260 1
1 641 . 15 1 1 A 61 61 ARG HA H 61 4.740 4.398 0.342 1
1 649 . 15 1 1 A 61 61 ARG C C 61 174.458 174.561 -0.103 1
1 650 . 15 1 1 A 61 61 ARG CA C 61 57.116 55.700 1.416 1
1 651 . 15 1 1 A 61 61 ARG CB C 61 29.615 30.599 -0.984 1
1 654 . 15 1 1 A 61 61 ARG N N 61 120.467 122.126 -1.659 1
1 656 . 15 1 1 A 62 62 ARG H H 62 8.867 9.034 -0.167 1
1 657 . 15 1 1 A 62 62 ARG HA H 62 4.297 4.404 -0.107 1
1 665 . 15 1 1 A 62 62 ARG C C 62 173.485 175.036 -1.551 1
1 666 . 15 1 1 A 62 62 ARG CA C 62 53.355 54.993 -1.638 1
1 667 . 15 1 1 A 62 62 ARG CB C 62 33.028 31.797 1.231 1
1 670 . 15 1 1 A 62 62 ARG N N 62 122.641 124.640 -1.999 1
1 672 . 15 1 1 A 63 63 HIS H H 63 7.997 8.563 -0.566 1
1 673 . 15 1 1 A 63 63 HIS HA H 63 5.427 5.476 -0.049 1
1 678 . 15 1 1 A 63 63 HIS C C 63 174.946 173.888 1.058 1
1 679 . 15 1 1 A 63 63 HIS CA C 63 54.689 53.728 0.961 1
1 680 . 15 1 1 A 63 63 HIS CB C 63 33.008 32.165 0.843 1
1 683 . 15 1 1 A 63 63 HIS N N 63 119.064 120.513 -1.449 1
1 684 . 15 1 1 A 64 64 PHE H H 64 9.880 9.474 0.406 1
1 685 . 15 1 1 A 64 64 PHE HA H 64 4.824 5.086 -0.262 1
1 693 . 15 1 1 A 64 64 PHE C C 64 174.882 175.412 -0.530 1
1 694 . 15 1 1 A 64 64 PHE CA C 64 56.489 56.630 -0.141 1
1 695 . 15 1 1 A 64 64 PHE CB C 64 41.405 40.547 0.858 1
1 701 . 15 1 1 A 64 64 PHE N N 64 123.961 122.286 1.675 1
1 702 . 15 1 1 A 65 65 ILE H H 65 8.982 9.000 -0.018 1
1 703 . 15 1 1 A 65 65 ILE HA H 65 4.273 4.386 -0.113 1
1 713 . 15 1 1 A 65 65 ILE C C 65 176.556 175.938 0.618 1
1 714 . 15 1 1 A 65 65 ILE CA C 65 62.649 62.199 0.450 1
1 715 . 15 1 1 A 65 65 ILE CB C 65 38.296 38.008 0.288 1
1 719 . 15 1 1 A 65 65 ILE N N 65 126.601 125.376 1.225 1
1 720 . 15 1 1 A 66 66 ILE H H 66 8.947 9.194 -0.247 1
1 721 . 15 1 1 A 66 66 ILE HA H 66 3.780 4.150 -0.370 1
1 731 . 15 1 1 A 66 66 ILE C C 66 175.721 175.708 0.013 1
1 732 . 15 1 1 A 66 66 ILE CA C 66 62.960 60.725 2.235 1
1 733 . 15 1 1 A 66 66 ILE CB C 66 37.209 38.474 -1.265 1
1 737 . 15 1 1 A 66 66 ILE N N 66 130.139 129.149 0.990 1
1 738 . 15 1 1 A 67 67 GLN H H 67 8.410 8.478 -0.068 1
1 739 . 15 1 1 A 67 67 GLN HA H 67 4.422 4.763 -0.341 1
1 746 . 15 1 1 A 67 67 GLN C C 67 174.347 174.280 0.067 1
1 747 . 15 1 1 A 67 67 GLN CA C 67 55.867 55.383 0.484 1
1 748 . 15 1 1 A 67 67 GLN CB C 67 29.950 29.687 0.263 1
1 750 . 15 1 1 A 67 67 GLN N N 67 128.872 127.109 1.763 1
1 752 . 15 1 1 A 68 68 TYR H H 68 8.619 8.912 -0.293 1
1 753 . 15 1 1 A 68 68 TYR HA H 68 5.300 4.772 0.528 1
1 760 . 15 1 1 A 68 68 TYR C C 68 174.695 174.181 0.514 1
1 761 . 15 1 1 A 68 68 TYR CA C 68 55.579 56.264 -0.685 1
1 762 . 15 1 1 A 68 68 TYR CB C 68 39.479 39.069 0.410 1
1 767 . 15 1 1 A 68 68 TYR N N 68 124.772 125.571 -0.799 1
1 768 . 15 1 1 A 69 69 VAL H H 69 8.539 8.539 0.000 1
1 769 . 15 1 1 A 69 69 VAL HA H 69 4.046 4.390 -0.344 1
1 777 . 15 1 1 A 69 69 VAL C C 69 175.010 175.009 0.001 1
1 778 . 15 1 1 A 69 69 VAL CA C 69 60.611 60.548 0.063 1
1 779 . 15 1 1 A 69 69 VAL CB C 69 35.358 34.414 0.944 1
1 782 . 15 1 1 A 69 69 VAL N N 69 126.652 127.033 -0.381 1
1 783 . 15 1 1 A 70 70 ASP H H 70 9.089 9.248 -0.159 1
1 784 . 15 1 1 A 70 70 ASP HA H 70 4.025 4.214 -0.189 1
1 787 . 15 1 1 A 70 70 ASP C C 70 174.813 175.063 -0.250 1
1 788 . 15 1 1 A 70 70 ASP CA C 70 55.623 55.448 0.175 1
1 789 . 15 1 1 A 70 70 ASP CB C 70 39.081 39.262 -0.181 1
1 790 . 15 1 1 A 70 70 ASP N N 70 128.327 127.410 0.917 1
1 791 . 15 1 1 A 71 71 ASN H H 71 8.128 8.071 0.057 1
1 792 . 15 1 1 A 71 71 ASN HA H 71 3.597 3.321 0.276 1
1 797 . 15 1 1 A 71 71 ASN C C 71 173.250 173.417 -0.167 1
1 798 . 15 1 1 A 71 71 ASN CA C 71 54.728 54.272 0.456 1
1 799 . 15 1 1 A 71 71 ASN CB C 71 37.601 37.034 0.567 1
1 800 . 15 1 1 A 71 71 ASN N N 71 107.230 108.198 -0.968 1
1 802 . 15 1 1 A 72 72 MET H H 72 7.256 7.221 0.035 1
1 803 . 15 1 1 A 72 72 MET HA H 72 4.740 4.898 -0.158 1
1 808 . 15 1 1 A 72 72 MET C C 72 173.780 174.039 -0.259 1
1 809 . 15 1 1 A 72 72 MET CA C 72 53.703 54.281 -0.578 1
1 810 . 15 1 1 A 72 72 MET CB C 72 36.570 36.837 -0.267 1
1 812 . 15 1 1 A 72 72 MET N N 72 117.117 116.428 0.689 1
1 813 . 15 1 1 A 73 73 TYR H H 73 9.430 9.075 0.355 1
1 814 . 15 1 1 A 73 73 TYR HA H 73 5.718 5.039 0.679 1
1 821 . 15 1 1 A 73 73 TYR C C 73 176.140 175.896 0.244 1
1 822 . 15 1 1 A 73 73 TYR CA C 73 57.290 58.079 -0.789 1
1 823 . 15 1 1 A 73 73 TYR CB C 73 40.013 39.197 0.816 1
1 828 . 15 1 1 A 73 73 TYR N N 73 119.856 122.749 -2.893 1
1 829 . 15 1 1 A 74 74 ARG H H 74 9.038 8.962 0.076 1
1 830 . 15 1 1 A 74 74 ARG HA H 74 4.867 5.066 -0.199 1
1 838 . 15 1 1 A 74 74 ARG C C 74 173.954 174.658 -0.704 1
1 839 . 15 1 1 A 74 74 ARG CA C 74 54.887 53.951 0.936 1
1 840 . 15 1 1 A 74 74 ARG CB C 74 34.484 34.809 -0.325 1
1 843 . 15 1 1 A 74 74 ARG N N 74 117.344 121.334 -3.990 1
1 845 . 15 1 1 A 75 75 PHE H H 75 9.005 8.333 0.672 1
1 846 . 15 1 1 A 75 75 PHE HA H 75 5.046 4.843 0.203 1
1 854 . 15 1 1 A 75 75 PHE C C 75 176.186 175.694 0.492 1
1 855 . 15 1 1 A 75 75 PHE CA C 75 59.658 59.257 0.401 1
1 856 . 15 1 1 A 75 75 PHE CB C 75 39.356 40.388 -1.032 1
1 862 . 15 1 1 A 75 75 PHE N N 75 117.865 116.729 1.136 1
1 863 . 15 1 1 A 76 76 GLU H H 76 8.213 8.285 -0.072 1
1 864 . 15 1 1 A 76 76 GLU HA H 76 4.586 4.409 0.177 1
1 869 . 15 1 1 A 76 76 GLU C C 76 175.238 176.571 -1.333 1
1 870 . 15 1 1 A 76 76 GLU CA C 76 55.994 55.119 0.875 1
1 871 . 15 1 1 A 76 76 GLU CB C 76 31.805 28.713 3.092 1
1 873 . 15 1 1 A 76 76 GLU N N 76 116.834 117.288 -0.454 1
1 874 . 15 1 1 A 77 77 GLY H H 77 8.692 8.059 0.633 1
1 875 . 15 1 1 A 77 77 GLY HA2 H 77 4.166 3.955 0.211 1
1 876 . 15 1 1 A 77 77 GLY HA3 H 77 4.015 3.958 0.057 1
1 877 . 15 1 1 A 77 77 GLY C C 77 173.784 174.257 -0.473 1
1 878 . 15 1 1 A 77 77 GLY CA C 77 45.505 45.559 -0.054 1
1 879 . 15 1 1 A 77 77 GLY N N 77 111.937 109.146 2.791 1
1 880 . 15 1 1 A 78 78 THR H H 78 8.332 7.839 0.493 1
1 881 . 15 1 1 A 78 78 THR HA H 78 3.900 4.250 -0.350 1
1 886 . 15 1 1 A 78 78 THR C C 78 173.591 174.691 -1.100 1
1 887 . 15 1 1 A 78 78 THR CA C 78 63.653 63.326 0.327 1
1 888 . 15 1 1 A 78 78 THR CB C 78 69.649 69.121 0.528 1
1 890 . 15 1 1 A 78 78 THR N N 78 120.765 115.128 5.637 1
1 891 . 15 1 1 A 79 79 GLY H H 79 8.038 8.481 -0.443 1
1 892 . 15 1 1 A 79 79 GLY HA2 H 79 4.748 4.334 0.414 1
1 893 . 15 1 1 A 79 79 GLY HA3 H 79 3.546 4.458 -0.912 1
1 894 . 15 1 1 A 79 79 GLY C C 79 172.580 172.143 0.437 1
1 895 . 15 1 1 A 79 79 GLY CA C 79 44.661 45.120 -0.459 1
1 896 . 15 1 1 A 79 79 GLY N N 79 109.887 113.093 -3.206 1
1 897 . 15 1 1 A 80 80 PHE H H 80 9.064 8.682 0.382 1
1 898 . 15 1 1 A 80 80 PHE HA H 80 4.886 4.959 -0.073 1
1 906 . 15 1 1 A 80 80 PHE C C 80 176.507 176.342 0.165 1
1 907 . 15 1 1 A 80 80 PHE CA C 80 57.257 56.773 0.484 1
1 908 . 15 1 1 A 80 80 PHE CB C 80 44.655 42.467 2.188 1
1 914 . 15 1 1 A 80 80 PHE N N 80 116.862 119.135 -2.273 1
1 915 . 15 1 1 A 81 81 SER H H 81 9.413 8.861 0.552 1
1 916 . 15 1 1 A 81 81 SER HA H 81 4.622 4.370 0.252 1
1 919 . 15 1 1 A 81 81 SER C C 81 173.735 174.889 -1.154 1
1 920 . 15 1 1 A 81 81 SER CA C 81 61.410 61.129 0.281 1
1 921 . 15 1 1 A 81 81 SER CB C 81 64.165 62.992 1.173 1
1 922 . 15 1 1 A 81 81 SER N N 81 116.467 116.249 0.218 1
1 923 . 15 1 1 A 82 82 ASN H H 82 7.688 8.217 -0.529 1
1 924 . 15 1 1 A 82 82 ASN HA H 82 4.952 5.280 -0.328 1
1 929 . 15 1 1 A 82 82 ASN C C 82 173.303 175.578 -2.275 1
1 930 . 15 1 1 A 82 82 ASN CA C 82 52.086 52.264 -0.178 1
1 931 . 15 1 1 A 82 82 ASN CB C 82 41.258 41.029 0.229 1
1 932 . 15 1 1 A 82 82 ASN N N 82 113.355 117.845 -4.490 1
1 934 . 15 1 1 A 83 83 ILE H H 83 8.858 8.718 0.140 1
1 935 . 15 1 1 A 83 83 ILE HA H 83 3.571 3.607 -0.036 1
1 945 . 15 1 1 A 83 83 ILE CA C 83 66.416 65.630 0.786 1
1 946 . 15 1 1 A 83 83 ILE CB C 83 35.074 35.159 -0.085 1
1 950 . 15 1 1 A 83 83 ILE N N 83 118.908 122.488 -3.580 1
1 951 . 15 1 1 A 84 84 PRO HA H 84 4.411 4.612 -0.201 1
1 958 . 15 1 1 A 84 84 PRO C C 84 177.616 179.241 -1.625 1
1 959 . 15 1 1 A 84 84 PRO CA C 84 67.525 66.388 1.137 1
1 960 . 15 1 1 A 84 84 PRO CB C 84 31.029 30.873 0.156 1
1 963 . 15 1 1 A 85 85 GLN H H 85 8.405 8.364 0.041 1
1 964 . 15 1 1 A 85 85 GLN HA H 85 3.874 4.024 -0.150 1
1 971 . 15 1 1 A 85 85 GLN C C 85 178.213 178.192 0.021 1
1 972 . 15 1 1 A 85 85 GLN CA C 85 59.495 58.517 0.978 1
1 973 . 15 1 1 A 85 85 GLN CB C 85 29.270 28.080 1.190 1
1 975 . 15 1 1 A 85 85 GLN N N 85 115.597 117.253 -1.656 1
1 977 . 15 1 1 A 86 86 LEU H H 86 7.136 8.172 -1.036 1
1 978 . 15 1 1 A 86 86 LEU HA H 86 3.589 3.716 -0.127 1
1 988 . 15 1 1 A 86 86 LEU C C 86 177.728 178.345 -0.617 1
1 989 . 15 1 1 A 86 86 LEU CA C 86 58.136 58.369 -0.233 1
1 990 . 15 1 1 A 86 86 LEU CB C 86 42.290 41.758 0.532 1
1 994 . 15 1 1 A 86 86 LEU N N 86 121.840 122.055 -0.215 1
1 995 . 15 1 1 A 87 87 ILE H H 87 8.323 7.760 0.563 1
1 996 . 15 1 1 A 87 87 ILE HA H 87 3.415 3.367 0.048 1
1 1006 . 15 1 1 A 87 87 ILE C C 87 178.064 177.728 0.336 1
1 1007 . 15 1 1 A 87 87 ILE CA C 87 61.458 65.366 -3.908 1
1 1008 . 15 1 1 A 87 87 ILE CB C 87 34.561 37.160 -2.599 1
1 1012 . 15 1 1 A 87 87 ILE N N 87 118.117 119.453 -1.336 1
1 1013 . 15 1 1 A 88 88 ASP H H 88 8.805 8.467 0.338 1
1 1014 . 15 1 1 A 88 88 ASP HA H 88 4.548 4.310 0.238 1
1 1017 . 15 1 1 A 88 88 ASP C C 88 179.265 178.109 1.156 1
1 1018 . 15 1 1 A 88 88 ASP CA C 88 58.099 57.310 0.789 1
1 1019 . 15 1 1 A 88 88 ASP CB C 88 42.166 41.960 0.206 1
1 1020 . 15 1 1 A 88 88 ASP N N 88 119.143 120.655 -1.512 1
1 1021 . 15 1 1 A 89 89 HIS H H 89 8.113 8.059 0.054 1
1 1022 . 15 1 1 A 89 89 HIS HA H 89 4.225 4.211 0.014 1
1 1026 . 15 1 1 A 89 89 HIS C C 89 179.261 177.030 2.231 1
1 1027 . 15 1 1 A 89 89 HIS CA C 89 60.647 59.053 1.594 1
1 1028 . 15 1 1 A 89 89 HIS CB C 89 30.801 29.437 1.364 1
1 1030 . 15 1 1 A 89 89 HIS N N 89 119.595 119.098 0.497 1
1 1031 . 15 1 1 A 90 90 HIS H H 90 7.685 7.853 -0.168 1
1 1032 . 15 1 1 A 90 90 HIS HA H 90 3.628 4.088 -0.460 1
1 1036 . 15 1 1 A 90 90 HIS C C 90 178.454 177.550 0.904 1
1 1037 . 15 1 1 A 90 90 HIS CA C 90 61.797 60.034 1.763 1
1 1038 . 15 1 1 A 90 90 HIS CB C 90 28.165 29.777 -1.612 1
1 1040 . 15 1 1 A 90 90 HIS N N 90 120.061 117.399 2.662 1
1 1041 . 15 1 1 A 91 91 TYR H H 91 9.394 8.483 0.911 1
1 1042 . 15 1 1 A 91 91 TYR HA H 91 4.238 3.916 0.322 1
1 1049 . 15 1 1 A 91 91 TYR C C 91 176.443 177.368 -0.925 1
1 1050 . 15 1 1 A 91 91 TYR CA C 91 60.669 61.690 -1.021 1
1 1051 . 15 1 1 A 91 91 TYR CB C 91 39.169 39.010 0.159 1
1 1056 . 15 1 1 A 91 91 TYR N N 91 123.532 119.832 3.700 1
1 1057 . 15 1 1 A 92 92 THR H H 92 8.774 8.554 0.220 1
1 1058 . 15 1 1 A 92 92 THR HA H 92 3.866 4.019 -0.153 1
1 1063 . 15 1 1 A 92 92 THR C C 92 177.050 176.401 0.649 1
1 1064 . 15 1 1 A 92 92 THR CA C 92 65.240 65.310 -0.070 1
1 1065 . 15 1 1 A 92 92 THR CB C 92 69.298 68.030 1.268 1
1 1067 . 15 1 1 A 92 92 THR N N 92 112.000 112.737 -0.737 1
1 1068 . 15 1 1 A 93 93 THR H H 93 7.617 7.446 0.171 1
1 1069 . 15 1 1 A 93 93 THR HA H 93 4.133 4.121 0.012 1
1 1074 . 15 1 1 A 93 93 THR C C 93 176.234 174.951 1.283 1
1 1075 . 15 1 1 A 93 93 THR CA C 93 63.527 62.731 0.796 1
1 1076 . 15 1 1 A 93 93 THR CB C 93 71.234 69.775 1.459 1
1 1078 . 15 1 1 A 93 93 THR N N 93 109.883 112.812 -2.929 1
1 1079 . 15 1 1 A 94 94 LYS H H 94 7.210 7.705 -0.495 1
1 1080 . 15 1 1 A 94 94 LYS HA H 94 3.830 3.755 0.075 1
1 1089 . 15 1 1 A 94 94 LYS C C 94 174.331 175.052 -0.721 1
1 1090 . 15 1 1 A 94 94 LYS CA C 94 56.776 57.311 -0.535 1
1 1091 . 15 1 1 A 94 94 LYS CB C 94 28.095 31.024 -2.929 1
1 1095 . 15 1 1 A 94 94 LYS N N 94 112.818 121.223 -8.405 1
1 1096 . 15 1 1 A 95 95 GLN H H 95 7.439 7.627 -0.188 1
1 1097 . 15 1 1 A 95 95 GLN HA H 95 4.216 4.549 -0.333 1
1 1104 . 15 1 1 A 95 95 GLN C C 95 179.087 175.590 3.497 1
1 1105 . 15 1 1 A 95 95 GLN CA C 95 56.378 54.797 1.581 1
1 1106 . 15 1 1 A 95 95 GLN CB C 95 28.542 30.433 -1.891 1
1 1108 . 15 1 1 A 95 95 GLN N N 95 117.860 119.058 -1.198 1
1 1110 . 15 1 1 A 96 96 VAL H H 96 8.520 8.511 0.009 1
1 1111 . 15 1 1 A 96 96 VAL HA H 96 4.297 4.570 -0.273 1
1 1119 . 15 1 1 A 96 96 VAL C C 96 177.329 176.697 0.632 1
1 1120 . 15 1 1 A 96 96 VAL CA C 96 61.196 61.778 -0.582 1
1 1121 . 15 1 1 A 96 96 VAL CB C 96 32.735 33.141 -0.406 1
1 1124 . 15 1 1 A 96 96 VAL N N 96 124.208 118.939 5.269 1
1 1125 . 15 1 1 A 97 97 ILE H H 97 8.491 8.591 -0.100 1
1 1126 . 15 1 1 A 97 97 ILE HA H 97 2.995 3.567 -0.572 1
1 1136 . 15 1 1 A 97 97 ILE CA C 97 62.066 63.322 -1.256 1
1 1137 . 15 1 1 A 97 97 ILE CB C 97 36.117 37.992 -1.875 1
1 1141 . 15 1 1 A 97 97 ILE N N 97 119.561 124.309 -4.748 1
1 1142 . 15 1 1 A 98 98 THR HA H 98 4.460 4.673 -0.213 1
1 1147 . 15 1 1 A 98 98 THR C C 98 174.335 174.821 -0.486 1
1 1148 . 15 1 1 A 98 98 THR CA C 98 58.244 59.187 -0.943 1
1 1149 . 15 1 1 A 98 98 THR CB C 98 73.056 71.792 1.264 1
1 1151 . 15 1 1 A 99 99 LYS H H 99 9.761 8.794 0.967 1
1 1152 . 15 1 1 A 99 99 LYS HA H 99 3.911 4.096 -0.185 1
1 1161 . 15 1 1 A 99 99 LYS C C 99 179.594 178.511 1.083 1
1 1162 . 15 1 1 A 99 99 LYS CA C 99 59.661 58.534 1.127 1
1 1163 . 15 1 1 A 99 99 LYS CB C 99 31.978 32.099 -0.121 1
1 1167 . 15 1 1 A 99 99 LYS N N 99 125.750 122.008 3.742 1
1 1168 . 15 1 1 A 100 100 LYS H H 100 8.910 7.727 1.183 1
1 1169 . 15 1 1 A 100 100 LYS HA H 100 4.024 4.080 -0.056 1
1 1178 . 15 1 1 A 100 100 LYS C C 100 178.060 177.720 0.340 1
1 1179 . 15 1 1 A 100 100 LYS CA C 100 58.642 58.806 -0.164 1
1 1180 . 15 1 1 A 100 100 LYS CB C 100 32.750 32.432 0.318 1
1 1184 . 15 1 1 A 100 100 LYS N N 100 117.112 120.235 -3.123 1
1 1185 . 15 1 1 A 101 101 SER H H 101 7.721 7.649 0.072 1
1 1186 . 15 1 1 A 101 101 SER HA H 101 4.282 4.648 -0.366 1
1 1189 . 15 1 1 A 101 101 SER C C 101 176.403 175.913 0.490 1
1 1190 . 15 1 1 A 101 101 SER CA C 101 60.442 58.674 1.768 1
1 1191 . 15 1 1 A 101 101 SER CB C 101 63.775 65.104 -1.329 1
1 1192 . 15 1 1 A 101 101 SER N N 101 112.069 110.198 1.871 1
1 1193 . 15 1 1 A 102 102 GLY H H 102 8.038 8.238 -0.200 1
1 1194 . 15 1 1 A 102 102 GLY HA2 H 102 4.024 3.900 0.124 1
1 1195 . 15 1 1 A 102 102 GLY HA3 H 102 3.713 3.918 -0.205 1
1 1196 . 15 1 1 A 102 102 GLY C C 102 173.991 174.604 -0.613 1
1 1197 . 15 1 1 A 102 102 GLY CA C 102 46.458 45.163 1.295 1
1 1198 . 15 1 1 A 102 102 GLY N N 102 111.144 110.491 0.653 1
1 1199 . 15 1 1 A 103 103 VAL H H 103 7.155 7.397 -0.242 1
1 1200 . 15 1 1 A 103 103 VAL HA H 103 3.652 3.908 -0.256 1
1 1208 . 15 1 1 A 103 103 VAL C C 103 173.805 175.433 -1.628 1
1 1209 . 15 1 1 A 103 103 VAL CA C 103 64.310 62.799 1.511 1
1 1210 . 15 1 1 A 103 103 VAL CB C 103 32.254 31.682 0.572 1
1 1213 . 15 1 1 A 103 103 VAL N N 103 119.836 122.304 -2.468 1
1 1214 . 15 1 1 A 104 104 VAL H H 104 7.653 8.982 -1.329 1
1 1215 . 15 1 1 A 104 104 VAL HA H 104 4.048 4.492 -0.444 1
1 1223 . 15 1 1 A 104 104 VAL C C 104 175.708 174.458 1.250 1
1 1224 . 15 1 1 A 104 104 VAL CA C 104 60.275 60.801 -0.526 1
1 1225 . 15 1 1 A 104 104 VAL CB C 104 35.112 34.281 0.831 1
1 1228 . 15 1 1 A 104 104 VAL N N 104 125.859 127.895 -2.036 1
1 1229 . 15 1 1 A 105 105 LEU H H 105 8.616 8.456 0.160 1
1 1230 . 15 1 1 A 105 105 LEU HA H 105 3.905 4.729 -0.824 1
1 1240 . 15 1 1 A 105 105 LEU C C 105 175.380 175.932 -0.552 1
1 1241 . 15 1 1 A 105 105 LEU CA C 105 54.471 53.647 0.824 1
1 1242 . 15 1 1 A 105 105 LEU CB C 105 39.821 42.477 -2.656 1
1 1246 . 15 1 1 A 105 105 LEU N N 105 123.839 127.276 -3.437 1
1 1247 . 15 1 1 A 106 106 LEU H H 106 8.894 8.612 0.282 1
1 1248 . 15 1 1 A 106 106 LEU HA H 106 4.839 5.129 -0.290 1
1 1258 . 15 1 1 A 106 106 LEU C C 106 176.930 176.456 0.474 1
1 1259 . 15 1 1 A 106 106 LEU CA C 106 56.288 53.206 3.082 1
1 1260 . 15 1 1 A 106 106 LEU CB C 106 45.237 45.599 -0.362 1
1 1264 . 15 1 1 A 106 106 LEU N N 106 120.590 121.384 -0.794 1
1 1265 . 15 1 1 A 107 107 ASN H H 107 8.124 9.131 -1.007 1
1 1266 . 15 1 1 A 107 107 ASN HA H 107 5.650 4.638 1.012 1
1 1271 . 15 1 1 A 107 107 ASN CA C 107 50.293 53.987 -3.694 1
1 1272 . 15 1 1 A 107 107 ASN CB C 107 41.223 36.198 5.025 1
1 1273 . 15 1 1 A 107 107 ASN N N 107 116.866 118.859 -1.993 1
1 1275 . 15 1 1 A 108 108 PRO HA H 108 2.926 3.806 -0.880 1
1 1282 . 15 1 1 A 108 108 PRO C C 108 176.671 176.583 0.088 1
1 1283 . 15 1 1 A 108 108 PRO CA C 108 60.804 62.535 -1.731 1
1 1284 . 15 1 1 A 108 108 PRO CB C 108 31.774 31.701 0.073 1
1 1287 . 15 1 1 A 109 109 ILE H H 109 8.648 7.669 0.979 1
1 1288 . 15 1 1 A 109 109 ILE HA H 109 4.519 4.345 0.174 1
1 1298 . 15 1 1 A 109 109 ILE CA C 109 55.070 59.602 -4.532 1
1 1299 . 15 1 1 A 109 109 ILE CB C 109 36.068 38.086 -2.018 1
1 1303 . 15 1 1 A 109 109 ILE N N 109 128.817 123.606 5.211 1
1 1304 . 15 1 1 A 110 110 PRO HA H 110 4.587 4.541 0.046 1
1 1311 . 15 1 1 A 110 110 PRO C C 110 177.013 176.287 0.726 1
1 1312 . 15 1 1 A 110 110 PRO CA C 110 61.850 62.323 -0.473 1
1 1313 . 15 1 1 A 110 110 PRO CB C 110 32.507 32.571 -0.064 1
1 1316 . 15 1 1 A 111 111 LYS H H 111 8.038 8.117 -0.079 1
1 1317 . 15 1 1 A 111 111 LYS HA H 111 3.553 4.852 -1.299 1
1 1326 . 15 1 1 A 111 111 LYS C C 111 176.123 174.726 1.397 1
1 1327 . 15 1 1 A 111 111 LYS CA C 111 56.220 54.001 2.219 1
1 1328 . 15 1 1 A 111 111 LYS CB C 111 32.373 35.544 -3.171 1
1 1332 . 15 1 1 A 111 111 LYS N N 111 120.147 116.764 3.383 1
1 1333 . 15 1 1 A 112 112 ASP H H 112 8.463 8.566 -0.103 1
1 1334 . 15 1 1 A 112 112 ASP HA H 112 4.523 4.774 -0.251 1
1 1337 . 15 1 1 A 112 112 ASP C C 112 175.986 175.851 0.135 1
1 1338 . 15 1 1 A 112 112 ASP CA C 112 54.256 53.962 0.294 1
1 1339 . 15 1 1 A 112 112 ASP CB C 112 41.563 41.690 -0.127 1
1 1340 . 15 1 1 A 112 112 ASP N N 112 121.863 122.029 -0.166 1
1 1341 . 15 1 1 A 113 113 LYS H H 113 8.059 8.450 -0.391 1
1 1342 . 15 1 1 A 113 113 LYS HA H 113 4.136 4.273 -0.137 1
1 1351 . 15 1 1 A 113 113 LYS C C 113 176.010 175.066 0.944 1
1 1352 . 15 1 1 A 113 113 LYS CA C 113 56.253 55.677 0.576 1
1 1353 . 15 1 1 A 113 113 LYS CB C 113 32.754 30.563 2.191 1
1 1357 . 15 1 1 A 113 113 LYS N N 113 121.725 122.822 -1.097 1
1 1358 . 15 1 1 A 114 114 LYS H H 114 8.225 8.094 0.131 1
1 1359 . 15 1 1 A 114 114 LYS HA H 114 4.169 4.796 -0.627 1
1 1368 . 15 1 1 A 114 114 LYS C C 114 176.198 175.019 1.179 1
1 1369 . 15 1 1 A 114 114 LYS CA C 114 56.413 54.137 2.276 1
1 1370 . 15 1 1 A 114 114 LYS CB C 114 32.725 35.971 -3.246 1
1 1374 . 15 1 1 A 114 114 LYS N N 114 121.857 123.463 -1.606 1
1 1375 . 15 1 1 A 115 115 TRP H H 115 8.078 8.502 -0.424 1
1 1376 . 15 1 1 A 115 115 TRP HA H 115 4.709 4.738 -0.029 1
1 1385 . 15 1 1 A 115 115 TRP C C 115 175.119 176.092 -0.973 1
1 1386 . 15 1 1 A 115 115 TRP CA C 115 56.856 56.542 0.314 1
1 1387 . 15 1 1 A 115 115 TRP CB C 115 29.474 27.571 1.903 1
1 1393 . 15 1 1 A 115 115 TRP N N 115 122.068 123.313 -1.245 1
1 1 . 16 1 1 A 10 10 HIS HA H 10 4.616 4.512 0.104 1
1 4 . 16 1 1 A 10 10 HIS C C 10 174.981 175.781 -0.800 1
1 5 . 16 1 1 A 10 10 HIS CA C 10 56.555 59.097 -2.542 1
1 6 . 16 1 1 A 10 10 HIS CB C 10 30.231 30.436 -0.205 1
1 7 . 16 1 1 A 11 11 MET H H 11 8.103 8.085 0.018 1
1 8 . 16 1 1 A 11 11 MET HA H 11 4.439 4.852 -0.413 1
1 13 . 16 1 1 A 11 11 MET C C 11 175.888 174.813 1.075 1
1 14 . 16 1 1 A 11 11 MET CA C 11 55.090 53.893 1.197 1
1 15 . 16 1 1 A 11 11 MET CB C 11 33.121 33.465 -0.344 1
1 17 . 16 1 1 A 11 11 MET N N 11 120.743 116.227 4.516 1
1 18 . 16 1 1 A 12 12 LYS H H 12 8.065 8.766 -0.701 1
1 19 . 16 1 1 A 12 12 LYS HA H 12 4.407 4.699 -0.292 1
1 28 . 16 1 1 A 12 12 LYS CA C 12 54.894 53.257 1.637 1
1 29 . 16 1 1 A 12 12 LYS CB C 12 31.863 32.134 -0.271 1
1 33 . 16 1 1 A 12 12 LYS N N 12 123.187 124.708 -1.521 1
1 34 . 16 1 1 A 13 13 PRO HA H 13 4.347 4.480 -0.133 1
1 41 . 16 1 1 A 13 13 PRO C C 13 176.891 177.621 -0.730 1
1 42 . 16 1 1 A 13 13 PRO CA C 13 62.542 62.540 0.002 1
1 43 . 16 1 1 A 13 13 PRO CB C 13 32.663 32.379 0.284 1
1 46 . 16 1 1 A 14 14 LEU H H 14 8.339 8.787 -0.448 1
1 47 . 16 1 1 A 14 14 LEU HA H 14 3.373 3.859 -0.486 1
1 57 . 16 1 1 A 14 14 LEU C C 14 176.683 178.345 -1.662 1
1 58 . 16 1 1 A 14 14 LEU CA C 14 58.555 57.585 0.970 1
1 59 . 16 1 1 A 14 14 LEU CB C 14 41.828 41.098 0.730 1
1 63 . 16 1 1 A 14 14 LEU N N 14 123.191 124.278 -1.087 1
1 64 . 16 1 1 A 15 15 ALA H H 15 8.175 7.911 0.264 1
1 65 . 16 1 1 A 15 15 ALA HA H 15 3.983 4.167 -0.184 1
1 69 . 16 1 1 A 15 15 ALA C C 15 178.697 178.306 0.391 1
1 70 . 16 1 1 A 15 15 ALA CA C 15 54.164 54.676 -0.512 1
1 71 . 16 1 1 A 15 15 ALA CB C 15 18.771 18.032 0.739 1
1 72 . 16 1 1 A 15 15 ALA N N 15 113.594 119.844 -6.250 1
1 73 . 16 1 1 A 16 16 GLU H H 16 7.458 7.541 -0.083 1
1 74 . 16 1 1 A 16 16 GLU HA H 16 4.266 4.252 0.014 1
1 79 . 16 1 1 A 16 16 GLU C C 16 176.510 177.048 -0.538 1
1 80 . 16 1 1 A 16 16 GLU CA C 16 55.196 57.149 -1.953 1
1 81 . 16 1 1 A 16 16 GLU CB C 16 30.907 30.080 0.827 1
1 83 . 16 1 1 A 16 16 GLU N N 16 113.348 115.217 -1.869 1
1 84 . 16 1 1 A 17 17 GLN H H 17 7.501 7.221 0.280 1
1 85 . 16 1 1 A 17 17 GLN HA H 17 3.683 4.079 -0.396 1
1 92 . 16 1 1 A 17 17 GLN C C 17 178.053 175.512 2.541 1
1 93 . 16 1 1 A 17 17 GLN CA C 17 54.606 55.654 -1.048 1
1 94 . 16 1 1 A 17 17 GLN CB C 17 25.758 28.674 -2.916 1
1 96 . 16 1 1 A 17 17 GLN N N 17 119.411 119.120 0.291 1
1 98 . 16 1 1 A 18 18 ASP H H 18 8.949 8.608 0.341 1
1 99 . 16 1 1 A 18 18 ASP HA H 18 4.184 4.169 0.015 1
1 102 . 16 1 1 A 18 18 ASP C C 18 175.263 178.335 -3.072 1
1 103 . 16 1 1 A 18 18 ASP CA C 18 57.275 56.911 0.364 1
1 104 . 16 1 1 A 18 18 ASP CB C 18 40.620 40.347 0.273 1
1 105 . 16 1 1 A 18 18 ASP N N 18 124.676 125.070 -0.394 1
1 106 . 16 1 1 A 19 19 TRP H H 19 6.068 7.353 -1.285 1
1 107 . 16 1 1 A 19 19 TRP HA H 19 5.045 4.736 0.309 1
1 116 . 16 1 1 A 19 19 TRP C C 19 175.902 176.399 -0.497 1
1 117 . 16 1 1 A 19 19 TRP CA C 19 53.542 58.037 -4.495 1
1 118 . 16 1 1 A 19 19 TRP CB C 19 29.179 28.695 0.484 1
1 124 . 16 1 1 A 19 19 TRP N N 19 107.757 118.489 -10.732 1
1 126 . 16 1 1 A 20 20 TYR H H 20 7.430 7.687 -0.257 1
1 127 . 16 1 1 A 20 20 TYR HA H 20 5.601 5.365 0.236 1
1 132 . 16 1 1 A 20 20 TYR C C 20 175.498 174.564 0.934 1
1 133 . 16 1 1 A 20 20 TYR CA C 20 56.967 57.168 -0.201 1
1 134 . 16 1 1 A 20 20 TYR CB C 20 39.083 38.648 0.435 1
1 137 . 16 1 1 A 20 20 TYR N N 20 123.173 122.262 0.911 1
1 138 . 16 1 1 A 21 21 HIS H H 21 8.934 8.801 0.133 1
1 139 . 16 1 1 A 21 21 HIS HA H 21 4.295 4.661 -0.366 1
1 144 . 16 1 1 A 21 21 HIS C C 21 175.177 175.112 0.065 1
1 145 . 16 1 1 A 21 21 HIS CA C 21 56.572 53.882 2.690 1
1 146 . 16 1 1 A 21 21 HIS CB C 21 33.365 27.826 5.539 1
1 149 . 16 1 1 A 21 21 HIS N N 21 125.732 126.285 -0.553 1
1 150 . 16 1 1 A 22 22 GLY H H 22 5.280 8.109 -2.829 1
1 151 . 16 1 1 A 22 22 GLY HA2 H 22 3.905 3.716 0.189 1
1 152 . 16 1 1 A 22 22 GLY HA3 H 22 3.585 3.719 -0.134 1
1 153 . 16 1 1 A 22 22 GLY C C 22 174.411 174.068 0.343 1
1 154 . 16 1 1 A 22 22 GLY CA C 22 46.402 46.884 -0.482 1
1 155 . 16 1 1 A 22 22 GLY N N 22 104.568 110.146 -5.578 1
1 156 . 16 1 1 A 23 23 ALA H H 23 8.768 7.869 0.899 1
1 157 . 16 1 1 A 23 23 ALA HA H 23 5.171 4.137 1.034 1
1 161 . 16 1 1 A 23 23 ALA C C 23 177.180 176.698 0.482 1
1 162 . 16 1 1 A 23 23 ALA CA C 23 51.153 52.862 -1.709 1
1 163 . 16 1 1 A 23 23 ALA CB C 23 16.999 17.443 -0.444 1
1 164 . 16 1 1 A 23 23 ALA N N 23 130.297 115.626 14.671 1
1 165 . 16 1 1 A 24 24 ILE H H 24 7.267 7.655 -0.388 1
1 166 . 16 1 1 A 24 24 ILE HA H 24 4.460 4.421 0.039 1
1 176 . 16 1 1 A 24 24 ILE CA C 24 58.529 59.674 -1.145 1
1 177 . 16 1 1 A 24 24 ILE CB C 24 38.763 37.673 1.090 1
1 181 . 16 1 1 A 24 24 ILE N N 24 118.903 114.932 3.971 1
1 182 . 16 1 1 A 25 25 PRO HA H 25 4.224 4.525 -0.301 1
1 189 . 16 1 1 A 25 25 PRO C C 25 176.918 177.537 -0.619 1
1 190 . 16 1 1 A 25 25 PRO CA C 25 62.907 62.580 0.327 1
1 191 . 16 1 1 A 25 25 PRO CB C 25 32.671 32.610 0.061 1
1 194 . 16 1 1 A 26 26 ARG H H 26 8.781 9.139 -0.358 1
1 195 . 16 1 1 A 26 26 ARG HA H 26 3.472 3.919 -0.447 1
1 202 . 16 1 1 A 26 26 ARG C C 26 178.112 177.965 0.147 1
1 203 . 16 1 1 A 26 26 ARG CA C 26 60.863 59.440 1.423 1
1 204 . 16 1 1 A 26 26 ARG CB C 26 30.314 29.890 0.424 1
1 207 . 16 1 1 A 26 26 ARG N N 26 124.635 121.392 3.243 1
1 208 . 16 1 1 A 27 27 ILE H H 27 8.540 8.176 0.364 1
1 209 . 16 1 1 A 27 27 ILE HA H 27 3.787 3.658 0.129 1
1 219 . 16 1 1 A 27 27 ILE C C 27 177.390 177.597 -0.207 1
1 220 . 16 1 1 A 27 27 ILE CA C 27 64.329 64.984 -0.655 1
1 221 . 16 1 1 A 27 27 ILE CB C 27 37.413 37.942 -0.529 1
1 225 . 16 1 1 A 27 27 ILE N N 27 115.859 120.140 -4.281 1
1 226 . 16 1 1 A 28 28 GLU H H 28 6.953 8.431 -1.478 1
1 227 . 16 1 1 A 28 28 GLU HA H 28 4.067 4.048 0.019 1
1 232 . 16 1 1 A 28 28 GLU C C 28 179.006 179.308 -0.302 1
1 233 . 16 1 1 A 28 28 GLU CA C 28 58.985 59.490 -0.505 1
1 234 . 16 1 1 A 28 28 GLU CB C 28 29.316 29.091 0.225 1
1 236 . 16 1 1 A 28 28 GLU N N 28 120.554 119.489 1.065 1
1 237 . 16 1 1 A 29 29 ALA H H 29 7.999 7.956 0.043 1
1 238 . 16 1 1 A 29 29 ALA HA H 29 3.822 4.051 -0.229 1
1 242 . 16 1 1 A 29 29 ALA C C 29 178.809 179.924 -1.115 1
1 243 . 16 1 1 A 29 29 ALA CA C 29 54.698 54.862 -0.164 1
1 244 . 16 1 1 A 29 29 ALA CB C 29 18.059 18.377 -0.318 1
1 245 . 16 1 1 A 29 29 ALA N N 29 120.122 122.772 -2.650 1
1 246 . 16 1 1 A 30 30 GLN H H 30 8.168 8.089 0.079 1
1 247 . 16 1 1 A 30 30 GLN HA H 30 3.811 4.169 -0.358 1
1 254 . 16 1 1 A 30 30 GLN C C 30 177.578 177.591 -0.013 1
1 255 . 16 1 1 A 30 30 GLN CA C 30 59.731 58.581 1.150 1
1 256 . 16 1 1 A 30 30 GLN CB C 30 28.161 28.827 -0.666 1
1 258 . 16 1 1 A 30 30 GLN N N 30 112.109 115.769 -3.660 1
1 260 . 16 1 1 A 31 31 GLU H H 31 7.248 8.330 -1.082 1
1 261 . 16 1 1 A 31 31 GLU HA H 31 4.063 4.185 -0.122 1
1 266 . 16 1 1 A 31 31 GLU C C 31 177.423 177.992 -0.569 1
1 267 . 16 1 1 A 31 31 GLU CA C 31 57.650 58.553 -0.903 1
1 268 . 16 1 1 A 31 31 GLU CB C 31 29.757 29.281 0.476 1
1 270 . 16 1 1 A 31 31 GLU N N 31 115.340 119.336 -3.996 1
1 271 . 16 1 1 A 32 32 LEU H H 32 7.169 7.699 -0.530 1
1 272 . 16 1 1 A 32 32 LEU HA H 32 4.087 4.554 -0.467 1
1 282 . 16 1 1 A 32 32 LEU C C 32 175.850 176.509 -0.659 1
1 283 . 16 1 1 A 32 32 LEU CA C 32 55.580 55.074 0.506 1
1 284 . 16 1 1 A 32 32 LEU CB C 32 42.910 42.233 0.677 1
1 288 . 16 1 1 A 32 32 LEU N N 32 116.367 114.504 1.863 1
1 289 . 16 1 1 A 33 33 LEU H H 33 7.062 7.800 -0.738 1
1 290 . 16 1 1 A 33 33 LEU HA H 33 4.431 4.385 0.046 1
1 300 . 16 1 1 A 33 33 LEU C C 33 174.837 177.103 -2.266 1
1 301 . 16 1 1 A 33 33 LEU CA C 33 53.521 54.668 -1.147 1
1 302 . 16 1 1 A 33 33 LEU CB C 33 43.301 41.253 2.048 1
1 306 . 16 1 1 A 33 33 LEU N N 33 118.568 122.306 -3.738 1
1 307 . 16 1 1 A 34 34 LYS H H 34 8.749 8.599 0.150 1
1 308 . 16 1 1 A 34 34 LYS HA H 34 4.162 4.345 -0.183 1
1 317 . 16 1 1 A 34 34 LYS C C 34 174.378 175.502 -1.124 1
1 318 . 16 1 1 A 34 34 LYS CA C 34 56.575 56.393 0.182 1
1 319 . 16 1 1 A 34 34 LYS CB C 34 36.918 34.091 2.827 1
1 323 . 16 1 1 A 34 34 LYS N N 34 121.659 119.028 2.631 1
1 324 . 16 1 1 A 35 35 LYS H H 35 8.137 7.414 0.723 1
1 325 . 16 1 1 A 35 35 LYS HA H 35 4.011 4.792 -0.781 1
1 334 . 16 1 1 A 35 35 LYS C C 35 174.343 175.385 -1.042 1
1 335 . 16 1 1 A 35 35 LYS CA C 35 53.960 54.411 -0.451 1
1 336 . 16 1 1 A 35 35 LYS CB C 35 35.587 35.329 0.258 1
1 340 . 16 1 1 A 35 35 LYS N N 35 119.354 115.959 3.395 1
1 341 . 16 1 1 A 36 36 GLN H H 36 8.394 8.718 -0.324 1
1 342 . 16 1 1 A 36 36 GLN HA H 36 4.187 4.932 -0.745 1
1 349 . 16 1 1 A 36 36 GLN C C 36 177.012 176.543 0.469 1
1 350 . 16 1 1 A 36 36 GLN CA C 36 57.750 57.489 0.261 1
1 351 . 16 1 1 A 36 36 GLN CB C 36 28.433 28.725 -0.292 1
1 353 . 16 1 1 A 36 36 GLN N N 36 120.248 123.159 -2.911 1
1 355 . 16 1 1 A 37 37 GLY H H 37 9.597 8.716 0.881 1
1 356 . 16 1 1 A 37 37 GLY HA2 H 37 4.486 4.134 0.352 1
1 357 . 16 1 1 A 37 37 GLY HA3 H 37 3.926 4.142 -0.216 1
1 358 . 16 1 1 A 37 37 GLY C C 37 176.285 174.716 1.569 1
1 359 . 16 1 1 A 37 37 GLY CA C 37 46.146 45.481 0.665 1
1 360 . 16 1 1 A 37 37 GLY N N 37 116.637 113.280 3.357 1
1 361 . 16 1 1 A 38 38 ASP H H 38 8.925 7.913 1.012 1
1 362 . 16 1 1 A 38 38 ASP HA H 38 5.697 4.690 1.007 1
1 365 . 16 1 1 A 38 38 ASP C C 38 176.181 175.696 0.485 1
1 366 . 16 1 1 A 38 38 ASP CA C 38 55.066 55.471 -0.405 1
1 367 . 16 1 1 A 38 38 ASP CB C 38 42.933 41.094 1.839 1
1 368 . 16 1 1 A 38 38 ASP N N 38 127.293 121.826 5.467 1
1 369 . 16 1 1 A 39 39 PHE H H 39 8.647 8.678 -0.031 1
1 370 . 16 1 1 A 39 39 PHE HA H 39 6.025 5.945 0.080 1
1 378 . 16 1 1 A 39 39 PHE C C 39 170.948 172.989 -2.041 1
1 379 . 16 1 1 A 39 39 PHE CA C 39 56.376 55.895 0.481 1
1 380 . 16 1 1 A 39 39 PHE CB C 39 44.583 43.167 1.416 1
1 386 . 16 1 1 A 39 39 PHE N N 39 117.102 120.629 -3.527 1
1 387 . 16 1 1 A 40 40 LEU H H 40 9.186 9.172 0.014 1
1 388 . 16 1 1 A 40 40 LEU HA H 40 4.983 5.347 -0.364 1
1 398 . 16 1 1 A 40 40 LEU C C 40 174.787 174.422 0.365 1
1 399 . 16 1 1 A 40 40 LEU CA C 40 54.610 53.744 0.866 1
1 400 . 16 1 1 A 40 40 LEU CB C 40 44.330 45.867 -1.537 1
1 404 . 16 1 1 A 40 40 LEU N N 40 114.388 118.132 -3.744 1
1 405 . 16 1 1 A 41 41 VAL H H 41 9.390 9.517 -0.127 1
1 406 . 16 1 1 A 41 41 VAL HA H 41 5.742 5.109 0.633 1
1 414 . 16 1 1 A 41 41 VAL C C 41 172.760 175.407 -2.647 1
1 415 . 16 1 1 A 41 41 VAL CA C 41 60.814 61.764 -0.950 1
1 416 . 16 1 1 A 41 41 VAL CB C 41 34.908 33.227 1.681 1
1 419 . 16 1 1 A 41 41 VAL N N 41 119.873 122.724 -2.851 1
1 420 . 16 1 1 A 42 42 ARG H H 42 9.598 9.260 0.338 1
1 421 . 16 1 1 A 42 42 ARG HA H 42 5.247 4.906 0.341 1
1 429 . 16 1 1 A 42 42 ARG C C 42 173.379 174.699 -1.320 1
1 430 . 16 1 1 A 42 42 ARG CA C 42 53.202 54.697 -1.495 1
1 431 . 16 1 1 A 42 42 ARG CB C 42 33.507 33.548 -0.041 1
1 434 . 16 1 1 A 42 42 ARG N N 42 124.179 124.744 -0.565 1
1 436 . 16 1 1 A 43 43 GLU H H 43 8.234 8.535 -0.301 1
1 437 . 16 1 1 A 43 43 GLU HA H 43 4.890 4.280 0.610 1
1 442 . 16 1 1 A 43 43 GLU C C 43 176.929 176.540 0.389 1
1 443 . 16 1 1 A 43 43 GLU CA C 43 54.846 56.329 -1.483 1
1 444 . 16 1 1 A 43 43 GLU CB C 43 31.599 30.853 0.746 1
1 446 . 16 1 1 A 43 43 GLU N N 43 124.103 124.490 -0.387 1
1 447 . 16 1 1 A 44 44 SER H H 44 9.033 8.780 0.253 1
1 448 . 16 1 1 A 44 44 SER HA H 44 3.957 4.352 -0.395 1
1 451 . 16 1 1 A 44 44 SER C C 44 175.005 175.713 -0.708 1
1 452 . 16 1 1 A 44 44 SER CA C 44 59.393 57.570 1.823 1
1 453 . 16 1 1 A 44 44 SER CB C 44 63.619 63.916 -0.297 1
1 454 . 16 1 1 A 44 44 SER N N 44 124.316 121.420 2.896 1
1 455 . 16 1 1 A 45 45 HIS H H 45 8.461 8.641 -0.180 1
1 456 . 16 1 1 A 45 45 HIS HA H 45 4.132 4.180 -0.048 1
1 460 . 16 1 1 A 45 45 HIS C C 45 176.480 178.089 -1.609 1
1 461 . 16 1 1 A 45 45 HIS CA C 45 58.887 58.644 0.243 1
1 462 . 16 1 1 A 45 45 HIS CB C 45 30.180 29.009 1.171 1
1 464 . 16 1 1 A 45 45 HIS N N 45 127.694 126.235 1.459 1
1 465 . 16 1 1 A 46 46 GLY H H 46 8.513 8.207 0.306 1
1 466 . 16 1 1 A 46 46 GLY HA2 H 46 3.827 3.895 -0.068 1
1 467 . 16 1 1 A 46 46 GLY HA3 H 46 3.827 3.907 -0.080 1
1 468 . 16 1 1 A 46 46 GLY C C 46 173.630 174.393 -0.763 1
1 469 . 16 1 1 A 46 46 GLY CA C 46 45.188 46.863 -1.675 1
1 470 . 16 1 1 A 46 46 GLY N N 46 110.761 107.089 3.672 1
1 471 . 16 1 1 A 47 47 LYS H H 47 7.216 7.726 -0.510 1
1 472 . 16 1 1 A 47 47 LYS HA H 47 4.540 4.736 -0.196 1
1 481 . 16 1 1 A 47 47 LYS CA C 47 53.475 52.891 0.584 1
1 482 . 16 1 1 A 47 47 LYS CB C 47 33.325 33.889 -0.564 1
1 486 . 16 1 1 A 47 47 LYS N N 47 121.356 120.099 1.257 1
1 487 . 16 1 1 A 48 48 PRO HA H 48 4.181 4.269 -0.088 1
1 494 . 16 1 1 A 48 48 PRO C C 48 178.920 177.419 1.501 1
1 495 . 16 1 1 A 48 48 PRO CA C 48 63.239 63.742 -0.503 1
1 496 . 16 1 1 A 48 48 PRO CB C 48 31.523 31.314 0.209 1
1 499 . 16 1 1 A 49 49 GLY H H 49 9.752 8.740 1.012 1
1 500 . 16 1 1 A 49 49 GLY HA2 H 49 4.053 3.889 0.164 1
1 501 . 16 1 1 A 49 49 GLY HA3 H 49 3.374 3.930 -0.556 1
1 502 . 16 1 1 A 49 49 GLY C C 49 172.093 174.203 -2.110 1
1 503 . 16 1 1 A 49 49 GLY CA C 49 45.041 45.003 0.038 1
1 504 . 16 1 1 A 49 49 GLY N N 49 112.415 112.607 -0.192 1
1 505 . 16 1 1 A 50 50 GLU H H 50 7.623 8.013 -0.390 1
1 506 . 16 1 1 A 50 50 GLU HA H 50 4.537 4.622 -0.085 1
1 511 . 16 1 1 A 50 50 GLU C C 50 173.297 175.194 -1.897 1
1 512 . 16 1 1 A 50 50 GLU CA C 50 55.174 55.799 -0.625 1
1 513 . 16 1 1 A 50 50 GLU CB C 50 31.651 30.741 0.910 1
1 515 . 16 1 1 A 50 50 GLU N N 50 121.600 121.699 -0.099 1
1 516 . 16 1 1 A 51 51 TYR H H 51 9.452 9.191 0.261 1
1 517 . 16 1 1 A 51 51 TYR HA H 51 5.382 5.174 0.208 1
1 524 . 16 1 1 A 51 51 TYR C C 51 174.387 175.216 -0.829 1
1 525 . 16 1 1 A 51 51 TYR CA C 51 57.592 56.875 0.717 1
1 526 . 16 1 1 A 51 51 TYR CB C 51 41.820 40.846 0.974 1
1 531 . 16 1 1 A 51 51 TYR N N 51 125.790 126.968 -1.178 1
1 532 . 16 1 1 A 52 52 VAL H H 52 9.471 9.465 0.006 1
1 533 . 16 1 1 A 52 52 VAL HA H 52 4.840 5.109 -0.269 1
1 541 . 16 1 1 A 52 52 VAL C C 52 174.947 174.962 -0.015 1
1 542 . 16 1 1 A 52 52 VAL CA C 52 60.991 61.113 -0.122 1
1 543 . 16 1 1 A 52 52 VAL CB C 52 36.829 35.003 1.826 1
1 546 . 16 1 1 A 52 52 VAL N N 52 120.617 122.430 -1.813 1
1 547 . 16 1 1 A 53 53 LEU H H 53 9.457 9.468 -0.011 1
1 548 . 16 1 1 A 53 53 LEU HA H 53 5.294 5.205 0.089 1
1 558 . 16 1 1 A 53 53 LEU C C 53 175.024 175.435 -0.411 1
1 559 . 16 1 1 A 53 53 LEU CA C 53 53.904 54.176 -0.272 1
1 560 . 16 1 1 A 53 53 LEU CB C 53 44.756 43.532 1.224 1
1 564 . 16 1 1 A 53 53 LEU N N 53 127.725 131.205 -3.480 1
1 565 . 16 1 1 A 54 54 SER H H 54 9.461 9.432 0.029 1
1 566 . 16 1 1 A 54 54 SER HA H 54 5.691 5.280 0.411 1
1 569 . 16 1 1 A 54 54 SER C C 54 172.227 173.299 -1.072 1
1 570 . 16 1 1 A 54 54 SER CA C 54 58.551 56.920 1.631 1
1 571 . 16 1 1 A 54 54 SER CB C 54 65.738 64.678 1.060 1
1 572 . 16 1 1 A 54 54 SER N N 54 127.178 123.375 3.803 1
1 573 . 16 1 1 A 55 55 VAL H H 55 9.049 8.724 0.325 1
1 574 . 16 1 1 A 55 55 VAL HA H 55 5.691 5.347 0.344 1
1 582 . 16 1 1 A 55 55 VAL C C 55 173.959 173.010 0.949 1
1 583 . 16 1 1 A 55 55 VAL CA C 55 58.398 59.687 -1.289 1
1 584 . 16 1 1 A 55 55 VAL CB C 55 36.262 35.979 0.283 1
1 587 . 16 1 1 A 55 55 VAL N N 55 120.619 127.005 -6.386 1
1 588 . 16 1 1 A 56 56 TYR H H 56 8.629 9.054 -0.425 1
1 589 . 16 1 1 A 56 56 TYR HA H 56 4.951 5.007 -0.056 1
1 596 . 16 1 1 A 56 56 TYR C C 56 175.224 174.799 0.425 1
1 597 . 16 1 1 A 56 56 TYR CA C 56 56.684 56.894 -0.210 1
1 598 . 16 1 1 A 56 56 TYR CB C 56 39.646 38.932 0.714 1
1 603 . 16 1 1 A 56 56 TYR N N 56 127.444 130.012 -2.568 1
1 604 . 16 1 1 A 57 57 SER H H 57 8.869 8.818 0.051 1
1 605 . 16 1 1 A 57 57 SER HA H 57 4.739 4.795 -0.056 1
1 608 . 16 1 1 A 57 57 SER C C 57 174.492 172.660 1.832 1
1 609 . 16 1 1 A 57 57 SER CA C 57 57.591 57.259 0.332 1
1 610 . 16 1 1 A 57 57 SER CB C 57 64.281 66.400 -2.119 1
1 611 . 16 1 1 A 57 57 SER N N 57 122.165 123.024 -0.859 1
1 612 . 16 1 1 A 58 58 ASP H H 58 10.446 9.374 1.072 1
1 613 . 16 1 1 A 58 58 ASP HA H 58 4.382 4.295 0.087 1
1 616 . 16 1 1 A 58 58 ASP C C 58 176.398 176.331 0.067 1
1 617 . 16 1 1 A 58 58 ASP CA C 58 55.215 55.276 -0.061 1
1 618 . 16 1 1 A 58 58 ASP CB C 58 39.513 39.210 0.303 1
1 619 . 16 1 1 A 58 58 ASP N N 58 132.098 128.146 3.952 1
1 620 . 16 1 1 A 59 59 GLY H H 59 7.861 8.457 -0.596 1
1 621 . 16 1 1 A 59 59 GLY HA2 H 59 3.817 3.725 0.092 1
1 622 . 16 1 1 A 59 59 GLY HA3 H 59 4.086 3.785 0.301 1
1 623 . 16 1 1 A 59 59 GLY C C 59 173.111 173.535 -0.424 1
1 624 . 16 1 1 A 59 59 GLY CA C 59 45.486 45.214 0.272 1
1 625 . 16 1 1 A 59 59 GLY N N 59 102.674 104.793 -2.119 1
1 626 . 16 1 1 A 60 60 GLN H H 60 7.137 7.738 -0.601 1
1 627 . 16 1 1 A 60 60 GLN HA H 60 4.455 4.597 -0.142 1
1 634 . 16 1 1 A 60 60 GLN C C 60 173.549 174.508 -0.959 1
1 635 . 16 1 1 A 60 60 GLN CA C 60 53.388 53.439 -0.051 1
1 636 . 16 1 1 A 60 60 GLN CB C 60 32.373 31.663 0.710 1
1 638 . 16 1 1 A 60 60 GLN N N 60 116.206 118.779 -2.573 1
1 640 . 16 1 1 A 61 61 ARG H H 61 8.589 8.461 0.128 1
1 641 . 16 1 1 A 61 61 ARG HA H 61 4.740 4.445 0.295 1
1 649 . 16 1 1 A 61 61 ARG C C 61 174.458 174.872 -0.414 1
1 650 . 16 1 1 A 61 61 ARG CA C 61 57.116 55.289 1.827 1
1 651 . 16 1 1 A 61 61 ARG CB C 61 29.615 30.582 -0.967 1
1 654 . 16 1 1 A 61 61 ARG N N 61 120.467 121.519 -1.052 1
1 656 . 16 1 1 A 62 62 ARG H H 62 8.867 8.892 -0.025 1
1 657 . 16 1 1 A 62 62 ARG HA H 62 4.297 4.285 0.012 1
1 665 . 16 1 1 A 62 62 ARG C C 62 173.485 175.559 -2.074 1
1 666 . 16 1 1 A 62 62 ARG CA C 62 53.355 55.692 -2.337 1
1 667 . 16 1 1 A 62 62 ARG CB C 62 33.028 30.836 2.192 1
1 670 . 16 1 1 A 62 62 ARG N N 62 122.641 124.482 -1.841 1
1 672 . 16 1 1 A 63 63 HIS H H 63 7.997 8.466 -0.469 1
1 673 . 16 1 1 A 63 63 HIS HA H 63 5.427 5.283 0.144 1
1 678 . 16 1 1 A 63 63 HIS C C 63 174.946 173.995 0.951 1
1 679 . 16 1 1 A 63 63 HIS CA C 63 54.689 53.776 0.913 1
1 680 . 16 1 1 A 63 63 HIS CB C 63 33.008 32.114 0.894 1
1 683 . 16 1 1 A 63 63 HIS N N 63 119.064 119.287 -0.223 1
1 684 . 16 1 1 A 64 64 PHE H H 64 9.880 9.217 0.663 1
1 685 . 16 1 1 A 64 64 PHE HA H 64 4.824 5.039 -0.215 1
1 693 . 16 1 1 A 64 64 PHE C C 64 174.882 175.113 -0.231 1
1 694 . 16 1 1 A 64 64 PHE CA C 64 56.489 56.673 -0.184 1
1 695 . 16 1 1 A 64 64 PHE CB C 64 41.405 40.892 0.513 1
1 701 . 16 1 1 A 64 64 PHE N N 64 123.961 122.159 1.802 1
1 702 . 16 1 1 A 65 65 ILE H H 65 8.982 9.169 -0.187 1
1 703 . 16 1 1 A 65 65 ILE HA H 65 4.273 4.627 -0.354 1
1 713 . 16 1 1 A 65 65 ILE C C 65 176.556 175.672 0.884 1
1 714 . 16 1 1 A 65 65 ILE CA C 65 62.649 60.914 1.735 1
1 715 . 16 1 1 A 65 65 ILE CB C 65 38.296 38.186 0.110 1
1 719 . 16 1 1 A 65 65 ILE N N 65 126.601 124.309 2.292 1
1 720 . 16 1 1 A 66 66 ILE H H 66 8.947 9.199 -0.252 1
1 721 . 16 1 1 A 66 66 ILE HA H 66 3.780 4.938 -1.158 1
1 731 . 16 1 1 A 66 66 ILE C C 66 175.721 175.610 0.111 1
1 732 . 16 1 1 A 66 66 ILE CA C 66 62.960 60.908 2.052 1
1 733 . 16 1 1 A 66 66 ILE CB C 66 37.209 38.774 -1.565 1
1 737 . 16 1 1 A 66 66 ILE N N 66 130.139 128.805 1.334 1
1 738 . 16 1 1 A 67 67 GLN H H 67 8.410 8.845 -0.435 1
1 739 . 16 1 1 A 67 67 GLN HA H 67 4.422 4.982 -0.560 1
1 746 . 16 1 1 A 67 67 GLN C C 67 174.347 173.927 0.420 1
1 747 . 16 1 1 A 67 67 GLN CA C 67 55.867 55.033 0.834 1
1 748 . 16 1 1 A 67 67 GLN CB C 67 29.950 30.922 -0.972 1
1 750 . 16 1 1 A 67 67 GLN N N 67 128.872 127.273 1.599 1
1 752 . 16 1 1 A 68 68 TYR H H 68 8.619 8.975 -0.356 1
1 753 . 16 1 1 A 68 68 TYR HA H 68 5.300 4.972 0.328 1
1 760 . 16 1 1 A 68 68 TYR C C 68 174.695 174.209 0.486 1
1 761 . 16 1 1 A 68 68 TYR CA C 68 55.579 56.301 -0.722 1
1 762 . 16 1 1 A 68 68 TYR CB C 68 39.479 39.415 0.064 1
1 767 . 16 1 1 A 68 68 TYR N N 68 124.772 124.482 0.290 1
1 768 . 16 1 1 A 69 69 VAL H H 69 8.539 8.645 -0.106 1
1 769 . 16 1 1 A 69 69 VAL HA H 69 4.046 4.335 -0.289 1
1 777 . 16 1 1 A 69 69 VAL C C 69 175.010 175.214 -0.204 1
1 778 . 16 1 1 A 69 69 VAL CA C 69 60.611 60.748 -0.137 1
1 779 . 16 1 1 A 69 69 VAL CB C 69 35.358 34.341 1.017 1
1 782 . 16 1 1 A 69 69 VAL N N 69 126.652 127.682 -1.030 1
1 783 . 16 1 1 A 70 70 ASP H H 70 9.089 9.277 -0.188 1
1 784 . 16 1 1 A 70 70 ASP HA H 70 4.025 4.192 -0.167 1
1 787 . 16 1 1 A 70 70 ASP C C 70 174.813 174.977 -0.164 1
1 788 . 16 1 1 A 70 70 ASP CA C 70 55.623 55.492 0.131 1
1 789 . 16 1 1 A 70 70 ASP CB C 70 39.081 39.104 -0.023 1
1 790 . 16 1 1 A 70 70 ASP N N 70 128.327 128.524 -0.197 1
1 791 . 16 1 1 A 71 71 ASN H H 71 8.128 8.043 0.085 1
1 792 . 16 1 1 A 71 71 ASN HA H 71 3.597 3.858 -0.261 1
1 797 . 16 1 1 A 71 71 ASN C C 71 173.250 173.660 -0.410 1
1 798 . 16 1 1 A 71 71 ASN CA C 71 54.728 54.386 0.342 1
1 799 . 16 1 1 A 71 71 ASN CB C 71 37.601 37.225 0.376 1
1 800 . 16 1 1 A 71 71 ASN N N 71 107.230 107.950 -0.720 1
1 802 . 16 1 1 A 72 72 MET H H 72 7.256 7.390 -0.134 1
1 803 . 16 1 1 A 72 72 MET HA H 72 4.740 4.966 -0.226 1
1 808 . 16 1 1 A 72 72 MET C C 72 173.780 173.906 -0.126 1
1 809 . 16 1 1 A 72 72 MET CA C 72 53.703 54.090 -0.387 1
1 810 . 16 1 1 A 72 72 MET CB C 72 36.570 37.259 -0.689 1
1 812 . 16 1 1 A 72 72 MET N N 72 117.117 117.152 -0.035 1
1 813 . 16 1 1 A 73 73 TYR H H 73 9.430 9.043 0.387 1
1 814 . 16 1 1 A 73 73 TYR HA H 73 5.718 5.349 0.369 1
1 821 . 16 1 1 A 73 73 TYR C C 73 176.140 175.695 0.445 1
1 822 . 16 1 1 A 73 73 TYR CA C 73 57.290 56.963 0.327 1
1 823 . 16 1 1 A 73 73 TYR CB C 73 40.013 40.409 -0.396 1
1 828 . 16 1 1 A 73 73 TYR N N 73 119.856 119.829 0.027 1
1 829 . 16 1 1 A 74 74 ARG H H 74 9.038 9.041 -0.003 1
1 830 . 16 1 1 A 74 74 ARG HA H 74 4.867 4.997 -0.130 1
1 838 . 16 1 1 A 74 74 ARG C C 74 173.954 175.095 -1.141 1
1 839 . 16 1 1 A 74 74 ARG CA C 74 54.887 54.169 0.718 1
1 840 . 16 1 1 A 74 74 ARG CB C 74 34.484 33.951 0.533 1
1 843 . 16 1 1 A 74 74 ARG N N 74 117.344 120.851 -3.507 1
1 845 . 16 1 1 A 75 75 PHE H H 75 9.005 8.806 0.199 1
1 846 . 16 1 1 A 75 75 PHE HA H 75 5.046 4.681 0.365 1
1 854 . 16 1 1 A 75 75 PHE C C 75 176.186 176.860 -0.674 1
1 855 . 16 1 1 A 75 75 PHE CA C 75 59.658 59.776 -0.118 1
1 856 . 16 1 1 A 75 75 PHE CB C 75 39.356 40.113 -0.757 1
1 862 . 16 1 1 A 75 75 PHE N N 75 117.865 120.079 -2.214 1
1 863 . 16 1 1 A 76 76 GLU H H 76 8.213 8.460 -0.247 1
1 864 . 16 1 1 A 76 76 GLU HA H 76 4.586 4.692 -0.106 1
1 869 . 16 1 1 A 76 76 GLU C C 76 175.238 176.735 -1.497 1
1 870 . 16 1 1 A 76 76 GLU CA C 76 55.994 57.564 -1.570 1
1 871 . 16 1 1 A 76 76 GLU CB C 76 31.805 32.233 -0.428 1
1 873 . 16 1 1 A 76 76 GLU N N 76 116.834 118.939 -2.105 1
1 874 . 16 1 1 A 77 77 GLY H H 77 8.692 7.953 0.739 1
1 875 . 16 1 1 A 77 77 GLY HA2 H 77 4.166 4.105 0.061 1
1 876 . 16 1 1 A 77 77 GLY HA3 H 77 4.015 4.115 -0.100 1
1 877 . 16 1 1 A 77 77 GLY C C 77 173.784 173.661 0.123 1
1 878 . 16 1 1 A 77 77 GLY CA C 77 45.505 45.091 0.414 1
1 879 . 16 1 1 A 77 77 GLY N N 77 111.937 107.472 4.465 1
1 880 . 16 1 1 A 78 78 THR H H 78 8.332 8.420 -0.088 1
1 881 . 16 1 1 A 78 78 THR HA H 78 3.900 4.183 -0.283 1
1 886 . 16 1 1 A 78 78 THR C C 78 173.591 174.762 -1.171 1
1 887 . 16 1 1 A 78 78 THR CA C 78 63.653 63.125 0.528 1
1 888 . 16 1 1 A 78 78 THR CB C 78 69.649 69.163 0.486 1
1 890 . 16 1 1 A 78 78 THR N N 78 120.765 116.925 3.840 1
1 891 . 16 1 1 A 79 79 GLY H H 79 8.038 8.546 -0.508 1
1 892 . 16 1 1 A 79 79 GLY HA2 H 79 4.748 4.156 0.592 1
1 893 . 16 1 1 A 79 79 GLY HA3 H 79 3.546 4.255 -0.709 1
1 894 . 16 1 1 A 79 79 GLY C C 79 172.580 172.244 0.336 1
1 895 . 16 1 1 A 79 79 GLY CA C 79 44.661 44.247 0.414 1
1 896 . 16 1 1 A 79 79 GLY N N 79 109.887 114.392 -4.505 1
1 897 . 16 1 1 A 80 80 PHE H H 80 9.064 8.712 0.352 1
1 898 . 16 1 1 A 80 80 PHE HA H 80 4.886 5.002 -0.116 1
1 906 . 16 1 1 A 80 80 PHE C C 80 176.507 176.339 0.168 1
1 907 . 16 1 1 A 80 80 PHE CA C 80 57.257 56.630 0.627 1
1 908 . 16 1 1 A 80 80 PHE CB C 80 44.655 42.328 2.327 1
1 914 . 16 1 1 A 80 80 PHE N N 80 116.862 120.242 -3.380 1
1 915 . 16 1 1 A 81 81 SER H H 81 9.413 8.698 0.715 1
1 916 . 16 1 1 A 81 81 SER HA H 81 4.622 4.391 0.231 1
1 919 . 16 1 1 A 81 81 SER C C 81 173.735 174.765 -1.030 1
1 920 . 16 1 1 A 81 81 SER CA C 81 61.410 61.441 -0.031 1
1 921 . 16 1 1 A 81 81 SER CB C 81 64.165 63.344 0.821 1
1 922 . 16 1 1 A 81 81 SER N N 81 116.467 116.453 0.014 1
1 923 . 16 1 1 A 82 82 ASN H H 82 7.688 8.124 -0.436 1
1 924 . 16 1 1 A 82 82 ASN HA H 82 4.952 5.299 -0.347 1
1 929 . 16 1 1 A 82 82 ASN C C 82 173.303 175.598 -2.295 1
1 930 . 16 1 1 A 82 82 ASN CA C 82 52.086 52.127 -0.041 1
1 931 . 16 1 1 A 82 82 ASN CB C 82 41.258 41.676 -0.418 1
1 932 . 16 1 1 A 82 82 ASN N N 82 113.355 116.014 -2.659 1
1 934 . 16 1 1 A 83 83 ILE H H 83 8.858 8.941 -0.083 1
1 935 . 16 1 1 A 83 83 ILE HA H 83 3.571 3.719 -0.148 1
1 945 . 16 1 1 A 83 83 ILE CA C 83 66.416 65.626 0.790 1
1 946 . 16 1 1 A 83 83 ILE CB C 83 35.074 35.188 -0.114 1
1 950 . 16 1 1 A 83 83 ILE N N 83 118.908 123.095 -4.187 1
1 951 . 16 1 1 A 84 84 PRO HA H 84 4.411 4.624 -0.213 1
1 958 . 16 1 1 A 84 84 PRO C C 84 177.616 179.155 -1.539 1
1 959 . 16 1 1 A 84 84 PRO CA C 84 67.525 66.382 1.143 1
1 960 . 16 1 1 A 84 84 PRO CB C 84 31.029 30.797 0.232 1
1 963 . 16 1 1 A 85 85 GLN H H 85 8.405 8.358 0.047 1
1 964 . 16 1 1 A 85 85 GLN HA H 85 3.874 4.080 -0.206 1
1 971 . 16 1 1 A 85 85 GLN C C 85 178.213 178.393 -0.180 1
1 972 . 16 1 1 A 85 85 GLN CA C 85 59.495 58.434 1.061 1
1 973 . 16 1 1 A 85 85 GLN CB C 85 29.270 28.348 0.922 1
1 975 . 16 1 1 A 85 85 GLN N N 85 115.597 117.363 -1.766 1
1 977 . 16 1 1 A 86 86 LEU H H 86 7.136 7.887 -0.751 1
1 978 . 16 1 1 A 86 86 LEU HA H 86 3.589 3.405 0.184 1
1 988 . 16 1 1 A 86 86 LEU C C 86 177.728 178.332 -0.604 1
1 989 . 16 1 1 A 86 86 LEU CA C 86 58.136 58.147 -0.011 1
1 990 . 16 1 1 A 86 86 LEU CB C 86 42.290 41.785 0.505 1
1 994 . 16 1 1 A 86 86 LEU N N 86 121.840 121.650 0.190 1
1 995 . 16 1 1 A 87 87 ILE H H 87 8.323 7.799 0.524 1
1 996 . 16 1 1 A 87 87 ILE HA H 87 3.415 3.302 0.113 1
1 1006 . 16 1 1 A 87 87 ILE C C 87 178.064 177.619 0.445 1
1 1007 . 16 1 1 A 87 87 ILE CA C 87 61.458 65.308 -3.850 1
1 1008 . 16 1 1 A 87 87 ILE CB C 87 34.561 37.208 -2.647 1
1 1012 . 16 1 1 A 87 87 ILE N N 87 118.117 119.491 -1.374 1
1 1013 . 16 1 1 A 88 88 ASP H H 88 8.805 8.237 0.568 1
1 1014 . 16 1 1 A 88 88 ASP HA H 88 4.548 4.274 0.274 1
1 1017 . 16 1 1 A 88 88 ASP C C 88 179.265 178.018 1.247 1
1 1018 . 16 1 1 A 88 88 ASP CA C 88 58.099 57.262 0.837 1
1 1019 . 16 1 1 A 88 88 ASP CB C 88 42.166 41.849 0.317 1
1 1020 . 16 1 1 A 88 88 ASP N N 88 119.143 120.508 -1.365 1
1 1021 . 16 1 1 A 89 89 HIS H H 89 8.113 8.041 0.072 1
1 1022 . 16 1 1 A 89 89 HIS HA H 89 4.225 4.252 -0.027 1
1 1026 . 16 1 1 A 89 89 HIS C C 89 179.261 177.055 2.206 1
1 1027 . 16 1 1 A 89 89 HIS CA C 89 60.647 59.145 1.502 1
1 1028 . 16 1 1 A 89 89 HIS CB C 89 30.801 29.922 0.879 1
1 1030 . 16 1 1 A 89 89 HIS N N 89 119.595 119.249 0.346 1
1 1031 . 16 1 1 A 90 90 HIS H H 90 7.685 7.932 -0.247 1
1 1032 . 16 1 1 A 90 90 HIS HA H 90 3.628 4.168 -0.540 1
1 1036 . 16 1 1 A 90 90 HIS C C 90 178.454 177.489 0.965 1
1 1037 . 16 1 1 A 90 90 HIS CA C 90 61.797 59.809 1.988 1
1 1038 . 16 1 1 A 90 90 HIS CB C 90 28.165 30.003 -1.838 1
1 1040 . 16 1 1 A 90 90 HIS N N 90 120.061 117.120 2.941 1
1 1041 . 16 1 1 A 91 91 TYR H H 91 9.394 8.250 1.144 1
1 1042 . 16 1 1 A 91 91 TYR HA H 91 4.238 3.937 0.301 1
1 1049 . 16 1 1 A 91 91 TYR C C 91 176.443 177.519 -1.076 1
1 1050 . 16 1 1 A 91 91 TYR CA C 91 60.669 61.688 -1.019 1
1 1051 . 16 1 1 A 91 91 TYR CB C 91 39.169 38.850 0.319 1
1 1056 . 16 1 1 A 91 91 TYR N N 91 123.532 120.060 3.472 1
1 1057 . 16 1 1 A 92 92 THR H H 92 8.774 8.615 0.159 1
1 1058 . 16 1 1 A 92 92 THR HA H 92 3.866 4.057 -0.191 1
1 1063 . 16 1 1 A 92 92 THR C C 92 177.050 176.282 0.768 1
1 1064 . 16 1 1 A 92 92 THR CA C 92 65.240 65.314 -0.074 1
1 1065 . 16 1 1 A 92 92 THR CB C 92 69.298 68.088 1.210 1
1 1067 . 16 1 1 A 92 92 THR N N 92 112.000 112.719 -0.719 1
1 1068 . 16 1 1 A 93 93 THR H H 93 7.617 7.489 0.128 1
1 1069 . 16 1 1 A 93 93 THR HA H 93 4.133 4.107 0.026 1
1 1074 . 16 1 1 A 93 93 THR C C 93 176.234 174.966 1.268 1
1 1075 . 16 1 1 A 93 93 THR CA C 93 63.527 62.617 0.910 1
1 1076 . 16 1 1 A 93 93 THR CB C 93 71.234 69.798 1.436 1
1 1078 . 16 1 1 A 93 93 THR N N 93 109.883 112.636 -2.753 1
1 1079 . 16 1 1 A 94 94 LYS H H 94 7.210 7.682 -0.472 1
1 1080 . 16 1 1 A 94 94 LYS HA H 94 3.830 3.728 0.102 1
1 1089 . 16 1 1 A 94 94 LYS C C 94 174.331 175.011 -0.680 1
1 1090 . 16 1 1 A 94 94 LYS CA C 94 56.776 57.306 -0.530 1
1 1091 . 16 1 1 A 94 94 LYS CB C 94 28.095 30.967 -2.872 1
1 1095 . 16 1 1 A 94 94 LYS N N 94 112.818 121.298 -8.480 1
1 1096 . 16 1 1 A 95 95 GLN H H 95 7.439 7.503 -0.064 1
1 1097 . 16 1 1 A 95 95 GLN HA H 95 4.216 4.529 -0.313 1
1 1104 . 16 1 1 A 95 95 GLN C C 95 179.087 175.959 3.128 1
1 1105 . 16 1 1 A 95 95 GLN CA C 95 56.378 54.591 1.787 1
1 1106 . 16 1 1 A 95 95 GLN CB C 95 28.542 29.845 -1.303 1
1 1108 . 16 1 1 A 95 95 GLN N N 95 117.860 119.039 -1.179 1
1 1110 . 16 1 1 A 96 96 VAL H H 96 8.520 8.412 0.108 1
1 1111 . 16 1 1 A 96 96 VAL HA H 96 4.297 4.602 -0.305 1
1 1119 . 16 1 1 A 96 96 VAL C C 96 177.329 176.173 1.156 1
1 1120 . 16 1 1 A 96 96 VAL CA C 96 61.196 61.529 -0.333 1
1 1121 . 16 1 1 A 96 96 VAL CB C 96 32.735 33.628 -0.893 1
1 1124 . 16 1 1 A 96 96 VAL N N 96 124.208 119.244 4.964 1
1 1125 . 16 1 1 A 97 97 ILE H H 97 8.491 8.495 -0.004 1
1 1126 . 16 1 1 A 97 97 ILE HA H 97 2.995 3.751 -0.756 1
1 1136 . 16 1 1 A 97 97 ILE CA C 97 62.066 62.576 -0.510 1
1 1137 . 16 1 1 A 97 97 ILE CB C 97 36.117 37.602 -1.485 1
1 1141 . 16 1 1 A 97 97 ILE N N 97 119.561 123.092 -3.531 1
1 1142 . 16 1 1 A 98 98 THR HA H 98 4.460 4.615 -0.155 1
1 1147 . 16 1 1 A 98 98 THR C C 98 174.335 174.795 -0.460 1
1 1148 . 16 1 1 A 98 98 THR CA C 98 58.244 59.273 -1.029 1
1 1149 . 16 1 1 A 98 98 THR CB C 98 73.056 71.717 1.339 1
1 1151 . 16 1 1 A 99 99 LYS H H 99 9.761 9.076 0.685 1
1 1152 . 16 1 1 A 99 99 LYS HA H 99 3.911 3.999 -0.088 1
1 1161 . 16 1 1 A 99 99 LYS C C 99 179.594 178.570 1.024 1
1 1162 . 16 1 1 A 99 99 LYS CA C 99 59.661 59.316 0.345 1
1 1163 . 16 1 1 A 99 99 LYS CB C 99 31.978 31.978 0.000 1
1 1167 . 16 1 1 A 99 99 LYS N N 99 125.750 122.921 2.829 1
1 1168 . 16 1 1 A 100 100 LYS H H 100 8.910 7.754 1.156 1
1 1169 . 16 1 1 A 100 100 LYS HA H 100 4.024 4.109 -0.085 1
1 1178 . 16 1 1 A 100 100 LYS C C 100 178.060 177.282 0.778 1
1 1179 . 16 1 1 A 100 100 LYS CA C 100 58.642 58.931 -0.289 1
1 1180 . 16 1 1 A 100 100 LYS CB C 100 32.750 32.494 0.256 1
1 1184 . 16 1 1 A 100 100 LYS N N 100 117.112 120.168 -3.056 1
1 1185 . 16 1 1 A 101 101 SER H H 101 7.721 7.591 0.130 1
1 1186 . 16 1 1 A 101 101 SER HA H 101 4.282 4.596 -0.314 1
1 1189 . 16 1 1 A 101 101 SER C C 101 176.403 175.035 1.368 1
1 1190 . 16 1 1 A 101 101 SER CA C 101 60.442 58.677 1.765 1
1 1191 . 16 1 1 A 101 101 SER CB C 101 63.775 64.812 -1.037 1
1 1192 . 16 1 1 A 101 101 SER N N 101 112.069 111.294 0.775 1
1 1193 . 16 1 1 A 102 102 GLY H H 102 8.038 8.517 -0.479 1
1 1194 . 16 1 1 A 102 102 GLY HA2 H 102 4.024 3.939 0.085 1
1 1195 . 16 1 1 A 102 102 GLY HA3 H 102 3.713 3.959 -0.246 1
1 1196 . 16 1 1 A 102 102 GLY C C 102 173.991 174.786 -0.795 1
1 1197 . 16 1 1 A 102 102 GLY CA C 102 46.458 46.396 0.062 1
1 1198 . 16 1 1 A 102 102 GLY N N 102 111.144 109.891 1.253 1
1 1199 . 16 1 1 A 103 103 VAL H H 103 7.155 8.179 -1.024 1
1 1200 . 16 1 1 A 103 103 VAL HA H 103 3.652 4.012 -0.360 1
1 1208 . 16 1 1 A 103 103 VAL C C 103 173.805 175.171 -1.366 1
1 1209 . 16 1 1 A 103 103 VAL CA C 103 64.310 62.692 1.618 1
1 1210 . 16 1 1 A 103 103 VAL CB C 103 32.254 31.988 0.266 1
1 1213 . 16 1 1 A 103 103 VAL N N 103 119.836 121.809 -1.973 1
1 1214 . 16 1 1 A 104 104 VAL H H 104 7.653 9.083 -1.430 1
1 1215 . 16 1 1 A 104 104 VAL HA H 104 4.048 4.530 -0.482 1
1 1223 . 16 1 1 A 104 104 VAL C C 104 175.708 174.275 1.433 1
1 1224 . 16 1 1 A 104 104 VAL CA C 104 60.275 60.606 -0.331 1
1 1225 . 16 1 1 A 104 104 VAL CB C 104 35.112 34.011 1.101 1
1 1228 . 16 1 1 A 104 104 VAL N N 104 125.859 127.862 -2.003 1
1 1229 . 16 1 1 A 105 105 LEU H H 105 8.616 8.291 0.325 1
1 1230 . 16 1 1 A 105 105 LEU HA H 105 3.905 4.582 -0.677 1
1 1240 . 16 1 1 A 105 105 LEU C C 105 175.380 175.818 -0.438 1
1 1241 . 16 1 1 A 105 105 LEU CA C 105 54.471 53.647 0.824 1
1 1242 . 16 1 1 A 105 105 LEU CB C 105 39.821 41.211 -1.390 1
1 1246 . 16 1 1 A 105 105 LEU N N 105 123.839 126.130 -2.291 1
1 1247 . 16 1 1 A 106 106 LEU H H 106 8.894 8.544 0.350 1
1 1248 . 16 1 1 A 106 106 LEU HA H 106 4.839 5.074 -0.235 1
1 1258 . 16 1 1 A 106 106 LEU C C 106 176.930 176.323 0.607 1
1 1259 . 16 1 1 A 106 106 LEU CA C 106 56.288 53.189 3.099 1
1 1260 . 16 1 1 A 106 106 LEU CB C 106 45.237 45.611 -0.374 1
1 1264 . 16 1 1 A 106 106 LEU N N 106 120.590 121.806 -1.216 1
1 1265 . 16 1 1 A 107 107 ASN H H 107 8.124 9.069 -0.945 1
1 1266 . 16 1 1 A 107 107 ASN HA H 107 5.650 4.633 1.017 1
1 1271 . 16 1 1 A 107 107 ASN CA C 107 50.293 53.968 -3.675 1
1 1272 . 16 1 1 A 107 107 ASN CB C 107 41.223 36.199 5.024 1
1 1273 . 16 1 1 A 107 107 ASN N N 107 116.866 118.774 -1.908 1
1 1275 . 16 1 1 A 108 108 PRO HA H 108 2.926 3.894 -0.968 1
1 1282 . 16 1 1 A 108 108 PRO C C 108 176.671 175.587 1.084 1
1 1283 . 16 1 1 A 108 108 PRO CA C 108 60.804 62.487 -1.683 1
1 1284 . 16 1 1 A 108 108 PRO CB C 108 31.774 32.163 -0.389 1
1 1287 . 16 1 1 A 109 109 ILE H H 109 8.648 7.788 0.860 1
1 1288 . 16 1 1 A 109 109 ILE HA H 109 4.519 4.579 -0.060 1
1 1298 . 16 1 1 A 109 109 ILE CA C 109 55.070 57.929 -2.859 1
1 1299 . 16 1 1 A 109 109 ILE CB C 109 36.068 38.842 -2.774 1
1 1303 . 16 1 1 A 109 109 ILE N N 109 128.817 122.952 5.865 1
1 1304 . 16 1 1 A 110 110 PRO HA H 110 4.587 4.459 0.128 1
1 1311 . 16 1 1 A 110 110 PRO C C 110 177.013 176.916 0.097 1
1 1312 . 16 1 1 A 110 110 PRO CA C 110 61.850 62.776 -0.926 1
1 1313 . 16 1 1 A 110 110 PRO CB C 110 32.507 31.744 0.763 1
1 1316 . 16 1 1 A 111 111 LYS H H 111 8.038 8.107 -0.069 1
1 1317 . 16 1 1 A 111 111 LYS HA H 111 3.553 2.803 0.750 1
1 1326 . 16 1 1 A 111 111 LYS C C 111 176.123 175.575 0.548 1
1 1327 . 16 1 1 A 111 111 LYS CA C 111 56.220 55.810 0.410 1
1 1328 . 16 1 1 A 111 111 LYS CB C 111 32.373 32.151 0.222 1
1 1332 . 16 1 1 A 111 111 LYS N N 111 120.147 118.965 1.182 1
1 1333 . 16 1 1 A 112 112 ASP H H 112 8.463 8.366 0.097 1
1 1334 . 16 1 1 A 112 112 ASP HA H 112 4.523 4.568 -0.045 1
1 1337 . 16 1 1 A 112 112 ASP C C 112 175.986 176.398 -0.412 1
1 1338 . 16 1 1 A 112 112 ASP CA C 112 54.256 54.480 -0.224 1
1 1339 . 16 1 1 A 112 112 ASP CB C 112 41.563 41.844 -0.281 1
1 1340 . 16 1 1 A 112 112 ASP N N 112 121.863 122.803 -0.940 1
1 1341 . 16 1 1 A 113 113 LYS H H 113 8.059 8.749 -0.690 1
1 1342 . 16 1 1 A 113 113 LYS HA H 113 4.136 4.447 -0.311 1
1 1351 . 16 1 1 A 113 113 LYS C C 113 176.010 175.671 0.339 1
1 1352 . 16 1 1 A 113 113 LYS CA C 113 56.253 57.043 -0.790 1
1 1353 . 16 1 1 A 113 113 LYS CB C 113 32.754 32.510 0.244 1
1 1357 . 16 1 1 A 113 113 LYS N N 113 121.725 121.103 0.622 1
1 1358 . 16 1 1 A 114 114 LYS H H 114 8.225 7.685 0.540 1
1 1359 . 16 1 1 A 114 114 LYS HA H 114 4.169 4.540 -0.371 1
1 1368 . 16 1 1 A 114 114 LYS C C 114 176.198 176.805 -0.607 1
1 1369 . 16 1 1 A 114 114 LYS CA C 114 56.413 55.213 1.200 1
1 1370 . 16 1 1 A 114 114 LYS CB C 114 32.725 32.230 0.495 1
1 1374 . 16 1 1 A 114 114 LYS N N 114 121.857 119.972 1.885 1
1 1375 . 16 1 1 A 115 115 TRP H H 115 8.078 8.159 -0.081 1
1 1376 . 16 1 1 A 115 115 TRP HA H 115 4.709 4.936 -0.227 1
1 1385 . 16 1 1 A 115 115 TRP C C 115 175.119 176.417 -1.298 1
1 1386 . 16 1 1 A 115 115 TRP CA C 115 56.856 56.979 -0.123 1
1 1387 . 16 1 1 A 115 115 TRP CB C 115 29.474 30.342 -0.868 1
1 1393 . 16 1 1 A 115 115 TRP N N 115 122.068 121.971 0.097 1
1 1 . 17 1 1 A 10 10 HIS HA H 10 4.616 4.676 -0.060 1
1 4 . 17 1 1 A 10 10 HIS C C 10 174.981 174.403 0.578 1
1 5 . 17 1 1 A 10 10 HIS CA C 10 56.555 57.278 -0.723 1
1 6 . 17 1 1 A 10 10 HIS CB C 10 30.231 30.512 -0.281 1
1 7 . 17 1 1 A 11 11 MET H H 11 8.103 8.531 -0.428 1
1 8 . 17 1 1 A 11 11 MET HA H 11 4.439 4.585 -0.146 1
1 13 . 17 1 1 A 11 11 MET C C 11 175.888 175.725 0.163 1
1 14 . 17 1 1 A 11 11 MET CA C 11 55.090 54.598 0.492 1
1 15 . 17 1 1 A 11 11 MET CB C 11 33.121 33.685 -0.564 1
1 17 . 17 1 1 A 11 11 MET N N 11 120.743 127.782 -7.039 1
1 18 . 17 1 1 A 12 12 LYS H H 12 8.065 8.474 -0.409 1
1 19 . 17 1 1 A 12 12 LYS HA H 12 4.407 4.702 -0.295 1
1 28 . 17 1 1 A 12 12 LYS CA C 12 54.894 53.692 1.202 1
1 29 . 17 1 1 A 12 12 LYS CB C 12 31.863 32.028 -0.165 1
1 33 . 17 1 1 A 12 12 LYS N N 12 123.187 125.156 -1.969 1
1 34 . 17 1 1 A 13 13 PRO HA H 13 4.347 4.482 -0.135 1
1 41 . 17 1 1 A 13 13 PRO C C 13 176.891 177.455 -0.564 1
1 42 . 17 1 1 A 13 13 PRO CA C 13 62.542 62.405 0.137 1
1 43 . 17 1 1 A 13 13 PRO CB C 13 32.663 32.798 -0.135 1
1 46 . 17 1 1 A 14 14 LEU H H 14 8.339 8.784 -0.445 1
1 47 . 17 1 1 A 14 14 LEU HA H 14 3.373 3.861 -0.488 1
1 57 . 17 1 1 A 14 14 LEU C C 14 176.683 178.162 -1.479 1
1 58 . 17 1 1 A 14 14 LEU CA C 14 58.555 57.607 0.948 1
1 59 . 17 1 1 A 14 14 LEU CB C 14 41.828 41.044 0.784 1
1 63 . 17 1 1 A 14 14 LEU N N 14 123.191 123.897 -0.706 1
1 64 . 17 1 1 A 15 15 ALA H H 15 8.175 7.864 0.311 1
1 65 . 17 1 1 A 15 15 ALA HA H 15 3.983 4.270 -0.287 1
1 69 . 17 1 1 A 15 15 ALA C C 15 178.697 178.350 0.347 1
1 70 . 17 1 1 A 15 15 ALA CA C 15 54.164 54.454 -0.290 1
1 71 . 17 1 1 A 15 15 ALA CB C 15 18.771 18.174 0.597 1
1 72 . 17 1 1 A 15 15 ALA N N 15 113.594 119.968 -6.374 1
1 73 . 17 1 1 A 16 16 GLU H H 16 7.458 7.857 -0.399 1
1 74 . 17 1 1 A 16 16 GLU HA H 16 4.266 4.457 -0.191 1
1 79 . 17 1 1 A 16 16 GLU C C 16 176.510 176.407 0.103 1
1 80 . 17 1 1 A 16 16 GLU CA C 16 55.196 56.205 -1.009 1
1 81 . 17 1 1 A 16 16 GLU CB C 16 30.907 30.410 0.497 1
1 83 . 17 1 1 A 16 16 GLU N N 16 113.348 115.107 -1.759 1
1 84 . 17 1 1 A 17 17 GLN H H 17 7.501 7.048 0.453 1
1 85 . 17 1 1 A 17 17 GLN HA H 17 3.683 4.082 -0.399 1
1 92 . 17 1 1 A 17 17 GLN C C 17 178.053 176.159 1.894 1
1 93 . 17 1 1 A 17 17 GLN CA C 17 54.606 55.098 -0.492 1
1 94 . 17 1 1 A 17 17 GLN CB C 17 25.758 28.324 -2.566 1
1 96 . 17 1 1 A 17 17 GLN N N 17 119.411 119.586 -0.175 1
1 98 . 17 1 1 A 18 18 ASP H H 18 8.949 8.668 0.281 1
1 99 . 17 1 1 A 18 18 ASP HA H 18 4.184 4.168 0.016 1
1 102 . 17 1 1 A 18 18 ASP C C 18 175.263 177.001 -1.738 1
1 103 . 17 1 1 A 18 18 ASP CA C 18 57.275 56.363 0.912 1
1 104 . 17 1 1 A 18 18 ASP CB C 18 40.620 39.936 0.684 1
1 105 . 17 1 1 A 18 18 ASP N N 18 124.676 123.958 0.718 1
1 106 . 17 1 1 A 19 19 TRP H H 19 6.068 7.244 -1.176 1
1 107 . 17 1 1 A 19 19 TRP HA H 19 5.045 4.581 0.464 1
1 116 . 17 1 1 A 19 19 TRP C C 19 175.902 175.983 -0.081 1
1 117 . 17 1 1 A 19 19 TRP CA C 19 53.542 57.336 -3.794 1
1 118 . 17 1 1 A 19 19 TRP CB C 19 29.179 29.115 0.064 1
1 124 . 17 1 1 A 19 19 TRP N N 19 107.757 116.731 -8.974 1
1 126 . 17 1 1 A 20 20 TYR H H 20 7.430 7.579 -0.149 1
1 127 . 17 1 1 A 20 20 TYR HA H 20 5.601 5.370 0.231 1
1 132 . 17 1 1 A 20 20 TYR C C 20 175.498 175.539 -0.041 1
1 133 . 17 1 1 A 20 20 TYR CA C 20 56.967 57.034 -0.067 1
1 134 . 17 1 1 A 20 20 TYR CB C 20 39.083 39.015 0.068 1
1 137 . 17 1 1 A 20 20 TYR N N 20 123.173 121.491 1.682 1
1 138 . 17 1 1 A 21 21 HIS H H 21 8.934 8.666 0.268 1
1 139 . 17 1 1 A 21 21 HIS HA H 21 4.295 4.427 -0.132 1
1 144 . 17 1 1 A 21 21 HIS C C 21 175.177 174.957 0.220 1
1 145 . 17 1 1 A 21 21 HIS CA C 21 56.572 56.102 0.470 1
1 146 . 17 1 1 A 21 21 HIS CB C 21 33.365 30.685 2.680 1
1 149 . 17 1 1 A 21 21 HIS N N 21 125.732 127.439 -1.707 1
1 150 . 17 1 1 A 22 22 GLY H H 22 5.280 6.667 -1.387 1
1 151 . 17 1 1 A 22 22 GLY HA2 H 22 3.905 3.536 0.369 1
1 152 . 17 1 1 A 22 22 GLY HA3 H 22 3.585 3.822 -0.237 1
1 153 . 17 1 1 A 22 22 GLY C C 22 174.411 174.015 0.396 1
1 154 . 17 1 1 A 22 22 GLY CA C 22 46.402 44.627 1.775 1
1 155 . 17 1 1 A 22 22 GLY N N 22 104.568 106.569 -2.001 1
1 156 . 17 1 1 A 23 23 ALA H H 23 8.768 8.306 0.462 1
1 157 . 17 1 1 A 23 23 ALA HA H 23 5.171 4.578 0.593 1
1 161 . 17 1 1 A 23 23 ALA C C 23 177.180 176.776 0.404 1
1 162 . 17 1 1 A 23 23 ALA CA C 23 51.153 51.193 -0.040 1
1 163 . 17 1 1 A 23 23 ALA CB C 23 16.999 17.681 -0.682 1
1 164 . 17 1 1 A 23 23 ALA N N 23 130.297 124.779 5.518 1
1 165 . 17 1 1 A 24 24 ILE H H 24 7.267 7.720 -0.453 1
1 166 . 17 1 1 A 24 24 ILE HA H 24 4.460 4.633 -0.173 1
1 176 . 17 1 1 A 24 24 ILE CA C 24 58.529 58.788 -0.259 1
1 177 . 17 1 1 A 24 24 ILE CB C 24 38.763 38.513 0.250 1
1 181 . 17 1 1 A 24 24 ILE N N 24 118.903 118.268 0.635 1
1 182 . 17 1 1 A 25 25 PRO HA H 25 4.224 4.487 -0.263 1
1 189 . 17 1 1 A 25 25 PRO C C 25 176.918 177.302 -0.384 1
1 190 . 17 1 1 A 25 25 PRO CA C 25 62.907 62.435 0.472 1
1 191 . 17 1 1 A 25 25 PRO CB C 25 32.671 33.162 -0.491 1
1 194 . 17 1 1 A 26 26 ARG H H 26 8.781 9.085 -0.304 1
1 195 . 17 1 1 A 26 26 ARG HA H 26 3.472 3.850 -0.378 1
1 202 . 17 1 1 A 26 26 ARG C C 26 178.112 178.268 -0.156 1
1 203 . 17 1 1 A 26 26 ARG CA C 26 60.863 59.463 1.400 1
1 204 . 17 1 1 A 26 26 ARG CB C 26 30.314 29.903 0.411 1
1 207 . 17 1 1 A 26 26 ARG N N 26 124.635 120.820 3.815 1
1 208 . 17 1 1 A 27 27 ILE H H 27 8.540 8.148 0.392 1
1 209 . 17 1 1 A 27 27 ILE HA H 27 3.787 3.611 0.176 1
1 219 . 17 1 1 A 27 27 ILE C C 27 177.390 177.815 -0.425 1
1 220 . 17 1 1 A 27 27 ILE CA C 27 64.329 65.577 -1.248 1
1 221 . 17 1 1 A 27 27 ILE CB C 27 37.413 37.713 -0.300 1
1 225 . 17 1 1 A 27 27 ILE N N 27 115.859 119.865 -4.006 1
1 226 . 17 1 1 A 28 28 GLU H H 28 6.953 8.484 -1.531 1
1 227 . 17 1 1 A 28 28 GLU HA H 28 4.067 3.974 0.093 1
1 232 . 17 1 1 A 28 28 GLU C C 28 179.006 179.250 -0.244 1
1 233 . 17 1 1 A 28 28 GLU CA C 28 58.985 59.664 -0.679 1
1 234 . 17 1 1 A 28 28 GLU CB C 28 29.316 29.187 0.129 1
1 236 . 17 1 1 A 28 28 GLU N N 28 120.554 119.662 0.892 1
1 237 . 17 1 1 A 29 29 ALA H H 29 7.999 7.852 0.147 1
1 238 . 17 1 1 A 29 29 ALA HA H 29 3.822 3.983 -0.161 1
1 242 . 17 1 1 A 29 29 ALA C C 29 178.809 179.597 -0.788 1
1 243 . 17 1 1 A 29 29 ALA CA C 29 54.698 55.423 -0.725 1
1 244 . 17 1 1 A 29 29 ALA CB C 29 18.059 18.243 -0.184 1
1 245 . 17 1 1 A 29 29 ALA N N 29 120.122 122.699 -2.577 1
1 246 . 17 1 1 A 30 30 GLN H H 30 8.168 8.050 0.118 1
1 247 . 17 1 1 A 30 30 GLN HA H 30 3.811 4.116 -0.305 1
1 254 . 17 1 1 A 30 30 GLN C C 30 177.578 177.960 -0.382 1
1 255 . 17 1 1 A 30 30 GLN CA C 30 59.731 58.540 1.191 1
1 256 . 17 1 1 A 30 30 GLN CB C 30 28.161 27.950 0.211 1
1 258 . 17 1 1 A 30 30 GLN N N 30 112.109 116.349 -4.240 1
1 260 . 17 1 1 A 31 31 GLU H H 31 7.248 8.236 -0.988 1
1 261 . 17 1 1 A 31 31 GLU HA H 31 4.063 4.035 0.028 1
1 266 . 17 1 1 A 31 31 GLU C C 31 177.423 179.020 -1.597 1
1 267 . 17 1 1 A 31 31 GLU CA C 31 57.650 59.011 -1.361 1
1 268 . 17 1 1 A 31 31 GLU CB C 31 29.757 29.161 0.596 1
1 270 . 17 1 1 A 31 31 GLU N N 31 115.340 119.489 -4.149 1
1 271 . 17 1 1 A 32 32 LEU H H 32 7.169 7.713 -0.544 1
1 272 . 17 1 1 A 32 32 LEU HA H 32 4.087 4.108 -0.021 1
1 282 . 17 1 1 A 32 32 LEU C C 32 175.850 177.167 -1.317 1
1 283 . 17 1 1 A 32 32 LEU CA C 32 55.580 57.358 -1.778 1
1 284 . 17 1 1 A 32 32 LEU CB C 32 42.910 41.520 1.390 1
1 288 . 17 1 1 A 32 32 LEU N N 32 116.367 115.653 0.714 1
1 289 . 17 1 1 A 33 33 LEU H H 33 7.062 7.604 -0.542 1
1 290 . 17 1 1 A 33 33 LEU HA H 33 4.431 4.135 0.296 1
1 300 . 17 1 1 A 33 33 LEU C C 33 174.837 177.295 -2.458 1
1 301 . 17 1 1 A 33 33 LEU CA C 33 53.521 55.247 -1.726 1
1 302 . 17 1 1 A 33 33 LEU CB C 33 43.301 41.570 1.731 1
1 306 . 17 1 1 A 33 33 LEU N N 33 118.568 123.164 -4.596 1
1 307 . 17 1 1 A 34 34 LYS H H 34 8.749 8.729 0.020 1
1 308 . 17 1 1 A 34 34 LYS HA H 34 4.162 4.326 -0.164 1
1 317 . 17 1 1 A 34 34 LYS C C 34 174.378 175.086 -0.708 1
1 318 . 17 1 1 A 34 34 LYS CA C 34 56.575 55.694 0.881 1
1 319 . 17 1 1 A 34 34 LYS CB C 34 36.918 33.851 3.067 1
1 323 . 17 1 1 A 34 34 LYS N N 34 121.659 118.370 3.289 1
1 324 . 17 1 1 A 35 35 LYS H H 35 8.137 7.379 0.758 1
1 325 . 17 1 1 A 35 35 LYS HA H 35 4.011 4.628 -0.617 1
1 334 . 17 1 1 A 35 35 LYS C C 35 174.343 174.342 0.001 1
1 335 . 17 1 1 A 35 35 LYS CA C 35 53.960 54.633 -0.673 1
1 336 . 17 1 1 A 35 35 LYS CB C 35 35.587 35.581 0.006 1
1 340 . 17 1 1 A 35 35 LYS N N 35 119.354 116.470 2.884 1
1 341 . 17 1 1 A 36 36 GLN H H 36 8.394 8.637 -0.243 1
1 342 . 17 1 1 A 36 36 GLN HA H 36 4.187 4.397 -0.210 1
1 349 . 17 1 1 A 36 36 GLN C C 36 177.012 176.754 0.258 1
1 350 . 17 1 1 A 36 36 GLN CA C 36 57.750 57.894 -0.144 1
1 351 . 17 1 1 A 36 36 GLN CB C 36 28.433 28.423 0.010 1
1 353 . 17 1 1 A 36 36 GLN N N 36 120.248 122.941 -2.693 1
1 355 . 17 1 1 A 37 37 GLY H H 37 9.597 9.096 0.501 1
1 356 . 17 1 1 A 37 37 GLY HA2 H 37 4.486 4.095 0.391 1
1 357 . 17 1 1 A 37 37 GLY HA3 H 37 3.926 4.108 -0.182 1
1 358 . 17 1 1 A 37 37 GLY C C 37 176.285 174.302 1.983 1
1 359 . 17 1 1 A 37 37 GLY CA C 37 46.146 45.176 0.970 1
1 360 . 17 1 1 A 37 37 GLY N N 37 116.637 114.984 1.653 1
1 361 . 17 1 1 A 38 38 ASP H H 38 8.925 8.175 0.750 1
1 362 . 17 1 1 A 38 38 ASP HA H 38 5.697 4.647 1.050 1
1 365 . 17 1 1 A 38 38 ASP C C 38 176.181 175.516 0.665 1
1 366 . 17 1 1 A 38 38 ASP CA C 38 55.066 54.859 0.207 1
1 367 . 17 1 1 A 38 38 ASP CB C 38 42.933 41.740 1.193 1
1 368 . 17 1 1 A 38 38 ASP N N 38 127.293 122.265 5.028 1
1 369 . 17 1 1 A 39 39 PHE H H 39 8.647 8.425 0.222 1
1 370 . 17 1 1 A 39 39 PHE HA H 39 6.025 5.906 0.119 1
1 378 . 17 1 1 A 39 39 PHE C C 39 170.948 173.004 -2.056 1
1 379 . 17 1 1 A 39 39 PHE CA C 39 56.376 56.044 0.332 1
1 380 . 17 1 1 A 39 39 PHE CB C 39 44.583 42.822 1.761 1
1 386 . 17 1 1 A 39 39 PHE N N 39 117.102 120.744 -3.642 1
1 387 . 17 1 1 A 40 40 LEU H H 40 9.186 8.983 0.203 1
1 388 . 17 1 1 A 40 40 LEU HA H 40 4.983 5.025 -0.042 1
1 398 . 17 1 1 A 40 40 LEU C C 40 174.787 174.395 0.392 1
1 399 . 17 1 1 A 40 40 LEU CA C 40 54.610 53.857 0.753 1
1 400 . 17 1 1 A 40 40 LEU CB C 40 44.330 45.624 -1.294 1
1 404 . 17 1 1 A 40 40 LEU N N 40 114.388 117.174 -2.786 1
1 405 . 17 1 1 A 41 41 VAL H H 41 9.390 9.430 -0.040 1
1 406 . 17 1 1 A 41 41 VAL HA H 41 5.742 5.048 0.694 1
1 414 . 17 1 1 A 41 41 VAL C C 41 172.760 175.231 -2.471 1
1 415 . 17 1 1 A 41 41 VAL CA C 41 60.814 61.682 -0.868 1
1 416 . 17 1 1 A 41 41 VAL CB C 41 34.908 33.367 1.541 1
1 419 . 17 1 1 A 41 41 VAL N N 41 119.873 122.336 -2.463 1
1 420 . 17 1 1 A 42 42 ARG H H 42 9.598 9.181 0.417 1
1 421 . 17 1 1 A 42 42 ARG HA H 42 5.247 5.126 0.121 1
1 429 . 17 1 1 A 42 42 ARG C C 42 173.379 174.206 -0.827 1
1 430 . 17 1 1 A 42 42 ARG CA C 42 53.202 53.634 -0.432 1
1 431 . 17 1 1 A 42 42 ARG CB C 42 33.507 34.016 -0.509 1
1 434 . 17 1 1 A 42 42 ARG N N 42 124.179 124.602 -0.423 1
1 436 . 17 1 1 A 43 43 GLU H H 43 8.234 8.627 -0.393 1
1 437 . 17 1 1 A 43 43 GLU HA H 43 4.890 4.180 0.710 1
1 442 . 17 1 1 A 43 43 GLU C C 43 176.929 176.403 0.526 1
1 443 . 17 1 1 A 43 43 GLU CA C 43 54.846 55.625 -0.779 1
1 444 . 17 1 1 A 43 43 GLU CB C 43 31.599 30.969 0.630 1
1 446 . 17 1 1 A 43 43 GLU N N 43 124.103 122.654 1.449 1
1 447 . 17 1 1 A 44 44 SER H H 44 9.033 8.991 0.042 1
1 448 . 17 1 1 A 44 44 SER HA H 44 3.957 4.532 -0.575 1
1 451 . 17 1 1 A 44 44 SER C C 44 175.005 173.717 1.288 1
1 452 . 17 1 1 A 44 44 SER CA C 44 59.393 58.276 1.117 1
1 453 . 17 1 1 A 44 44 SER CB C 44 63.619 63.593 0.026 1
1 454 . 17 1 1 A 44 44 SER N N 44 124.316 120.857 3.459 1
1 455 . 17 1 1 A 45 45 HIS H H 45 8.461 8.658 -0.197 1
1 456 . 17 1 1 A 45 45 HIS HA H 45 4.132 4.465 -0.333 1
1 460 . 17 1 1 A 45 45 HIS C C 45 176.480 175.972 0.508 1
1 461 . 17 1 1 A 45 45 HIS CA C 45 58.887 56.413 2.474 1
1 462 . 17 1 1 A 45 45 HIS CB C 45 30.180 29.510 0.670 1
1 464 . 17 1 1 A 45 45 HIS N N 45 127.694 127.435 0.259 1
1 465 . 17 1 1 A 46 46 GLY H H 46 8.513 8.204 0.309 1
1 466 . 17 1 1 A 46 46 GLY HA2 H 46 3.827 3.792 0.035 1
1 467 . 17 1 1 A 46 46 GLY HA3 H 46 3.827 3.857 -0.030 1
1 468 . 17 1 1 A 46 46 GLY C C 46 173.630 173.574 0.056 1
1 469 . 17 1 1 A 46 46 GLY CA C 46 45.188 45.334 -0.146 1
1 470 . 17 1 1 A 46 46 GLY N N 46 110.761 112.685 -1.924 1
1 471 . 17 1 1 A 47 47 LYS H H 47 7.216 7.857 -0.641 1
1 472 . 17 1 1 A 47 47 LYS HA H 47 4.540 4.699 -0.159 1
1 481 . 17 1 1 A 47 47 LYS CA C 47 53.475 53.206 0.269 1
1 482 . 17 1 1 A 47 47 LYS CB C 47 33.325 33.951 -0.626 1
1 486 . 17 1 1 A 47 47 LYS N N 47 121.356 122.521 -1.165 1
1 487 . 17 1 1 A 48 48 PRO HA H 48 4.181 4.296 -0.115 1
1 494 . 17 1 1 A 48 48 PRO C C 48 178.920 177.416 1.504 1
1 495 . 17 1 1 A 48 48 PRO CA C 48 63.239 63.723 -0.484 1
1 496 . 17 1 1 A 48 48 PRO CB C 48 31.523 31.474 0.049 1
1 499 . 17 1 1 A 49 49 GLY H H 49 9.752 9.046 0.706 1
1 500 . 17 1 1 A 49 49 GLY HA2 H 49 4.053 3.980 0.073 1
1 501 . 17 1 1 A 49 49 GLY HA3 H 49 3.374 4.114 -0.740 1
1 502 . 17 1 1 A 49 49 GLY C C 49 172.093 174.165 -2.072 1
1 503 . 17 1 1 A 49 49 GLY CA C 49 45.041 45.353 -0.312 1
1 504 . 17 1 1 A 49 49 GLY N N 49 112.415 112.462 -0.047 1
1 505 . 17 1 1 A 50 50 GLU H H 50 7.623 7.769 -0.146 1
1 506 . 17 1 1 A 50 50 GLU HA H 50 4.537 4.578 -0.041 1
1 511 . 17 1 1 A 50 50 GLU C C 50 173.297 175.055 -1.758 1
1 512 . 17 1 1 A 50 50 GLU CA C 50 55.174 55.997 -0.823 1
1 513 . 17 1 1 A 50 50 GLU CB C 50 31.651 29.664 1.987 1
1 515 . 17 1 1 A 50 50 GLU N N 50 121.600 122.182 -0.582 1
1 516 . 17 1 1 A 51 51 TYR H H 51 9.452 9.273 0.179 1
1 517 . 17 1 1 A 51 51 TYR HA H 51 5.382 5.199 0.183 1
1 524 . 17 1 1 A 51 51 TYR C C 51 174.387 175.429 -1.042 1
1 525 . 17 1 1 A 51 51 TYR CA C 51 57.592 57.842 -0.250 1
1 526 . 17 1 1 A 51 51 TYR CB C 51 41.820 39.962 1.858 1
1 531 . 17 1 1 A 51 51 TYR N N 51 125.790 127.111 -1.321 1
1 532 . 17 1 1 A 52 52 VAL H H 52 9.471 9.468 0.003 1
1 533 . 17 1 1 A 52 52 VAL HA H 52 4.840 4.942 -0.102 1
1 541 . 17 1 1 A 52 52 VAL C C 52 174.947 175.272 -0.325 1
1 542 . 17 1 1 A 52 52 VAL CA C 52 60.991 61.330 -0.339 1
1 543 . 17 1 1 A 52 52 VAL CB C 52 36.829 33.879 2.950 1
1 546 . 17 1 1 A 52 52 VAL N N 52 120.617 123.530 -2.913 1
1 547 . 17 1 1 A 53 53 LEU H H 53 9.457 9.373 0.084 1
1 548 . 17 1 1 A 53 53 LEU HA H 53 5.294 5.141 0.153 1
1 558 . 17 1 1 A 53 53 LEU C C 53 175.024 175.020 0.004 1
1 559 . 17 1 1 A 53 53 LEU CA C 53 53.904 54.673 -0.769 1
1 560 . 17 1 1 A 53 53 LEU CB C 53 44.756 44.290 0.466 1
1 564 . 17 1 1 A 53 53 LEU N N 53 127.725 131.472 -3.747 1
1 565 . 17 1 1 A 54 54 SER H H 54 9.461 9.180 0.281 1
1 566 . 17 1 1 A 54 54 SER HA H 54 5.691 5.573 0.118 1
1 569 . 17 1 1 A 54 54 SER C C 54 172.227 173.156 -0.929 1
1 570 . 17 1 1 A 54 54 SER CA C 54 58.551 57.907 0.644 1
1 571 . 17 1 1 A 54 54 SER CB C 54 65.738 64.927 0.811 1
1 572 . 17 1 1 A 54 54 SER N N 54 127.178 124.672 2.506 1
1 573 . 17 1 1 A 55 55 VAL H H 55 9.049 8.720 0.329 1
1 574 . 17 1 1 A 55 55 VAL HA H 55 5.691 5.464 0.227 1
1 582 . 17 1 1 A 55 55 VAL C C 55 173.959 172.831 1.128 1
1 583 . 17 1 1 A 55 55 VAL CA C 55 58.398 59.811 -1.413 1
1 584 . 17 1 1 A 55 55 VAL CB C 55 36.262 36.004 0.258 1
1 587 . 17 1 1 A 55 55 VAL N N 55 120.619 123.824 -3.205 1
1 588 . 17 1 1 A 56 56 TYR H H 56 8.629 9.248 -0.619 1
1 589 . 17 1 1 A 56 56 TYR HA H 56 4.951 5.206 -0.255 1
1 596 . 17 1 1 A 56 56 TYR C C 56 175.224 174.479 0.745 1
1 597 . 17 1 1 A 56 56 TYR CA C 56 56.684 56.197 0.487 1
1 598 . 17 1 1 A 56 56 TYR CB C 56 39.646 39.696 -0.050 1
1 603 . 17 1 1 A 56 56 TYR N N 56 127.444 129.660 -2.216 1
1 604 . 17 1 1 A 57 57 SER H H 57 8.869 8.377 0.492 1
1 605 . 17 1 1 A 57 57 SER HA H 57 4.739 4.944 -0.205 1
1 608 . 17 1 1 A 57 57 SER C C 57 174.492 172.999 1.493 1
1 609 . 17 1 1 A 57 57 SER CA C 57 57.591 56.037 1.554 1
1 610 . 17 1 1 A 57 57 SER CB C 57 64.281 66.145 -1.864 1
1 611 . 17 1 1 A 57 57 SER N N 57 122.165 119.274 2.891 1
1 612 . 17 1 1 A 58 58 ASP H H 58 10.446 9.384 1.062 1
1 613 . 17 1 1 A 58 58 ASP HA H 58 4.382 4.284 0.098 1
1 616 . 17 1 1 A 58 58 ASP C C 58 176.398 176.267 0.131 1
1 617 . 17 1 1 A 58 58 ASP CA C 58 55.215 55.264 -0.049 1
1 618 . 17 1 1 A 58 58 ASP CB C 58 39.513 39.220 0.293 1
1 619 . 17 1 1 A 58 58 ASP N N 58 132.098 120.486 11.612 1
1 620 . 17 1 1 A 59 59 GLY H H 59 7.861 8.440 -0.579 1
1 621 . 17 1 1 A 59 59 GLY HA2 H 59 3.817 3.661 0.156 1
1 622 . 17 1 1 A 59 59 GLY HA3 H 59 4.086 3.773 0.313 1
1 623 . 17 1 1 A 59 59 GLY C C 59 173.111 173.414 -0.303 1
1 624 . 17 1 1 A 59 59 GLY CA C 59 45.486 45.253 0.233 1
1 625 . 17 1 1 A 59 59 GLY N N 59 102.674 104.770 -2.096 1
1 626 . 17 1 1 A 60 60 GLN H H 60 7.137 7.693 -0.556 1
1 627 . 17 1 1 A 60 60 GLN HA H 60 4.455 4.639 -0.184 1
1 634 . 17 1 1 A 60 60 GLN C C 60 173.549 174.606 -1.057 1
1 635 . 17 1 1 A 60 60 GLN CA C 60 53.388 53.416 -0.028 1
1 636 . 17 1 1 A 60 60 GLN CB C 60 32.373 32.070 0.303 1
1 638 . 17 1 1 A 60 60 GLN N N 60 116.206 118.655 -2.449 1
1 640 . 17 1 1 A 61 61 ARG H H 61 8.589 8.335 0.254 1
1 641 . 17 1 1 A 61 61 ARG HA H 61 4.740 4.452 0.288 1
1 649 . 17 1 1 A 61 61 ARG C C 61 174.458 174.619 -0.161 1
1 650 . 17 1 1 A 61 61 ARG CA C 61 57.116 55.629 1.487 1
1 651 . 17 1 1 A 61 61 ARG CB C 61 29.615 30.663 -1.048 1
1 654 . 17 1 1 A 61 61 ARG N N 61 120.467 121.640 -1.173 1
1 656 . 17 1 1 A 62 62 ARG H H 62 8.867 8.956 -0.089 1
1 657 . 17 1 1 A 62 62 ARG HA H 62 4.297 4.302 -0.005 1
1 665 . 17 1 1 A 62 62 ARG C C 62 173.485 175.468 -1.983 1
1 666 . 17 1 1 A 62 62 ARG CA C 62 53.355 55.897 -2.542 1
1 667 . 17 1 1 A 62 62 ARG CB C 62 33.028 31.192 1.836 1
1 670 . 17 1 1 A 62 62 ARG N N 62 122.641 124.945 -2.304 1
1 672 . 17 1 1 A 63 63 HIS H H 63 7.997 8.302 -0.305 1
1 673 . 17 1 1 A 63 63 HIS HA H 63 5.427 5.124 0.303 1
1 678 . 17 1 1 A 63 63 HIS C C 63 174.946 174.032 0.914 1
1 679 . 17 1 1 A 63 63 HIS CA C 63 54.689 54.020 0.669 1
1 680 . 17 1 1 A 63 63 HIS CB C 63 33.008 32.136 0.872 1
1 683 . 17 1 1 A 63 63 HIS N N 63 119.064 118.708 0.356 1
1 684 . 17 1 1 A 64 64 PHE H H 64 9.880 9.585 0.295 1
1 685 . 17 1 1 A 64 64 PHE HA H 64 4.824 5.089 -0.265 1
1 693 . 17 1 1 A 64 64 PHE C C 64 174.882 174.994 -0.112 1
1 694 . 17 1 1 A 64 64 PHE CA C 64 56.489 56.584 -0.095 1
1 695 . 17 1 1 A 64 64 PHE CB C 64 41.405 40.991 0.414 1
1 701 . 17 1 1 A 64 64 PHE N N 64 123.961 122.150 1.811 1
1 702 . 17 1 1 A 65 65 ILE H H 65 8.982 9.195 -0.213 1
1 703 . 17 1 1 A 65 65 ILE HA H 65 4.273 4.629 -0.356 1
1 713 . 17 1 1 A 65 65 ILE C C 65 176.556 176.078 0.478 1
1 714 . 17 1 1 A 65 65 ILE CA C 65 62.649 60.783 1.866 1
1 715 . 17 1 1 A 65 65 ILE CB C 65 38.296 38.164 0.132 1
1 719 . 17 1 1 A 65 65 ILE N N 65 126.601 124.612 1.989 1
1 720 . 17 1 1 A 66 66 ILE H H 66 8.947 8.936 0.011 1
1 721 . 17 1 1 A 66 66 ILE HA H 66 3.780 4.032 -0.252 1
1 731 . 17 1 1 A 66 66 ILE C C 66 175.721 175.752 -0.031 1
1 732 . 17 1 1 A 66 66 ILE CA C 66 62.960 61.434 1.526 1
1 733 . 17 1 1 A 66 66 ILE CB C 66 37.209 37.653 -0.444 1
1 737 . 17 1 1 A 66 66 ILE N N 66 130.139 129.134 1.005 1
1 738 . 17 1 1 A 67 67 GLN H H 67 8.410 8.606 -0.196 1
1 739 . 17 1 1 A 67 67 GLN HA H 67 4.422 4.839 -0.417 1
1 746 . 17 1 1 A 67 67 GLN C C 67 174.347 174.079 0.268 1
1 747 . 17 1 1 A 67 67 GLN CA C 67 55.867 55.086 0.781 1
1 748 . 17 1 1 A 67 67 GLN CB C 67 29.950 30.086 -0.136 1
1 750 . 17 1 1 A 67 67 GLN N N 67 128.872 127.187 1.685 1
1 752 . 17 1 1 A 68 68 TYR H H 68 8.619 8.948 -0.329 1
1 753 . 17 1 1 A 68 68 TYR HA H 68 5.300 4.712 0.588 1
1 760 . 17 1 1 A 68 68 TYR C C 68 174.695 174.118 0.577 1
1 761 . 17 1 1 A 68 68 TYR CA C 68 55.579 56.447 -0.868 1
1 762 . 17 1 1 A 68 68 TYR CB C 68 39.479 38.822 0.657 1
1 767 . 17 1 1 A 68 68 TYR N N 68 124.772 125.625 -0.853 1
1 768 . 17 1 1 A 69 69 VAL H H 69 8.539 8.691 -0.152 1
1 769 . 17 1 1 A 69 69 VAL HA H 69 4.046 4.325 -0.279 1
1 777 . 17 1 1 A 69 69 VAL C C 69 175.010 175.408 -0.398 1
1 778 . 17 1 1 A 69 69 VAL CA C 69 60.611 60.997 -0.386 1
1 779 . 17 1 1 A 69 69 VAL CB C 69 35.358 33.934 1.424 1
1 782 . 17 1 1 A 69 69 VAL N N 69 126.652 128.069 -1.417 1
1 783 . 17 1 1 A 70 70 ASP H H 70 9.089 9.338 -0.249 1
1 784 . 17 1 1 A 70 70 ASP HA H 70 4.025 4.173 -0.148 1
1 787 . 17 1 1 A 70 70 ASP C C 70 174.813 174.998 -0.185 1
1 788 . 17 1 1 A 70 70 ASP CA C 70 55.623 55.595 0.028 1
1 789 . 17 1 1 A 70 70 ASP CB C 70 39.081 39.032 0.049 1
1 790 . 17 1 1 A 70 70 ASP N N 70 128.327 129.068 -0.741 1
1 791 . 17 1 1 A 71 71 ASN H H 71 8.128 8.012 0.116 1
1 792 . 17 1 1 A 71 71 ASN HA H 71 3.597 3.664 -0.067 1
1 797 . 17 1 1 A 71 71 ASN C C 71 173.250 173.642 -0.392 1
1 798 . 17 1 1 A 71 71 ASN CA C 71 54.728 54.273 0.455 1
1 799 . 17 1 1 A 71 71 ASN CB C 71 37.601 37.167 0.434 1
1 800 . 17 1 1 A 71 71 ASN N N 71 107.230 107.593 -0.363 1
1 802 . 17 1 1 A 72 72 MET H H 72 7.256 7.401 -0.145 1
1 803 . 17 1 1 A 72 72 MET HA H 72 4.740 4.812 -0.072 1
1 808 . 17 1 1 A 72 72 MET C C 72 173.780 174.556 -0.776 1
1 809 . 17 1 1 A 72 72 MET CA C 72 53.703 53.983 -0.280 1
1 810 . 17 1 1 A 72 72 MET CB C 72 36.570 35.208 1.362 1
1 812 . 17 1 1 A 72 72 MET N N 72 117.117 117.149 -0.032 1
1 813 . 17 1 1 A 73 73 TYR H H 73 9.430 9.208 0.222 1
1 814 . 17 1 1 A 73 73 TYR HA H 73 5.718 4.993 0.725 1
1 821 . 17 1 1 A 73 73 TYR C C 73 176.140 176.000 0.140 1
1 822 . 17 1 1 A 73 73 TYR CA C 73 57.290 58.078 -0.788 1
1 823 . 17 1 1 A 73 73 TYR CB C 73 40.013 39.254 0.759 1
1 828 . 17 1 1 A 73 73 TYR N N 73 119.856 122.706 -2.850 1
1 829 . 17 1 1 A 74 74 ARG H H 74 9.038 8.968 0.070 1
1 830 . 17 1 1 A 74 74 ARG HA H 74 4.867 5.017 -0.150 1
1 838 . 17 1 1 A 74 74 ARG C C 74 173.954 175.440 -1.486 1
1 839 . 17 1 1 A 74 74 ARG CA C 74 54.887 54.295 0.592 1
1 840 . 17 1 1 A 74 74 ARG CB C 74 34.484 33.736 0.748 1
1 843 . 17 1 1 A 74 74 ARG N N 74 117.344 121.168 -3.824 1
1 845 . 17 1 1 A 75 75 PHE H H 75 9.005 8.884 0.121 1
1 846 . 17 1 1 A 75 75 PHE HA H 75 5.046 4.615 0.431 1
1 854 . 17 1 1 A 75 75 PHE C C 75 176.186 176.075 0.111 1
1 855 . 17 1 1 A 75 75 PHE CA C 75 59.658 59.566 0.092 1
1 856 . 17 1 1 A 75 75 PHE CB C 75 39.356 40.154 -0.798 1
1 862 . 17 1 1 A 75 75 PHE N N 75 117.865 121.744 -3.879 1
1 863 . 17 1 1 A 76 76 GLU H H 76 8.213 8.296 -0.083 1
1 864 . 17 1 1 A 76 76 GLU HA H 76 4.586 4.755 -0.169 1
1 869 . 17 1 1 A 76 76 GLU C C 76 175.238 176.971 -1.733 1
1 870 . 17 1 1 A 76 76 GLU CA C 76 55.994 57.940 -1.946 1
1 871 . 17 1 1 A 76 76 GLU CB C 76 31.805 31.938 -0.133 1
1 873 . 17 1 1 A 76 76 GLU N N 76 116.834 117.497 -0.663 1
1 874 . 17 1 1 A 77 77 GLY H H 77 8.692 7.952 0.740 1
1 875 . 17 1 1 A 77 77 GLY HA2 H 77 4.166 4.083 0.083 1
1 876 . 17 1 1 A 77 77 GLY HA3 H 77 4.015 4.099 -0.084 1
1 877 . 17 1 1 A 77 77 GLY C C 77 173.784 173.839 -0.055 1
1 878 . 17 1 1 A 77 77 GLY CA C 77 45.505 44.441 1.064 1
1 879 . 17 1 1 A 77 77 GLY N N 77 111.937 108.283 3.654 1
1 880 . 17 1 1 A 78 78 THR H H 78 8.332 8.654 -0.322 1
1 881 . 17 1 1 A 78 78 THR HA H 78 3.900 4.342 -0.442 1
1 886 . 17 1 1 A 78 78 THR C C 78 173.591 174.581 -0.990 1
1 887 . 17 1 1 A 78 78 THR CA C 78 63.653 62.804 0.849 1
1 888 . 17 1 1 A 78 78 THR CB C 78 69.649 69.578 0.071 1
1 890 . 17 1 1 A 78 78 THR N N 78 120.765 116.598 4.167 1
1 891 . 17 1 1 A 79 79 GLY H H 79 8.038 8.511 -0.473 1
1 892 . 17 1 1 A 79 79 GLY HA2 H 79 4.748 4.341 0.407 1
1 893 . 17 1 1 A 79 79 GLY HA3 H 79 3.546 4.497 -0.951 1
1 894 . 17 1 1 A 79 79 GLY C C 79 172.580 172.153 0.427 1
1 895 . 17 1 1 A 79 79 GLY CA C 79 44.661 44.110 0.551 1
1 896 . 17 1 1 A 79 79 GLY N N 79 109.887 113.415 -3.528 1
1 897 . 17 1 1 A 80 80 PHE H H 80 9.064 8.728 0.336 1
1 898 . 17 1 1 A 80 80 PHE HA H 80 4.886 5.039 -0.153 1
1 906 . 17 1 1 A 80 80 PHE C C 80 176.507 175.990 0.517 1
1 907 . 17 1 1 A 80 80 PHE CA C 80 57.257 56.365 0.892 1
1 908 . 17 1 1 A 80 80 PHE CB C 80 44.655 42.456 2.199 1
1 914 . 17 1 1 A 80 80 PHE N N 80 116.862 119.524 -2.662 1
1 915 . 17 1 1 A 81 81 SER H H 81 9.413 9.021 0.392 1
1 916 . 17 1 1 A 81 81 SER HA H 81 4.622 4.661 -0.039 1
1 919 . 17 1 1 A 81 81 SER C C 81 173.735 173.985 -0.250 1
1 920 . 17 1 1 A 81 81 SER CA C 81 61.410 60.661 0.749 1
1 921 . 17 1 1 A 81 81 SER CB C 81 64.165 63.222 0.943 1
1 922 . 17 1 1 A 81 81 SER N N 81 116.467 118.268 -1.801 1
1 923 . 17 1 1 A 82 82 ASN H H 82 7.688 8.140 -0.452 1
1 924 . 17 1 1 A 82 82 ASN HA H 82 4.952 5.203 -0.251 1
1 929 . 17 1 1 A 82 82 ASN C C 82 173.303 175.495 -2.192 1
1 930 . 17 1 1 A 82 82 ASN CA C 82 52.086 52.183 -0.097 1
1 931 . 17 1 1 A 82 82 ASN CB C 82 41.258 40.671 0.587 1
1 932 . 17 1 1 A 82 82 ASN N N 82 113.355 116.792 -3.437 1
1 934 . 17 1 1 A 83 83 ILE H H 83 8.858 8.667 0.191 1
1 935 . 17 1 1 A 83 83 ILE HA H 83 3.571 3.722 -0.151 1
1 945 . 17 1 1 A 83 83 ILE CA C 83 66.416 65.173 1.243 1
1 946 . 17 1 1 A 83 83 ILE CB C 83 35.074 34.550 0.524 1
1 950 . 17 1 1 A 83 83 ILE N N 83 118.908 124.261 -5.353 1
1 951 . 17 1 1 A 84 84 PRO HA H 84 4.411 4.621 -0.210 1
1 958 . 17 1 1 A 84 84 PRO C C 84 177.616 179.616 -2.000 1
1 959 . 17 1 1 A 84 84 PRO CA C 84 67.525 66.654 0.871 1
1 960 . 17 1 1 A 84 84 PRO CB C 84 31.029 30.804 0.225 1
1 963 . 17 1 1 A 85 85 GLN H H 85 8.405 8.312 0.093 1
1 964 . 17 1 1 A 85 85 GLN HA H 85 3.874 4.024 -0.150 1
1 971 . 17 1 1 A 85 85 GLN C C 85 178.213 178.232 -0.019 1
1 972 . 17 1 1 A 85 85 GLN CA C 85 59.495 58.923 0.572 1
1 973 . 17 1 1 A 85 85 GLN CB C 85 29.270 28.201 1.069 1
1 975 . 17 1 1 A 85 85 GLN N N 85 115.597 117.334 -1.737 1
1 977 . 17 1 1 A 86 86 LEU H H 86 7.136 8.116 -0.980 1
1 978 . 17 1 1 A 86 86 LEU HA H 86 3.589 3.611 -0.022 1
1 988 . 17 1 1 A 86 86 LEU C C 86 177.728 178.556 -0.828 1
1 989 . 17 1 1 A 86 86 LEU CA C 86 58.136 58.329 -0.193 1
1 990 . 17 1 1 A 86 86 LEU CB C 86 42.290 41.864 0.426 1
1 994 . 17 1 1 A 86 86 LEU N N 86 121.840 121.749 0.091 1
1 995 . 17 1 1 A 87 87 ILE H H 87 8.323 8.170 0.153 1
1 996 . 17 1 1 A 87 87 ILE HA H 87 3.415 3.402 0.013 1
1 1006 . 17 1 1 A 87 87 ILE C C 87 178.064 177.623 0.441 1
1 1007 . 17 1 1 A 87 87 ILE CA C 87 61.458 65.490 -4.032 1
1 1008 . 17 1 1 A 87 87 ILE CB C 87 34.561 37.734 -3.173 1
1 1012 . 17 1 1 A 87 87 ILE N N 87 118.117 119.622 -1.505 1
1 1013 . 17 1 1 A 88 88 ASP H H 88 8.805 8.528 0.277 1
1 1014 . 17 1 1 A 88 88 ASP HA H 88 4.548 4.313 0.235 1
1 1017 . 17 1 1 A 88 88 ASP C C 88 179.265 178.161 1.104 1
1 1018 . 17 1 1 A 88 88 ASP CA C 88 58.099 57.388 0.711 1
1 1019 . 17 1 1 A 88 88 ASP CB C 88 42.166 41.706 0.460 1
1 1020 . 17 1 1 A 88 88 ASP N N 88 119.143 120.518 -1.375 1
1 1021 . 17 1 1 A 89 89 HIS H H 89 8.113 7.993 0.120 1
1 1022 . 17 1 1 A 89 89 HIS HA H 89 4.225 4.238 -0.013 1
1 1026 . 17 1 1 A 89 89 HIS C C 89 179.261 176.963 2.298 1
1 1027 . 17 1 1 A 89 89 HIS CA C 89 60.647 59.102 1.545 1
1 1028 . 17 1 1 A 89 89 HIS CB C 89 30.801 29.875 0.926 1
1 1030 . 17 1 1 A 89 89 HIS N N 89 119.595 119.106 0.489 1
1 1031 . 17 1 1 A 90 90 HIS H H 90 7.685 7.868 -0.183 1
1 1032 . 17 1 1 A 90 90 HIS HA H 90 3.628 4.102 -0.474 1
1 1036 . 17 1 1 A 90 90 HIS C C 90 178.454 177.477 0.977 1
1 1037 . 17 1 1 A 90 90 HIS CA C 90 61.797 59.935 1.862 1
1 1038 . 17 1 1 A 90 90 HIS CB C 90 28.165 29.860 -1.695 1
1 1040 . 17 1 1 A 90 90 HIS N N 90 120.061 117.543 2.518 1
1 1041 . 17 1 1 A 91 91 TYR H H 91 9.394 8.363 1.031 1
1 1042 . 17 1 1 A 91 91 TYR HA H 91 4.238 3.844 0.394 1
1 1049 . 17 1 1 A 91 91 TYR C C 91 176.443 177.733 -1.290 1
1 1050 . 17 1 1 A 91 91 TYR CA C 91 60.669 61.822 -1.153 1
1 1051 . 17 1 1 A 91 91 TYR CB C 91 39.169 39.073 0.096 1
1 1056 . 17 1 1 A 91 91 TYR N N 91 123.532 120.066 3.466 1
1 1057 . 17 1 1 A 92 92 THR H H 92 8.774 8.411 0.363 1
1 1058 . 17 1 1 A 92 92 THR HA H 92 3.866 3.977 -0.111 1
1 1063 . 17 1 1 A 92 92 THR C C 92 177.050 176.229 0.821 1
1 1064 . 17 1 1 A 92 92 THR CA C 92 65.240 65.688 -0.448 1
1 1065 . 17 1 1 A 92 92 THR CB C 92 69.298 68.119 1.179 1
1 1067 . 17 1 1 A 92 92 THR N N 92 112.000 113.044 -1.044 1
1 1068 . 17 1 1 A 93 93 THR H H 93 7.617 7.681 -0.064 1
1 1069 . 17 1 1 A 93 93 THR HA H 93 4.133 4.135 -0.002 1
1 1074 . 17 1 1 A 93 93 THR C C 93 176.234 174.722 1.512 1
1 1075 . 17 1 1 A 93 93 THR CA C 93 63.527 62.258 1.269 1
1 1076 . 17 1 1 A 93 93 THR CB C 93 71.234 69.510 1.724 1
1 1078 . 17 1 1 A 93 93 THR N N 93 109.883 112.727 -2.844 1
1 1079 . 17 1 1 A 94 94 LYS H H 94 7.210 7.723 -0.513 1
1 1080 . 17 1 1 A 94 94 LYS HA H 94 3.830 3.743 0.087 1
1 1089 . 17 1 1 A 94 94 LYS C C 94 174.331 175.136 -0.805 1
1 1090 . 17 1 1 A 94 94 LYS CA C 94 56.776 57.364 -0.588 1
1 1091 . 17 1 1 A 94 94 LYS CB C 94 28.095 30.684 -2.589 1
1 1095 . 17 1 1 A 94 94 LYS N N 94 112.818 120.982 -8.164 1
1 1096 . 17 1 1 A 95 95 GLN H H 95 7.439 7.614 -0.175 1
1 1097 . 17 1 1 A 95 95 GLN HA H 95 4.216 4.498 -0.282 1
1 1104 . 17 1 1 A 95 95 GLN C C 95 179.087 176.050 3.037 1
1 1105 . 17 1 1 A 95 95 GLN CA C 95 56.378 55.157 1.221 1
1 1106 . 17 1 1 A 95 95 GLN CB C 95 28.542 30.116 -1.574 1
1 1108 . 17 1 1 A 95 95 GLN N N 95 117.860 118.851 -0.991 1
1 1110 . 17 1 1 A 96 96 VAL H H 96 8.520 8.628 -0.108 1
1 1111 . 17 1 1 A 96 96 VAL HA H 96 4.297 4.543 -0.246 1
1 1119 . 17 1 1 A 96 96 VAL C C 96 177.329 176.609 0.720 1
1 1120 . 17 1 1 A 96 96 VAL CA C 96 61.196 61.511 -0.315 1
1 1121 . 17 1 1 A 96 96 VAL CB C 96 32.735 33.151 -0.416 1
1 1124 . 17 1 1 A 96 96 VAL N N 96 124.208 119.638 4.570 1
1 1125 . 17 1 1 A 97 97 ILE H H 97 8.491 8.276 0.215 1
1 1126 . 17 1 1 A 97 97 ILE HA H 97 2.995 3.498 -0.503 1
1 1136 . 17 1 1 A 97 97 ILE CA C 97 62.066 63.236 -1.170 1
1 1137 . 17 1 1 A 97 97 ILE CB C 97 36.117 37.886 -1.769 1
1 1141 . 17 1 1 A 97 97 ILE N N 97 119.561 124.130 -4.569 1
1 1142 . 17 1 1 A 98 98 THR HA H 98 4.460 4.611 -0.151 1
1 1147 . 17 1 1 A 98 98 THR C C 98 174.335 174.656 -0.321 1
1 1148 . 17 1 1 A 98 98 THR CA C 98 58.244 59.377 -1.133 1
1 1149 . 17 1 1 A 98 98 THR CB C 98 73.056 71.970 1.086 1
1 1151 . 17 1 1 A 99 99 LYS H H 99 9.761 9.247 0.514 1
1 1152 . 17 1 1 A 99 99 LYS HA H 99 3.911 4.004 -0.093 1
1 1161 . 17 1 1 A 99 99 LYS C C 99 179.594 178.465 1.129 1
1 1162 . 17 1 1 A 99 99 LYS CA C 99 59.661 59.361 0.300 1
1 1163 . 17 1 1 A 99 99 LYS CB C 99 31.978 31.978 0.000 1
1 1167 . 17 1 1 A 99 99 LYS N N 99 125.750 122.333 3.417 1
1 1168 . 17 1 1 A 100 100 LYS H H 100 8.910 7.923 0.987 1
1 1169 . 17 1 1 A 100 100 LYS HA H 100 4.024 4.173 -0.149 1
1 1178 . 17 1 1 A 100 100 LYS C C 100 178.060 176.918 1.142 1
1 1179 . 17 1 1 A 100 100 LYS CA C 100 58.642 58.593 0.049 1
1 1180 . 17 1 1 A 100 100 LYS CB C 100 32.750 32.391 0.359 1
1 1184 . 17 1 1 A 100 100 LYS N N 100 117.112 118.076 -0.964 1
1 1185 . 17 1 1 A 101 101 SER H H 101 7.721 7.567 0.154 1
1 1186 . 17 1 1 A 101 101 SER HA H 101 4.282 4.641 -0.359 1
1 1189 . 17 1 1 A 101 101 SER C C 101 176.403 174.879 1.524 1
1 1190 . 17 1 1 A 101 101 SER CA C 101 60.442 58.548 1.894 1
1 1191 . 17 1 1 A 101 101 SER CB C 101 63.775 65.291 -1.516 1
1 1192 . 17 1 1 A 101 101 SER N N 101 112.069 112.708 -0.639 1
1 1193 . 17 1 1 A 102 102 GLY H H 102 8.038 8.304 -0.266 1
1 1194 . 17 1 1 A 102 102 GLY HA2 H 102 4.024 3.896 0.128 1
1 1195 . 17 1 1 A 102 102 GLY HA3 H 102 3.713 3.918 -0.205 1
1 1196 . 17 1 1 A 102 102 GLY C C 102 173.991 174.761 -0.770 1
1 1197 . 17 1 1 A 102 102 GLY CA C 102 46.458 46.437 0.021 1
1 1198 . 17 1 1 A 102 102 GLY N N 102 111.144 110.178 0.966 1
1 1199 . 17 1 1 A 103 103 VAL H H 103 7.155 8.036 -0.881 1
1 1200 . 17 1 1 A 103 103 VAL HA H 103 3.652 4.053 -0.401 1
1 1208 . 17 1 1 A 103 103 VAL C C 103 173.805 174.998 -1.193 1
1 1209 . 17 1 1 A 103 103 VAL CA C 103 64.310 62.359 1.951 1
1 1210 . 17 1 1 A 103 103 VAL CB C 103 32.254 32.347 -0.093 1
1 1213 . 17 1 1 A 103 103 VAL N N 103 119.836 121.100 -1.264 1
1 1214 . 17 1 1 A 104 104 VAL H H 104 7.653 8.992 -1.339 1
1 1215 . 17 1 1 A 104 104 VAL HA H 104 4.048 4.477 -0.429 1
1 1223 . 17 1 1 A 104 104 VAL C C 104 175.708 174.097 1.611 1
1 1224 . 17 1 1 A 104 104 VAL CA C 104 60.275 60.633 -0.358 1
1 1225 . 17 1 1 A 104 104 VAL CB C 104 35.112 34.345 0.767 1
1 1228 . 17 1 1 A 104 104 VAL N N 104 125.859 127.422 -1.563 1
1 1229 . 17 1 1 A 105 105 LEU H H 105 8.616 8.287 0.329 1
1 1230 . 17 1 1 A 105 105 LEU HA H 105 3.905 4.438 -0.533 1
1 1240 . 17 1 1 A 105 105 LEU C C 105 175.380 175.921 -0.541 1
1 1241 . 17 1 1 A 105 105 LEU CA C 105 54.471 53.691 0.780 1
1 1242 . 17 1 1 A 105 105 LEU CB C 105 39.821 41.835 -2.014 1
1 1246 . 17 1 1 A 105 105 LEU N N 105 123.839 126.365 -2.526 1
1 1247 . 17 1 1 A 106 106 LEU H H 106 8.894 8.494 0.400 1
1 1248 . 17 1 1 A 106 106 LEU HA H 106 4.839 4.974 -0.135 1
1 1258 . 17 1 1 A 106 106 LEU C C 106 176.930 176.338 0.592 1
1 1259 . 17 1 1 A 106 106 LEU CA C 106 56.288 53.211 3.077 1
1 1260 . 17 1 1 A 106 106 LEU CB C 106 45.237 45.552 -0.315 1
1 1264 . 17 1 1 A 106 106 LEU N N 106 120.590 121.660 -1.070 1
1 1265 . 17 1 1 A 107 107 ASN H H 107 8.124 9.041 -0.917 1
1 1266 . 17 1 1 A 107 107 ASN HA H 107 5.650 4.632 1.018 1
1 1271 . 17 1 1 A 107 107 ASN CA C 107 50.293 54.008 -3.715 1
1 1272 . 17 1 1 A 107 107 ASN CB C 107 41.223 36.212 5.011 1
1 1273 . 17 1 1 A 107 107 ASN N N 107 116.866 117.762 -0.896 1
1 1275 . 17 1 1 A 108 108 PRO HA H 108 2.926 4.076 -1.150 1
1 1282 . 17 1 1 A 108 108 PRO C C 108 176.671 175.675 0.996 1
1 1283 . 17 1 1 A 108 108 PRO CA C 108 60.804 62.345 -1.541 1
1 1284 . 17 1 1 A 108 108 PRO CB C 108 31.774 31.833 -0.059 1
1 1287 . 17 1 1 A 109 109 ILE H H 109 8.648 7.651 0.997 1
1 1288 . 17 1 1 A 109 109 ILE HA H 109 4.519 4.539 -0.020 1
1 1298 . 17 1 1 A 109 109 ILE CA C 109 55.070 58.419 -3.349 1
1 1299 . 17 1 1 A 109 109 ILE CB C 109 36.068 38.026 -1.958 1
1 1303 . 17 1 1 A 109 109 ILE N N 109 128.817 122.888 5.929 1
1 1304 . 17 1 1 A 110 110 PRO HA H 110 4.587 4.530 0.057 1
1 1311 . 17 1 1 A 110 110 PRO C C 110 177.013 176.554 0.459 1
1 1312 . 17 1 1 A 110 110 PRO CA C 110 61.850 62.561 -0.711 1
1 1313 . 17 1 1 A 110 110 PRO CB C 110 32.507 32.137 0.370 1
1 1316 . 17 1 1 A 111 111 LYS H H 111 8.038 8.165 -0.127 1
1 1317 . 17 1 1 A 111 111 LYS HA H 111 3.553 3.876 -0.323 1
1 1326 . 17 1 1 A 111 111 LYS C C 111 176.123 174.924 1.199 1
1 1327 . 17 1 1 A 111 111 LYS CA C 111 56.220 54.777 1.443 1
1 1328 . 17 1 1 A 111 111 LYS CB C 111 32.373 33.122 -0.749 1
1 1332 . 17 1 1 A 111 111 LYS N N 111 120.147 118.082 2.065 1
1 1333 . 17 1 1 A 112 112 ASP H H 112 8.463 8.220 0.243 1
1 1334 . 17 1 1 A 112 112 ASP HA H 112 4.523 4.827 -0.304 1
1 1337 . 17 1 1 A 112 112 ASP C C 112 175.986 174.231 1.755 1
1 1338 . 17 1 1 A 112 112 ASP CA C 112 54.256 52.788 1.468 1
1 1339 . 17 1 1 A 112 112 ASP CB C 112 41.563 44.580 -3.017 1
1 1340 . 17 1 1 A 112 112 ASP N N 112 121.863 118.809 3.054 1
1 1341 . 17 1 1 A 113 113 LYS H H 113 8.059 8.366 -0.307 1
1 1342 . 17 1 1 A 113 113 LYS HA H 113 4.136 3.949 0.187 1
1 1351 . 17 1 1 A 113 113 LYS C C 113 176.010 176.036 -0.026 1
1 1352 . 17 1 1 A 113 113 LYS CA C 113 56.253 55.481 0.772 1
1 1353 . 17 1 1 A 113 113 LYS CB C 113 32.754 32.359 0.395 1
1 1357 . 17 1 1 A 113 113 LYS N N 113 121.725 120.810 0.915 1
1 1358 . 17 1 1 A 114 114 LYS H H 114 8.225 7.013 1.212 1
1 1359 . 17 1 1 A 114 114 LYS HA H 114 4.169 4.452 -0.283 1
1 1368 . 17 1 1 A 114 114 LYS C C 114 176.198 176.132 0.066 1
1 1369 . 17 1 1 A 114 114 LYS CA C 114 56.413 54.693 1.720 1
1 1370 . 17 1 1 A 114 114 LYS CB C 114 32.725 30.269 2.456 1
1 1374 . 17 1 1 A 114 114 LYS N N 114 121.857 119.928 1.929 1
1 1375 . 17 1 1 A 115 115 TRP H H 115 8.078 7.713 0.365 1
1 1376 . 17 1 1 A 115 115 TRP HA H 115 4.709 4.588 0.121 1
1 1385 . 17 1 1 A 115 115 TRP C C 115 175.119 176.823 -1.704 1
1 1386 . 17 1 1 A 115 115 TRP CA C 115 56.856 57.919 -1.063 1
1 1387 . 17 1 1 A 115 115 TRP CB C 115 29.474 29.046 0.428 1
1 1393 . 17 1 1 A 115 115 TRP N N 115 122.068 123.314 -1.246 1
1 1 . 18 1 1 A 10 10 HIS HA H 10 4.616 4.748 -0.132 1
1 4 . 18 1 1 A 10 10 HIS C C 10 174.981 174.998 -0.017 1
1 5 . 18 1 1 A 10 10 HIS CA C 10 56.555 55.473 1.082 1
1 6 . 18 1 1 A 10 10 HIS CB C 10 30.231 31.405 -1.174 1
1 7 . 18 1 1 A 11 11 MET H H 11 8.103 8.617 -0.514 1
1 8 . 18 1 1 A 11 11 MET HA H 11 4.439 4.384 0.055 1
1 13 . 18 1 1 A 11 11 MET C C 11 175.888 175.430 0.458 1
1 14 . 18 1 1 A 11 11 MET CA C 11 55.090 55.515 -0.425 1
1 15 . 18 1 1 A 11 11 MET CB C 11 33.121 33.057 0.064 1
1 17 . 18 1 1 A 11 11 MET N N 11 120.743 119.544 1.199 1
1 18 . 18 1 1 A 12 12 LYS H H 12 8.065 7.819 0.246 1
1 19 . 18 1 1 A 12 12 LYS HA H 12 4.407 4.270 0.137 1
1 28 . 18 1 1 A 12 12 LYS CA C 12 54.894 54.752 0.142 1
1 29 . 18 1 1 A 12 12 LYS CB C 12 31.863 31.457 0.406 1
1 33 . 18 1 1 A 12 12 LYS N N 12 123.187 126.561 -3.374 1
1 34 . 18 1 1 A 13 13 PRO HA H 13 4.347 4.417 -0.070 1
1 41 . 18 1 1 A 13 13 PRO C C 13 176.891 177.125 -0.234 1
1 42 . 18 1 1 A 13 13 PRO CA C 13 62.542 62.327 0.215 1
1 43 . 18 1 1 A 13 13 PRO CB C 13 32.663 33.179 -0.516 1
1 46 . 18 1 1 A 14 14 LEU H H 14 8.339 8.710 -0.371 1
1 47 . 18 1 1 A 14 14 LEU HA H 14 3.373 3.763 -0.390 1
1 57 . 18 1 1 A 14 14 LEU C C 14 176.683 178.253 -1.570 1
1 58 . 18 1 1 A 14 14 LEU CA C 14 58.555 57.398 1.157 1
1 59 . 18 1 1 A 14 14 LEU CB C 14 41.828 40.965 0.863 1
1 63 . 18 1 1 A 14 14 LEU N N 14 123.191 123.407 -0.216 1
1 64 . 18 1 1 A 15 15 ALA H H 15 8.175 7.881 0.294 1
1 65 . 18 1 1 A 15 15 ALA HA H 15 3.983 4.079 -0.096 1
1 69 . 18 1 1 A 15 15 ALA C C 15 178.697 178.334 0.363 1
1 70 . 18 1 1 A 15 15 ALA CA C 15 54.164 54.508 -0.344 1
1 71 . 18 1 1 A 15 15 ALA CB C 15 18.771 18.030 0.741 1
1 72 . 18 1 1 A 15 15 ALA N N 15 113.594 119.609 -6.015 1
1 73 . 18 1 1 A 16 16 GLU H H 16 7.458 7.424 0.034 1
1 74 . 18 1 1 A 16 16 GLU HA H 16 4.266 4.238 0.028 1
1 79 . 18 1 1 A 16 16 GLU C C 16 176.510 176.962 -0.452 1
1 80 . 18 1 1 A 16 16 GLU CA C 16 55.196 57.758 -2.562 1
1 81 . 18 1 1 A 16 16 GLU CB C 16 30.907 30.252 0.655 1
1 83 . 18 1 1 A 16 16 GLU N N 16 113.348 115.369 -2.021 1
1 84 . 18 1 1 A 17 17 GLN H H 17 7.501 6.750 0.751 1
1 85 . 18 1 1 A 17 17 GLN HA H 17 3.683 3.900 -0.217 1
1 92 . 18 1 1 A 17 17 GLN C C 17 178.053 175.875 2.178 1
1 93 . 18 1 1 A 17 17 GLN CA C 17 54.606 55.415 -0.809 1
1 94 . 18 1 1 A 17 17 GLN CB C 17 25.758 28.227 -2.469 1
1 96 . 18 1 1 A 17 17 GLN N N 17 119.411 119.015 0.396 1
1 98 . 18 1 1 A 18 18 ASP H H 18 8.949 8.362 0.587 1
1 99 . 18 1 1 A 18 18 ASP HA H 18 4.184 4.072 0.112 1
1 102 . 18 1 1 A 18 18 ASP C C 18 175.263 178.053 -2.790 1
1 103 . 18 1 1 A 18 18 ASP CA C 18 57.275 57.044 0.231 1
1 104 . 18 1 1 A 18 18 ASP CB C 18 40.620 40.263 0.357 1
1 105 . 18 1 1 A 18 18 ASP N N 18 124.676 123.328 1.348 1
1 106 . 18 1 1 A 19 19 TRP H H 19 6.068 7.120 -1.052 1
1 107 . 18 1 1 A 19 19 TRP HA H 19 5.045 4.556 0.489 1
1 116 . 18 1 1 A 19 19 TRP C C 19 175.902 176.309 -0.407 1
1 117 . 18 1 1 A 19 19 TRP CA C 19 53.542 57.375 -3.833 1
1 118 . 18 1 1 A 19 19 TRP CB C 19 29.179 28.836 0.343 1
1 124 . 18 1 1 A 19 19 TRP N N 19 107.757 117.580 -9.823 1
1 126 . 18 1 1 A 20 20 TYR H H 20 7.430 7.551 -0.121 1
1 127 . 18 1 1 A 20 20 TYR HA H 20 5.601 5.443 0.158 1
1 132 . 18 1 1 A 20 20 TYR C C 20 175.498 174.380 1.118 1
1 133 . 18 1 1 A 20 20 TYR CA C 20 56.967 57.128 -0.161 1
1 134 . 18 1 1 A 20 20 TYR CB C 20 39.083 39.277 -0.194 1
1 137 . 18 1 1 A 20 20 TYR N N 20 123.173 122.469 0.704 1
1 138 . 18 1 1 A 21 21 HIS H H 21 8.934 8.717 0.217 1
1 139 . 18 1 1 A 21 21 HIS HA H 21 4.295 4.728 -0.433 1
1 144 . 18 1 1 A 21 21 HIS C C 21 175.177 175.181 -0.004 1
1 145 . 18 1 1 A 21 21 HIS CA C 21 56.572 53.549 3.023 1
1 146 . 18 1 1 A 21 21 HIS CB C 21 33.365 29.247 4.118 1
1 149 . 18 1 1 A 21 21 HIS N N 21 125.732 126.216 -0.484 1
1 150 . 18 1 1 A 22 22 GLY H H 22 5.280 8.076 -2.796 1
1 151 . 18 1 1 A 22 22 GLY HA2 H 22 3.905 3.683 0.222 1
1 152 . 18 1 1 A 22 22 GLY HA3 H 22 3.585 3.689 -0.104 1
1 153 . 18 1 1 A 22 22 GLY C C 22 174.411 174.052 0.359 1
1 154 . 18 1 1 A 22 22 GLY CA C 22 46.402 46.855 -0.453 1
1 155 . 18 1 1 A 22 22 GLY N N 22 104.568 109.888 -5.320 1
1 156 . 18 1 1 A 23 23 ALA H H 23 8.768 7.994 0.774 1
1 157 . 18 1 1 A 23 23 ALA HA H 23 5.171 4.144 1.027 1
1 161 . 18 1 1 A 23 23 ALA C C 23 177.180 176.772 0.408 1
1 162 . 18 1 1 A 23 23 ALA CA C 23 51.153 52.802 -1.649 1
1 163 . 18 1 1 A 23 23 ALA CB C 23 16.999 17.385 -0.386 1
1 164 . 18 1 1 A 23 23 ALA N N 23 130.297 115.363 14.934 1
1 165 . 18 1 1 A 24 24 ILE H H 24 7.267 7.525 -0.258 1
1 166 . 18 1 1 A 24 24 ILE HA H 24 4.460 4.425 0.035 1
1 176 . 18 1 1 A 24 24 ILE CA C 24 58.529 59.810 -1.281 1
1 177 . 18 1 1 A 24 24 ILE CB C 24 38.763 37.625 1.138 1
1 181 . 18 1 1 A 24 24 ILE N N 24 118.903 115.106 3.797 1
1 182 . 18 1 1 A 25 25 PRO HA H 25 4.224 4.594 -0.370 1
1 189 . 18 1 1 A 25 25 PRO C C 25 176.918 177.739 -0.821 1
1 190 . 18 1 1 A 25 25 PRO CA C 25 62.907 63.044 -0.137 1
1 191 . 18 1 1 A 25 25 PRO CB C 25 32.671 32.669 0.002 1
1 194 . 18 1 1 A 26 26 ARG H H 26 8.781 9.035 -0.254 1
1 195 . 18 1 1 A 26 26 ARG HA H 26 3.472 3.901 -0.429 1
1 202 . 18 1 1 A 26 26 ARG C C 26 178.112 178.010 0.102 1
1 203 . 18 1 1 A 26 26 ARG CA C 26 60.863 59.495 1.368 1
1 204 . 18 1 1 A 26 26 ARG CB C 26 30.314 29.867 0.447 1
1 207 . 18 1 1 A 26 26 ARG N N 26 124.635 123.554 1.081 1
1 208 . 18 1 1 A 27 27 ILE H H 27 8.540 8.133 0.407 1
1 209 . 18 1 1 A 27 27 ILE HA H 27 3.787 3.632 0.155 1
1 219 . 18 1 1 A 27 27 ILE C C 27 177.390 177.477 -0.087 1
1 220 . 18 1 1 A 27 27 ILE CA C 27 64.329 65.095 -0.766 1
1 221 . 18 1 1 A 27 27 ILE CB C 27 37.413 38.030 -0.617 1
1 225 . 18 1 1 A 27 27 ILE N N 27 115.859 120.232 -4.373 1
1 226 . 18 1 1 A 28 28 GLU H H 28 6.953 8.586 -1.633 1
1 227 . 18 1 1 A 28 28 GLU HA H 28 4.067 4.050 0.017 1
1 232 . 18 1 1 A 28 28 GLU C C 28 179.006 179.389 -0.383 1
1 233 . 18 1 1 A 28 28 GLU CA C 28 58.985 59.630 -0.645 1
1 234 . 18 1 1 A 28 28 GLU CB C 28 29.316 29.175 0.141 1
1 236 . 18 1 1 A 28 28 GLU N N 28 120.554 119.224 1.330 1
1 237 . 18 1 1 A 29 29 ALA H H 29 7.999 8.052 -0.053 1
1 238 . 18 1 1 A 29 29 ALA HA H 29 3.822 4.039 -0.217 1
1 242 . 18 1 1 A 29 29 ALA C C 29 178.809 180.007 -1.198 1
1 243 . 18 1 1 A 29 29 ALA CA C 29 54.698 54.919 -0.221 1
1 244 . 18 1 1 A 29 29 ALA CB C 29 18.059 18.338 -0.279 1
1 245 . 18 1 1 A 29 29 ALA N N 29 120.122 122.723 -2.601 1
1 246 . 18 1 1 A 30 30 GLN H H 30 8.168 7.848 0.320 1
1 247 . 18 1 1 A 30 30 GLN HA H 30 3.811 4.175 -0.364 1
1 254 . 18 1 1 A 30 30 GLN C C 30 177.578 177.794 -0.216 1
1 255 . 18 1 1 A 30 30 GLN CA C 30 59.731 58.542 1.189 1
1 256 . 18 1 1 A 30 30 GLN CB C 30 28.161 28.500 -0.339 1
1 258 . 18 1 1 A 30 30 GLN N N 30 112.109 115.770 -3.661 1
1 260 . 18 1 1 A 31 31 GLU H H 31 7.248 8.326 -1.078 1
1 261 . 18 1 1 A 31 31 GLU HA H 31 4.063 4.086 -0.023 1
1 266 . 18 1 1 A 31 31 GLU C C 31 177.423 178.983 -1.560 1
1 267 . 18 1 1 A 31 31 GLU CA C 31 57.650 59.197 -1.547 1
1 268 . 18 1 1 A 31 31 GLU CB C 31 29.757 29.257 0.500 1
1 270 . 18 1 1 A 31 31 GLU N N 31 115.340 119.475 -4.135 1
1 271 . 18 1 1 A 32 32 LEU H H 32 7.169 7.283 -0.114 1
1 272 . 18 1 1 A 32 32 LEU HA H 32 4.087 4.216 -0.129 1
1 282 . 18 1 1 A 32 32 LEU C C 32 175.850 177.122 -1.272 1
1 283 . 18 1 1 A 32 32 LEU CA C 32 55.580 56.904 -1.324 1
1 284 . 18 1 1 A 32 32 LEU CB C 32 42.910 41.524 1.386 1
1 288 . 18 1 1 A 32 32 LEU N N 32 116.367 113.714 2.653 1
1 289 . 18 1 1 A 33 33 LEU H H 33 7.062 7.606 -0.544 1
1 290 . 18 1 1 A 33 33 LEU HA H 33 4.431 4.057 0.374 1
1 300 . 18 1 1 A 33 33 LEU C C 33 174.837 176.906 -2.069 1
1 301 . 18 1 1 A 33 33 LEU CA C 33 53.521 55.339 -1.818 1
1 302 . 18 1 1 A 33 33 LEU CB C 33 43.301 42.094 1.207 1
1 306 . 18 1 1 A 33 33 LEU N N 33 118.568 122.397 -3.829 1
1 307 . 18 1 1 A 34 34 LYS H H 34 8.749 8.481 0.268 1
1 308 . 18 1 1 A 34 34 LYS HA H 34 4.162 4.081 0.081 1
1 317 . 18 1 1 A 34 34 LYS C C 34 174.378 175.076 -0.698 1
1 318 . 18 1 1 A 34 34 LYS CA C 34 56.575 56.210 0.365 1
1 319 . 18 1 1 A 34 34 LYS CB C 34 36.918 34.585 2.333 1
1 323 . 18 1 1 A 34 34 LYS N N 34 121.659 117.964 3.695 1
1 324 . 18 1 1 A 35 35 LYS H H 35 8.137 7.455 0.682 1
1 325 . 18 1 1 A 35 35 LYS HA H 35 4.011 4.957 -0.946 1
1 334 . 18 1 1 A 35 35 LYS C C 35 174.343 175.616 -1.273 1
1 335 . 18 1 1 A 35 35 LYS CA C 35 53.960 54.698 -0.738 1
1 336 . 18 1 1 A 35 35 LYS CB C 35 35.587 35.317 0.270 1
1 340 . 18 1 1 A 35 35 LYS N N 35 119.354 116.478 2.876 1
1 341 . 18 1 1 A 36 36 GLN H H 36 8.394 8.717 -0.323 1
1 342 . 18 1 1 A 36 36 GLN HA H 36 4.187 4.821 -0.634 1
1 349 . 18 1 1 A 36 36 GLN C C 36 177.012 176.673 0.339 1
1 350 . 18 1 1 A 36 36 GLN CA C 36 57.750 57.907 -0.157 1
1 351 . 18 1 1 A 36 36 GLN CB C 36 28.433 28.540 -0.107 1
1 353 . 18 1 1 A 36 36 GLN N N 36 120.248 122.466 -2.218 1
1 355 . 18 1 1 A 37 37 GLY H H 37 9.597 8.952 0.645 1
1 356 . 18 1 1 A 37 37 GLY HA2 H 37 4.486 4.109 0.377 1
1 357 . 18 1 1 A 37 37 GLY HA3 H 37 3.926 4.111 -0.185 1
1 358 . 18 1 1 A 37 37 GLY C C 37 176.285 174.526 1.759 1
1 359 . 18 1 1 A 37 37 GLY CA C 37 46.146 45.439 0.707 1
1 360 . 18 1 1 A 37 37 GLY N N 37 116.637 114.432 2.205 1
1 361 . 18 1 1 A 38 38 ASP H H 38 8.925 7.870 1.055 1
1 362 . 18 1 1 A 38 38 ASP HA H 38 5.697 4.677 1.020 1
1 365 . 18 1 1 A 38 38 ASP C C 38 176.181 175.765 0.416 1
1 366 . 18 1 1 A 38 38 ASP CA C 38 55.066 55.503 -0.437 1
1 367 . 18 1 1 A 38 38 ASP CB C 38 42.933 41.464 1.469 1
1 368 . 18 1 1 A 38 38 ASP N N 38 127.293 122.051 5.242 1
1 369 . 18 1 1 A 39 39 PHE H H 39 8.647 8.514 0.133 1
1 370 . 18 1 1 A 39 39 PHE HA H 39 6.025 6.030 -0.005 1
1 378 . 18 1 1 A 39 39 PHE C C 39 170.948 173.024 -2.076 1
1 379 . 18 1 1 A 39 39 PHE CA C 39 56.376 56.190 0.186 1
1 380 . 18 1 1 A 39 39 PHE CB C 39 44.583 43.020 1.563 1
1 386 . 18 1 1 A 39 39 PHE N N 39 117.102 119.206 -2.104 1
1 387 . 18 1 1 A 40 40 LEU H H 40 9.186 8.948 0.238 1
1 388 . 18 1 1 A 40 40 LEU HA H 40 4.983 5.385 -0.402 1
1 398 . 18 1 1 A 40 40 LEU C C 40 174.787 174.608 0.179 1
1 399 . 18 1 1 A 40 40 LEU CA C 40 54.610 53.683 0.927 1
1 400 . 18 1 1 A 40 40 LEU CB C 40 44.330 45.947 -1.617 1
1 404 . 18 1 1 A 40 40 LEU N N 40 114.388 117.936 -3.548 1
1 405 . 18 1 1 A 41 41 VAL H H 41 9.390 9.405 -0.015 1
1 406 . 18 1 1 A 41 41 VAL HA H 41 5.742 5.211 0.531 1
1 414 . 18 1 1 A 41 41 VAL C C 41 172.760 174.948 -2.188 1
1 415 . 18 1 1 A 41 41 VAL CA C 41 60.814 61.267 -0.453 1
1 416 . 18 1 1 A 41 41 VAL CB C 41 34.908 33.806 1.102 1
1 419 . 18 1 1 A 41 41 VAL N N 41 119.873 121.704 -1.831 1
1 420 . 18 1 1 A 42 42 ARG H H 42 9.598 9.220 0.378 1
1 421 . 18 1 1 A 42 42 ARG HA H 42 5.247 4.860 0.387 1
1 429 . 18 1 1 A 42 42 ARG C C 42 173.379 174.320 -0.941 1
1 430 . 18 1 1 A 42 42 ARG CA C 42 53.202 53.659 -0.457 1
1 431 . 18 1 1 A 42 42 ARG CB C 42 33.507 34.053 -0.546 1
1 434 . 18 1 1 A 42 42 ARG N N 42 124.179 124.537 -0.358 1
1 436 . 18 1 1 A 43 43 GLU H H 43 8.234 8.579 -0.345 1
1 437 . 18 1 1 A 43 43 GLU HA H 43 4.890 4.434 0.456 1
1 442 . 18 1 1 A 43 43 GLU C C 43 176.929 176.375 0.554 1
1 443 . 18 1 1 A 43 43 GLU CA C 43 54.846 55.471 -0.625 1
1 444 . 18 1 1 A 43 43 GLU CB C 43 31.599 30.987 0.612 1
1 446 . 18 1 1 A 43 43 GLU N N 43 124.103 122.910 1.193 1
1 447 . 18 1 1 A 44 44 SER H H 44 9.033 8.674 0.359 1
1 448 . 18 1 1 A 44 44 SER HA H 44 3.957 4.473 -0.516 1
1 451 . 18 1 1 A 44 44 SER C C 44 175.005 174.719 0.286 1
1 452 . 18 1 1 A 44 44 SER CA C 44 59.393 57.811 1.582 1
1 453 . 18 1 1 A 44 44 SER CB C 44 63.619 63.794 -0.175 1
1 454 . 18 1 1 A 44 44 SER N N 44 124.316 120.616 3.700 1
1 455 . 18 1 1 A 45 45 HIS H H 45 8.461 8.820 -0.359 1
1 456 . 18 1 1 A 45 45 HIS HA H 45 4.132 4.198 -0.066 1
1 460 . 18 1 1 A 45 45 HIS C C 45 176.480 177.987 -1.507 1
1 461 . 18 1 1 A 45 45 HIS CA C 45 58.887 59.412 -0.525 1
1 462 . 18 1 1 A 45 45 HIS CB C 45 30.180 30.547 -0.367 1
1 464 . 18 1 1 A 45 45 HIS N N 45 127.694 126.727 0.967 1
1 465 . 18 1 1 A 46 46 GLY H H 46 8.513 8.290 0.223 1
1 466 . 18 1 1 A 46 46 GLY HA2 H 46 3.827 3.948 -0.121 1
1 467 . 18 1 1 A 46 46 GLY HA3 H 46 3.827 3.954 -0.127 1
1 468 . 18 1 1 A 46 46 GLY C C 46 173.630 174.441 -0.811 1
1 469 . 18 1 1 A 46 46 GLY CA C 46 45.188 46.724 -1.536 1
1 470 . 18 1 1 A 46 46 GLY N N 46 110.761 106.586 4.175 1
1 471 . 18 1 1 A 47 47 LYS H H 47 7.216 7.461 -0.245 1
1 472 . 18 1 1 A 47 47 LYS HA H 47 4.540 4.766 -0.226 1
1 481 . 18 1 1 A 47 47 LYS CA C 47 53.475 52.818 0.657 1
1 482 . 18 1 1 A 47 47 LYS CB C 47 33.325 34.029 -0.704 1
1 486 . 18 1 1 A 47 47 LYS N N 47 121.356 120.688 0.668 1
1 487 . 18 1 1 A 48 48 PRO HA H 48 4.181 4.258 -0.077 1
1 494 . 18 1 1 A 48 48 PRO C C 48 178.920 177.474 1.446 1
1 495 . 18 1 1 A 48 48 PRO CA C 48 63.239 63.756 -0.517 1
1 496 . 18 1 1 A 48 48 PRO CB C 48 31.523 31.282 0.241 1
1 499 . 18 1 1 A 49 49 GLY H H 49 9.752 8.779 0.973 1
1 500 . 18 1 1 A 49 49 GLY HA2 H 49 4.053 3.965 0.088 1
1 501 . 18 1 1 A 49 49 GLY HA3 H 49 3.374 3.970 -0.596 1
1 502 . 18 1 1 A 49 49 GLY C C 49 172.093 174.268 -2.175 1
1 503 . 18 1 1 A 49 49 GLY CA C 49 45.041 45.081 -0.040 1
1 504 . 18 1 1 A 49 49 GLY N N 49 112.415 112.882 -0.467 1
1 505 . 18 1 1 A 50 50 GLU H H 50 7.623 7.739 -0.116 1
1 506 . 18 1 1 A 50 50 GLU HA H 50 4.537 4.630 -0.093 1
1 511 . 18 1 1 A 50 50 GLU C C 50 173.297 175.366 -2.069 1
1 512 . 18 1 1 A 50 50 GLU CA C 50 55.174 55.767 -0.593 1
1 513 . 18 1 1 A 50 50 GLU CB C 50 31.651 30.548 1.103 1
1 515 . 18 1 1 A 50 50 GLU N N 50 121.600 121.816 -0.216 1
1 516 . 18 1 1 A 51 51 TYR H H 51 9.452 9.183 0.269 1
1 517 . 18 1 1 A 51 51 TYR HA H 51 5.382 5.289 0.093 1
1 524 . 18 1 1 A 51 51 TYR C C 51 174.387 175.448 -1.061 1
1 525 . 18 1 1 A 51 51 TYR CA C 51 57.592 57.177 0.415 1
1 526 . 18 1 1 A 51 51 TYR CB C 51 41.820 40.697 1.123 1
1 531 . 18 1 1 A 51 51 TYR N N 51 125.790 127.090 -1.300 1
1 532 . 18 1 1 A 52 52 VAL H H 52 9.471 9.462 0.009 1
1 533 . 18 1 1 A 52 52 VAL HA H 52 4.840 4.946 -0.106 1
1 541 . 18 1 1 A 52 52 VAL C C 52 174.947 174.696 0.251 1
1 542 . 18 1 1 A 52 52 VAL CA C 52 60.991 61.114 -0.123 1
1 543 . 18 1 1 A 52 52 VAL CB C 52 36.829 34.729 2.100 1
1 546 . 18 1 1 A 52 52 VAL N N 52 120.617 122.493 -1.876 1
1 547 . 18 1 1 A 53 53 LEU H H 53 9.457 9.217 0.240 1
1 548 . 18 1 1 A 53 53 LEU HA H 53 5.294 5.166 0.128 1
1 558 . 18 1 1 A 53 53 LEU C C 53 175.024 174.933 0.091 1
1 559 . 18 1 1 A 53 53 LEU CA C 53 53.904 54.863 -0.959 1
1 560 . 18 1 1 A 53 53 LEU CB C 53 44.756 44.271 0.485 1
1 564 . 18 1 1 A 53 53 LEU N N 53 127.725 131.331 -3.606 1
1 565 . 18 1 1 A 54 54 SER H H 54 9.461 9.367 0.094 1
1 566 . 18 1 1 A 54 54 SER HA H 54 5.691 5.334 0.357 1
1 569 . 18 1 1 A 54 54 SER C C 54 172.227 173.021 -0.794 1
1 570 . 18 1 1 A 54 54 SER CA C 54 58.551 57.731 0.820 1
1 571 . 18 1 1 A 54 54 SER CB C 54 65.738 65.348 0.390 1
1 572 . 18 1 1 A 54 54 SER N N 54 127.178 124.007 3.171 1
1 573 . 18 1 1 A 55 55 VAL H H 55 9.049 9.196 -0.147 1
1 574 . 18 1 1 A 55 55 VAL HA H 55 5.691 5.594 0.097 1
1 582 . 18 1 1 A 55 55 VAL C C 55 173.959 172.965 0.994 1
1 583 . 18 1 1 A 55 55 VAL CA C 55 58.398 59.531 -1.133 1
1 584 . 18 1 1 A 55 55 VAL CB C 55 36.262 35.314 0.948 1
1 587 . 18 1 1 A 55 55 VAL N N 55 120.619 126.176 -5.557 1
1 588 . 18 1 1 A 56 56 TYR H H 56 8.629 9.233 -0.604 1
1 589 . 18 1 1 A 56 56 TYR HA H 56 4.951 5.307 -0.356 1
1 596 . 18 1 1 A 56 56 TYR C C 56 175.224 174.662 0.562 1
1 597 . 18 1 1 A 56 56 TYR CA C 56 56.684 56.182 0.502 1
1 598 . 18 1 1 A 56 56 TYR CB C 56 39.646 41.058 -1.412 1
1 603 . 18 1 1 A 56 56 TYR N N 56 127.444 129.843 -2.399 1
1 604 . 18 1 1 A 57 57 SER H H 57 8.869 8.808 0.061 1
1 605 . 18 1 1 A 57 57 SER HA H 57 4.739 4.808 -0.069 1
1 608 . 18 1 1 A 57 57 SER C C 57 174.492 173.362 1.130 1
1 609 . 18 1 1 A 57 57 SER CA C 57 57.591 57.300 0.291 1
1 610 . 18 1 1 A 57 57 SER CB C 57 64.281 66.358 -2.077 1
1 611 . 18 1 1 A 57 57 SER N N 57 122.165 123.103 -0.938 1
1 612 . 18 1 1 A 58 58 ASP H H 58 10.446 9.421 1.025 1
1 613 . 18 1 1 A 58 58 ASP HA H 58 4.382 4.256 0.126 1
1 616 . 18 1 1 A 58 58 ASP C C 58 176.398 175.238 1.160 1
1 617 . 18 1 1 A 58 58 ASP CA C 58 55.215 54.960 0.255 1
1 618 . 18 1 1 A 58 58 ASP CB C 58 39.513 39.704 -0.191 1
1 619 . 18 1 1 A 58 58 ASP N N 58 132.098 127.788 4.310 1
1 620 . 18 1 1 A 59 59 GLY H H 59 7.861 8.325 -0.464 1
1 621 . 18 1 1 A 59 59 GLY HA2 H 59 3.817 3.725 0.092 1
1 622 . 18 1 1 A 59 59 GLY HA3 H 59 4.086 3.777 0.309 1
1 623 . 18 1 1 A 59 59 GLY C C 59 173.111 173.525 -0.414 1
1 624 . 18 1 1 A 59 59 GLY CA C 59 45.486 45.236 0.250 1
1 625 . 18 1 1 A 59 59 GLY N N 59 102.674 104.048 -1.374 1
1 626 . 18 1 1 A 60 60 GLN H H 60 7.137 7.633 -0.496 1
1 627 . 18 1 1 A 60 60 GLN HA H 60 4.455 4.382 0.073 1
1 634 . 18 1 1 A 60 60 GLN C C 60 173.549 175.126 -1.577 1
1 635 . 18 1 1 A 60 60 GLN CA C 60 53.388 54.529 -1.141 1
1 636 . 18 1 1 A 60 60 GLN CB C 60 32.373 30.144 2.229 1
1 638 . 18 1 1 A 60 60 GLN N N 60 116.206 119.577 -3.371 1
1 640 . 18 1 1 A 61 61 ARG H H 61 8.589 8.376 0.213 1
1 641 . 18 1 1 A 61 61 ARG HA H 61 4.740 4.477 0.263 1
1 649 . 18 1 1 A 61 61 ARG C C 61 174.458 174.658 -0.200 1
1 650 . 18 1 1 A 61 61 ARG CA C 61 57.116 55.302 1.814 1
1 651 . 18 1 1 A 61 61 ARG CB C 61 29.615 30.602 -0.987 1
1 654 . 18 1 1 A 61 61 ARG N N 61 120.467 122.096 -1.629 1
1 656 . 18 1 1 A 62 62 ARG H H 62 8.867 8.854 0.013 1
1 657 . 18 1 1 A 62 62 ARG HA H 62 4.297 4.372 -0.075 1
1 665 . 18 1 1 A 62 62 ARG C C 62 173.485 175.278 -1.793 1
1 666 . 18 1 1 A 62 62 ARG CA C 62 53.355 55.057 -1.702 1
1 667 . 18 1 1 A 62 62 ARG CB C 62 33.028 30.872 2.156 1
1 670 . 18 1 1 A 62 62 ARG N N 62 122.641 124.275 -1.634 1
1 672 . 18 1 1 A 63 63 HIS H H 63 7.997 8.694 -0.697 1
1 673 . 18 1 1 A 63 63 HIS HA H 63 5.427 5.630 -0.203 1
1 678 . 18 1 1 A 63 63 HIS C C 63 174.946 173.919 1.027 1
1 679 . 18 1 1 A 63 63 HIS CA C 63 54.689 53.582 1.107 1
1 680 . 18 1 1 A 63 63 HIS CB C 63 33.008 32.532 0.476 1
1 683 . 18 1 1 A 63 63 HIS N N 63 119.064 120.823 -1.759 1
1 684 . 18 1 1 A 64 64 PHE H H 64 9.880 9.287 0.593 1
1 685 . 18 1 1 A 64 64 PHE HA H 64 4.824 5.090 -0.266 1
1 693 . 18 1 1 A 64 64 PHE C C 64 174.882 175.279 -0.397 1
1 694 . 18 1 1 A 64 64 PHE CA C 64 56.489 56.603 -0.114 1
1 695 . 18 1 1 A 64 64 PHE CB C 64 41.405 40.529 0.876 1
1 701 . 18 1 1 A 64 64 PHE N N 64 123.961 121.844 2.117 1
1 702 . 18 1 1 A 65 65 ILE H H 65 8.982 9.016 -0.034 1
1 703 . 18 1 1 A 65 65 ILE HA H 65 4.273 4.519 -0.246 1
1 713 . 18 1 1 A 65 65 ILE C C 65 176.556 176.041 0.515 1
1 714 . 18 1 1 A 65 65 ILE CA C 65 62.649 61.764 0.885 1
1 715 . 18 1 1 A 65 65 ILE CB C 65 38.296 37.800 0.496 1
1 719 . 18 1 1 A 65 65 ILE N N 65 126.601 125.292 1.309 1
1 720 . 18 1 1 A 66 66 ILE H H 66 8.947 9.204 -0.257 1
1 721 . 18 1 1 A 66 66 ILE HA H 66 3.780 4.550 -0.770 1
1 731 . 18 1 1 A 66 66 ILE C C 66 175.721 175.493 0.228 1
1 732 . 18 1 1 A 66 66 ILE CA C 66 62.960 60.914 2.046 1
1 733 . 18 1 1 A 66 66 ILE CB C 66 37.209 37.971 -0.762 1
1 737 . 18 1 1 A 66 66 ILE N N 66 130.139 129.424 0.715 1
1 738 . 18 1 1 A 67 67 GLN H H 67 8.410 9.086 -0.676 1
1 739 . 18 1 1 A 67 67 GLN HA H 67 4.422 4.923 -0.501 1
1 746 . 18 1 1 A 67 67 GLN C C 67 174.347 173.771 0.576 1
1 747 . 18 1 1 A 67 67 GLN CA C 67 55.867 54.773 1.094 1
1 748 . 18 1 1 A 67 67 GLN CB C 67 29.950 30.458 -0.508 1
1 750 . 18 1 1 A 67 67 GLN N N 67 128.872 127.580 1.292 1
1 752 . 18 1 1 A 68 68 TYR H H 68 8.619 9.084 -0.465 1
1 753 . 18 1 1 A 68 68 TYR HA H 68 5.300 4.647 0.653 1
1 760 . 18 1 1 A 68 68 TYR C C 68 174.695 174.258 0.437 1
1 761 . 18 1 1 A 68 68 TYR CA C 68 55.579 56.380 -0.801 1
1 762 . 18 1 1 A 68 68 TYR CB C 68 39.479 38.624 0.855 1
1 767 . 18 1 1 A 68 68 TYR N N 68 124.772 126.235 -1.463 1
1 768 . 18 1 1 A 69 69 VAL H H 69 8.539 8.675 -0.136 1
1 769 . 18 1 1 A 69 69 VAL HA H 69 4.046 4.337 -0.291 1
1 777 . 18 1 1 A 69 69 VAL C C 69 175.010 175.059 -0.049 1
1 778 . 18 1 1 A 69 69 VAL CA C 69 60.611 60.596 0.015 1
1 779 . 18 1 1 A 69 69 VAL CB C 69 35.358 34.368 0.990 1
1 782 . 18 1 1 A 69 69 VAL N N 69 126.652 126.852 -0.200 1
1 783 . 18 1 1 A 70 70 ASP H H 70 9.089 9.224 -0.135 1
1 784 . 18 1 1 A 70 70 ASP HA H 70 4.025 4.207 -0.182 1
1 787 . 18 1 1 A 70 70 ASP C C 70 174.813 175.120 -0.307 1
1 788 . 18 1 1 A 70 70 ASP CA C 70 55.623 55.471 0.152 1
1 789 . 18 1 1 A 70 70 ASP CB C 70 39.081 39.241 -0.160 1
1 790 . 18 1 1 A 70 70 ASP N N 70 128.327 127.996 0.331 1
1 791 . 18 1 1 A 71 71 ASN H H 71 8.128 8.101 0.027 1
1 792 . 18 1 1 A 71 71 ASN HA H 71 3.597 3.869 -0.272 1
1 797 . 18 1 1 A 71 71 ASN C C 71 173.250 173.921 -0.671 1
1 798 . 18 1 1 A 71 71 ASN CA C 71 54.728 54.461 0.267 1
1 799 . 18 1 1 A 71 71 ASN CB C 71 37.601 37.014 0.587 1
1 800 . 18 1 1 A 71 71 ASN N N 71 107.230 107.960 -0.730 1
1 802 . 18 1 1 A 72 72 MET H H 72 7.256 7.693 -0.437 1
1 803 . 18 1 1 A 72 72 MET HA H 72 4.740 4.967 -0.227 1
1 808 . 18 1 1 A 72 72 MET C C 72 173.780 174.647 -0.867 1
1 809 . 18 1 1 A 72 72 MET CA C 72 53.703 54.062 -0.359 1
1 810 . 18 1 1 A 72 72 MET CB C 72 36.570 35.229 1.341 1
1 812 . 18 1 1 A 72 72 MET N N 72 117.117 117.741 -0.624 1
1 813 . 18 1 1 A 73 73 TYR H H 73 9.430 9.339 0.091 1
1 814 . 18 1 1 A 73 73 TYR HA H 73 5.718 5.050 0.668 1
1 821 . 18 1 1 A 73 73 TYR C C 73 176.140 175.984 0.156 1
1 822 . 18 1 1 A 73 73 TYR CA C 73 57.290 57.887 -0.597 1
1 823 . 18 1 1 A 73 73 TYR CB C 73 40.013 39.059 0.954 1
1 828 . 18 1 1 A 73 73 TYR N N 73 119.856 123.037 -3.181 1
1 829 . 18 1 1 A 74 74 ARG H H 74 9.038 8.713 0.325 1
1 830 . 18 1 1 A 74 74 ARG HA H 74 4.867 5.002 -0.135 1
1 838 . 18 1 1 A 74 74 ARG C C 74 173.954 175.503 -1.549 1
1 839 . 18 1 1 A 74 74 ARG CA C 74 54.887 54.329 0.558 1
1 840 . 18 1 1 A 74 74 ARG CB C 74 34.484 33.865 0.619 1
1 843 . 18 1 1 A 74 74 ARG N N 74 117.344 122.649 -5.305 1
1 845 . 18 1 1 A 75 75 PHE H H 75 9.005 8.964 0.041 1
1 846 . 18 1 1 A 75 75 PHE HA H 75 5.046 4.611 0.435 1
1 854 . 18 1 1 A 75 75 PHE C C 75 176.186 175.995 0.191 1
1 855 . 18 1 1 A 75 75 PHE CA C 75 59.658 59.471 0.187 1
1 856 . 18 1 1 A 75 75 PHE CB C 75 39.356 40.508 -1.152 1
1 862 . 18 1 1 A 75 75 PHE N N 75 117.865 121.302 -3.437 1
1 863 . 18 1 1 A 76 76 GLU H H 76 8.213 8.482 -0.269 1
1 864 . 18 1 1 A 76 76 GLU HA H 76 4.586 4.805 -0.219 1
1 869 . 18 1 1 A 76 76 GLU C C 76 175.238 177.812 -2.574 1
1 870 . 18 1 1 A 76 76 GLU CA C 76 55.994 57.880 -1.886 1
1 871 . 18 1 1 A 76 76 GLU CB C 76 31.805 32.072 -0.267 1
1 873 . 18 1 1 A 76 76 GLU N N 76 116.834 118.045 -1.211 1
1 874 . 18 1 1 A 77 77 GLY H H 77 8.692 7.931 0.761 1
1 875 . 18 1 1 A 77 77 GLY HA2 H 77 4.166 4.114 0.052 1
1 876 . 18 1 1 A 77 77 GLY HA3 H 77 4.015 4.117 -0.102 1
1 877 . 18 1 1 A 77 77 GLY C C 77 173.784 175.081 -1.297 1
1 878 . 18 1 1 A 77 77 GLY CA C 77 45.505 46.291 -0.786 1
1 879 . 18 1 1 A 77 77 GLY N N 77 111.937 107.083 4.854 1
1 880 . 18 1 1 A 78 78 THR H H 78 8.332 7.834 0.498 1
1 881 . 18 1 1 A 78 78 THR HA H 78 3.900 4.203 -0.303 1
1 886 . 18 1 1 A 78 78 THR C C 78 173.591 174.309 -0.718 1
1 887 . 18 1 1 A 78 78 THR CA C 78 63.653 63.694 -0.041 1
1 888 . 18 1 1 A 78 78 THR CB C 78 69.649 69.207 0.442 1
1 890 . 18 1 1 A 78 78 THR N N 78 120.765 114.489 6.276 1
1 891 . 18 1 1 A 79 79 GLY H H 79 8.038 8.566 -0.528 1
1 892 . 18 1 1 A 79 79 GLY HA2 H 79 4.748 4.407 0.341 1
1 893 . 18 1 1 A 79 79 GLY HA3 H 79 3.546 4.542 -0.996 1
1 894 . 18 1 1 A 79 79 GLY C C 79 172.580 172.297 0.283 1
1 895 . 18 1 1 A 79 79 GLY CA C 79 44.661 44.333 0.328 1
1 896 . 18 1 1 A 79 79 GLY N N 79 109.887 113.756 -3.869 1
1 897 . 18 1 1 A 80 80 PHE H H 80 9.064 8.948 0.116 1
1 898 . 18 1 1 A 80 80 PHE HA H 80 4.886 4.909 -0.023 1
1 906 . 18 1 1 A 80 80 PHE C C 80 176.507 176.281 0.226 1
1 907 . 18 1 1 A 80 80 PHE CA C 80 57.257 56.739 0.518 1
1 908 . 18 1 1 A 80 80 PHE CB C 80 44.655 42.655 2.000 1
1 914 . 18 1 1 A 80 80 PHE N N 80 116.862 119.970 -3.108 1
1 915 . 18 1 1 A 81 81 SER H H 81 9.413 8.744 0.669 1
1 916 . 18 1 1 A 81 81 SER HA H 81 4.622 4.387 0.235 1
1 919 . 18 1 1 A 81 81 SER C C 81 173.735 174.950 -1.215 1
1 920 . 18 1 1 A 81 81 SER CA C 81 61.410 62.039 -0.629 1
1 921 . 18 1 1 A 81 81 SER CB C 81 64.165 63.251 0.914 1
1 922 . 18 1 1 A 81 81 SER N N 81 116.467 116.314 0.153 1
1 923 . 18 1 1 A 82 82 ASN H H 82 7.688 8.121 -0.433 1
1 924 . 18 1 1 A 82 82 ASN HA H 82 4.952 5.335 -0.383 1
1 929 . 18 1 1 A 82 82 ASN C C 82 173.303 175.544 -2.241 1
1 930 . 18 1 1 A 82 82 ASN CA C 82 52.086 52.174 -0.088 1
1 931 . 18 1 1 A 82 82 ASN CB C 82 41.258 41.971 -0.713 1
1 932 . 18 1 1 A 82 82 ASN N N 82 113.355 116.685 -3.330 1
1 934 . 18 1 1 A 83 83 ILE H H 83 8.858 8.755 0.103 1
1 935 . 18 1 1 A 83 83 ILE HA H 83 3.571 3.678 -0.107 1
1 945 . 18 1 1 A 83 83 ILE CA C 83 66.416 65.349 1.067 1
1 946 . 18 1 1 A 83 83 ILE CB C 83 35.074 34.761 0.313 1
1 950 . 18 1 1 A 83 83 ILE N N 83 118.908 123.022 -4.114 1
1 951 . 18 1 1 A 84 84 PRO HA H 84 4.411 4.712 -0.301 1
1 958 . 18 1 1 A 84 84 PRO C C 84 177.616 179.570 -1.954 1
1 959 . 18 1 1 A 84 84 PRO CA C 84 67.525 66.644 0.881 1
1 960 . 18 1 1 A 84 84 PRO CB C 84 31.029 30.881 0.148 1
1 963 . 18 1 1 A 85 85 GLN H H 85 8.405 8.210 0.195 1
1 964 . 18 1 1 A 85 85 GLN HA H 85 3.874 4.069 -0.195 1
1 971 . 18 1 1 A 85 85 GLN C C 85 178.213 178.225 -0.012 1
1 972 . 18 1 1 A 85 85 GLN CA C 85 59.495 58.918 0.577 1
1 973 . 18 1 1 A 85 85 GLN CB C 85 29.270 28.262 1.008 1
1 975 . 18 1 1 A 85 85 GLN N N 85 115.597 117.352 -1.755 1
1 977 . 18 1 1 A 86 86 LEU H H 86 7.136 8.210 -1.074 1
1 978 . 18 1 1 A 86 86 LEU HA H 86 3.589 3.234 0.355 1
1 988 . 18 1 1 A 86 86 LEU C C 86 177.728 178.374 -0.646 1
1 989 . 18 1 1 A 86 86 LEU CA C 86 58.136 58.163 -0.027 1
1 990 . 18 1 1 A 86 86 LEU CB C 86 42.290 41.668 0.622 1
1 994 . 18 1 1 A 86 86 LEU N N 86 121.840 121.759 0.081 1
1 995 . 18 1 1 A 87 87 ILE H H 87 8.323 8.016 0.307 1
1 996 . 18 1 1 A 87 87 ILE HA H 87 3.415 3.292 0.123 1
1 1006 . 18 1 1 A 87 87 ILE C C 87 178.064 177.726 0.338 1
1 1007 . 18 1 1 A 87 87 ILE CA C 87 61.458 65.296 -3.838 1
1 1008 . 18 1 1 A 87 87 ILE CB C 87 34.561 37.526 -2.965 1
1 1012 . 18 1 1 A 87 87 ILE N N 87 118.117 119.544 -1.427 1
1 1013 . 18 1 1 A 88 88 ASP H H 88 8.805 8.480 0.325 1
1 1014 . 18 1 1 A 88 88 ASP HA H 88 4.548 4.296 0.252 1
1 1017 . 18 1 1 A 88 88 ASP C C 88 179.265 178.150 1.115 1
1 1018 . 18 1 1 A 88 88 ASP CA C 88 58.099 57.389 0.710 1
1 1019 . 18 1 1 A 88 88 ASP CB C 88 42.166 41.897 0.269 1
1 1020 . 18 1 1 A 88 88 ASP N N 88 119.143 120.425 -1.282 1
1 1021 . 18 1 1 A 89 89 HIS H H 89 8.113 8.090 0.023 1
1 1022 . 18 1 1 A 89 89 HIS HA H 89 4.225 4.360 -0.135 1
1 1026 . 18 1 1 A 89 89 HIS C C 89 179.261 177.224 2.037 1
1 1027 . 18 1 1 A 89 89 HIS CA C 89 60.647 58.994 1.653 1
1 1028 . 18 1 1 A 89 89 HIS CB C 89 30.801 29.425 1.376 1
1 1030 . 18 1 1 A 89 89 HIS N N 89 119.595 119.261 0.334 1
1 1031 . 18 1 1 A 90 90 HIS H H 90 7.685 7.809 -0.124 1
1 1032 . 18 1 1 A 90 90 HIS HA H 90 3.628 4.054 -0.426 1
1 1036 . 18 1 1 A 90 90 HIS C C 90 178.454 177.584 0.870 1
1 1037 . 18 1 1 A 90 90 HIS CA C 90 61.797 60.212 1.585 1
1 1038 . 18 1 1 A 90 90 HIS CB C 90 28.165 30.021 -1.856 1
1 1040 . 18 1 1 A 90 90 HIS N N 90 120.061 117.396 2.665 1
1 1041 . 18 1 1 A 91 91 TYR H H 91 9.394 8.194 1.200 1
1 1042 . 18 1 1 A 91 91 TYR HA H 91 4.238 3.912 0.326 1
1 1049 . 18 1 1 A 91 91 TYR C C 91 176.443 177.750 -1.307 1
1 1050 . 18 1 1 A 91 91 TYR CA C 91 60.669 61.809 -1.140 1
1 1051 . 18 1 1 A 91 91 TYR CB C 91 39.169 39.122 0.047 1
1 1056 . 18 1 1 A 91 91 TYR N N 91 123.532 119.968 3.564 1
1 1057 . 18 1 1 A 92 92 THR H H 92 8.774 8.557 0.217 1
1 1058 . 18 1 1 A 92 92 THR HA H 92 3.866 4.116 -0.250 1
1 1063 . 18 1 1 A 92 92 THR C C 92 177.050 176.241 0.809 1
1 1064 . 18 1 1 A 92 92 THR CA C 92 65.240 65.610 -0.370 1
1 1065 . 18 1 1 A 92 92 THR CB C 92 69.298 68.105 1.193 1
1 1067 . 18 1 1 A 92 92 THR N N 92 112.000 112.922 -0.922 1
1 1068 . 18 1 1 A 93 93 THR H H 93 7.617 7.514 0.103 1
1 1069 . 18 1 1 A 93 93 THR HA H 93 4.133 4.179 -0.046 1
1 1074 . 18 1 1 A 93 93 THR C C 93 176.234 174.930 1.304 1
1 1075 . 18 1 1 A 93 93 THR CA C 93 63.527 62.301 1.226 1
1 1076 . 18 1 1 A 93 93 THR CB C 93 71.234 69.787 1.447 1
1 1078 . 18 1 1 A 93 93 THR N N 93 109.883 111.943 -2.060 1
1 1079 . 18 1 1 A 94 94 LYS H H 94 7.210 7.726 -0.516 1
1 1080 . 18 1 1 A 94 94 LYS HA H 94 3.830 3.752 0.078 1
1 1089 . 18 1 1 A 94 94 LYS C C 94 174.331 175.014 -0.683 1
1 1090 . 18 1 1 A 94 94 LYS CA C 94 56.776 57.400 -0.624 1
1 1091 . 18 1 1 A 94 94 LYS CB C 94 28.095 31.061 -2.966 1
1 1095 . 18 1 1 A 94 94 LYS N N 94 112.818 121.412 -8.594 1
1 1096 . 18 1 1 A 95 95 GLN H H 95 7.439 7.498 -0.059 1
1 1097 . 18 1 1 A 95 95 GLN HA H 95 4.216 4.652 -0.436 1
1 1104 . 18 1 1 A 95 95 GLN C C 95 179.087 175.981 3.106 1
1 1105 . 18 1 1 A 95 95 GLN CA C 95 56.378 54.455 1.923 1
1 1106 . 18 1 1 A 95 95 GLN CB C 95 28.542 30.142 -1.600 1
1 1108 . 18 1 1 A 95 95 GLN N N 95 117.860 118.934 -1.074 1
1 1110 . 18 1 1 A 96 96 VAL H H 96 8.520 8.555 -0.035 1
1 1111 . 18 1 1 A 96 96 VAL HA H 96 4.297 4.428 -0.131 1
1 1119 . 18 1 1 A 96 96 VAL C C 96 177.329 176.921 0.408 1
1 1120 . 18 1 1 A 96 96 VAL CA C 96 61.196 61.894 -0.698 1
1 1121 . 18 1 1 A 96 96 VAL CB C 96 32.735 33.313 -0.578 1
1 1124 . 18 1 1 A 96 96 VAL N N 96 124.208 119.566 4.642 1
1 1125 . 18 1 1 A 97 97 ILE H H 97 8.491 8.392 0.099 1
1 1126 . 18 1 1 A 97 97 ILE HA H 97 2.995 3.366 -0.371 1
1 1136 . 18 1 1 A 97 97 ILE CA C 97 62.066 63.481 -1.415 1
1 1137 . 18 1 1 A 97 97 ILE CB C 97 36.117 37.577 -1.460 1
1 1141 . 18 1 1 A 97 97 ILE N N 97 119.561 124.177 -4.616 1
1 1142 . 18 1 1 A 98 98 THR HA H 98 4.460 4.660 -0.200 1
1 1147 . 18 1 1 A 98 98 THR C C 98 174.335 174.654 -0.319 1
1 1148 . 18 1 1 A 98 98 THR CA C 98 58.244 59.239 -0.995 1
1 1149 . 18 1 1 A 98 98 THR CB C 98 73.056 72.441 0.615 1
1 1151 . 18 1 1 A 99 99 LYS H H 99 9.761 8.910 0.851 1
1 1152 . 18 1 1 A 99 99 LYS HA H 99 3.911 4.078 -0.167 1
1 1161 . 18 1 1 A 99 99 LYS C C 99 179.594 178.241 1.353 1
1 1162 . 18 1 1 A 99 99 LYS CA C 99 59.661 58.399 1.262 1
1 1163 . 18 1 1 A 99 99 LYS CB C 99 31.978 32.112 -0.134 1
1 1167 . 18 1 1 A 99 99 LYS N N 99 125.750 121.505 4.245 1
1 1168 . 18 1 1 A 100 100 LYS H H 100 8.910 7.857 1.053 1
1 1169 . 18 1 1 A 100 100 LYS HA H 100 4.024 4.219 -0.195 1
1 1178 . 18 1 1 A 100 100 LYS C C 100 178.060 177.613 0.447 1
1 1179 . 18 1 1 A 100 100 LYS CA C 100 58.642 58.520 0.122 1
1 1180 . 18 1 1 A 100 100 LYS CB C 100 32.750 32.340 0.410 1
1 1184 . 18 1 1 A 100 100 LYS N N 100 117.112 119.097 -1.985 1
1 1185 . 18 1 1 A 101 101 SER H H 101 7.721 7.692 0.029 1
1 1186 . 18 1 1 A 101 101 SER HA H 101 4.282 4.693 -0.411 1
1 1189 . 18 1 1 A 101 101 SER C C 101 176.403 176.065 0.338 1
1 1190 . 18 1 1 A 101 101 SER CA C 101 60.442 58.772 1.670 1
1 1191 . 18 1 1 A 101 101 SER CB C 101 63.775 65.489 -1.714 1
1 1192 . 18 1 1 A 101 101 SER N N 101 112.069 111.268 0.801 1
1 1193 . 18 1 1 A 102 102 GLY H H 102 8.038 8.400 -0.362 1
1 1194 . 18 1 1 A 102 102 GLY HA2 H 102 4.024 3.868 0.156 1
1 1195 . 18 1 1 A 102 102 GLY HA3 H 102 3.713 3.887 -0.174 1
1 1196 . 18 1 1 A 102 102 GLY C C 102 173.991 174.590 -0.599 1
1 1197 . 18 1 1 A 102 102 GLY CA C 102 46.458 45.837 0.621 1
1 1198 . 18 1 1 A 102 102 GLY N N 102 111.144 110.579 0.565 1
1 1199 . 18 1 1 A 103 103 VAL H H 103 7.155 7.408 -0.253 1
1 1200 . 18 1 1 A 103 103 VAL HA H 103 3.652 4.122 -0.470 1
1 1208 . 18 1 1 A 103 103 VAL C C 103 173.805 174.963 -1.158 1
1 1209 . 18 1 1 A 103 103 VAL CA C 103 64.310 62.377 1.933 1
1 1210 . 18 1 1 A 103 103 VAL CB C 103 32.254 32.583 -0.329 1
1 1213 . 18 1 1 A 103 103 VAL N N 103 119.836 121.733 -1.897 1
1 1214 . 18 1 1 A 104 104 VAL H H 104 7.653 9.018 -1.365 1
1 1215 . 18 1 1 A 104 104 VAL HA H 104 4.048 4.472 -0.424 1
1 1223 . 18 1 1 A 104 104 VAL C C 104 175.708 174.149 1.559 1
1 1224 . 18 1 1 A 104 104 VAL CA C 104 60.275 60.705 -0.430 1
1 1225 . 18 1 1 A 104 104 VAL CB C 104 35.112 34.201 0.911 1
1 1228 . 18 1 1 A 104 104 VAL N N 104 125.859 127.620 -1.761 1
1 1229 . 18 1 1 A 105 105 LEU H H 105 8.616 8.294 0.322 1
1 1230 . 18 1 1 A 105 105 LEU HA H 105 3.905 4.831 -0.926 1
1 1240 . 18 1 1 A 105 105 LEU C C 105 175.380 175.724 -0.344 1
1 1241 . 18 1 1 A 105 105 LEU CA C 105 54.471 53.476 0.995 1
1 1242 . 18 1 1 A 105 105 LEU CB C 105 39.821 42.532 -2.711 1
1 1246 . 18 1 1 A 105 105 LEU N N 105 123.839 126.189 -2.350 1
1 1247 . 18 1 1 A 106 106 LEU H H 106 8.894 8.593 0.301 1
1 1248 . 18 1 1 A 106 106 LEU HA H 106 4.839 5.029 -0.190 1
1 1258 . 18 1 1 A 106 106 LEU C C 106 176.930 176.511 0.419 1
1 1259 . 18 1 1 A 106 106 LEU CA C 106 56.288 53.300 2.988 1
1 1260 . 18 1 1 A 106 106 LEU CB C 106 45.237 45.548 -0.311 1
1 1264 . 18 1 1 A 106 106 LEU N N 106 120.590 121.594 -1.004 1
1 1265 . 18 1 1 A 107 107 ASN H H 107 8.124 9.101 -0.977 1
1 1266 . 18 1 1 A 107 107 ASN HA H 107 5.650 4.668 0.982 1
1 1271 . 18 1 1 A 107 107 ASN CA C 107 50.293 53.992 -3.699 1
1 1272 . 18 1 1 A 107 107 ASN CB C 107 41.223 36.204 5.019 1
1 1273 . 18 1 1 A 107 107 ASN N N 107 116.866 117.822 -0.956 1
1 1275 . 18 1 1 A 108 108 PRO HA H 108 2.926 3.867 -0.941 1
1 1282 . 18 1 1 A 108 108 PRO C C 108 176.671 176.599 0.072 1
1 1283 . 18 1 1 A 108 108 PRO CA C 108 60.804 62.530 -1.726 1
1 1284 . 18 1 1 A 108 108 PRO CB C 108 31.774 32.220 -0.446 1
1 1287 . 18 1 1 A 109 109 ILE H H 109 8.648 7.507 1.141 1
1 1288 . 18 1 1 A 109 109 ILE HA H 109 4.519 4.405 0.114 1
1 1298 . 18 1 1 A 109 109 ILE CA C 109 55.070 59.148 -4.078 1
1 1299 . 18 1 1 A 109 109 ILE CB C 109 36.068 38.259 -2.191 1
1 1303 . 18 1 1 A 109 109 ILE N N 109 128.817 123.344 5.473 1
1 1304 . 18 1 1 A 110 110 PRO HA H 110 4.587 4.417 0.170 1
1 1311 . 18 1 1 A 110 110 PRO C C 110 177.013 176.287 0.726 1
1 1312 . 18 1 1 A 110 110 PRO CA C 110 61.850 62.906 -1.056 1
1 1313 . 18 1 1 A 110 110 PRO CB C 110 32.507 31.811 0.696 1
1 1316 . 18 1 1 A 111 111 LYS H H 111 8.038 8.129 -0.091 1
1 1317 . 18 1 1 A 111 111 LYS HA H 111 3.553 3.916 -0.363 1
1 1326 . 18 1 1 A 111 111 LYS C C 111 176.123 175.057 1.066 1
1 1327 . 18 1 1 A 111 111 LYS CA C 111 56.220 55.142 1.078 1
1 1328 . 18 1 1 A 111 111 LYS CB C 111 32.373 32.931 -0.558 1
1 1332 . 18 1 1 A 111 111 LYS N N 111 120.147 118.373 1.774 1
1 1333 . 18 1 1 A 112 112 ASP H H 112 8.463 8.834 -0.371 1
1 1334 . 18 1 1 A 112 112 ASP HA H 112 4.523 4.767 -0.244 1
1 1337 . 18 1 1 A 112 112 ASP C C 112 175.986 176.738 -0.752 1
1 1338 . 18 1 1 A 112 112 ASP CA C 112 54.256 53.397 0.859 1
1 1339 . 18 1 1 A 112 112 ASP CB C 112 41.563 41.667 -0.104 1
1 1340 . 18 1 1 A 112 112 ASP N N 112 121.863 123.112 -1.249 1
1 1341 . 18 1 1 A 113 113 LYS H H 113 8.059 8.306 -0.247 1
1 1342 . 18 1 1 A 113 113 LYS HA H 113 4.136 4.109 0.027 1
1 1351 . 18 1 1 A 113 113 LYS C C 113 176.010 176.141 -0.131 1
1 1352 . 18 1 1 A 113 113 LYS CA C 113 56.253 55.863 0.390 1
1 1353 . 18 1 1 A 113 113 LYS CB C 113 32.754 31.737 1.017 1
1 1357 . 18 1 1 A 113 113 LYS N N 113 121.725 120.110 1.615 1
1 1358 . 18 1 1 A 114 114 LYS H H 114 8.225 7.151 1.074 1
1 1359 . 18 1 1 A 114 114 LYS HA H 114 4.169 4.029 0.140 1
1 1368 . 18 1 1 A 114 114 LYS C C 114 176.198 176.353 -0.155 1
1 1369 . 18 1 1 A 114 114 LYS CA C 114 56.413 55.852 0.561 1
1 1370 . 18 1 1 A 114 114 LYS CB C 114 32.725 32.750 -0.025 1
1 1374 . 18 1 1 A 114 114 LYS N N 114 121.857 120.281 1.576 1
1 1375 . 18 1 1 A 115 115 TRP H H 115 8.078 8.294 -0.216 1
1 1376 . 18 1 1 A 115 115 TRP HA H 115 4.709 4.335 0.374 1
1 1385 . 18 1 1 A 115 115 TRP C C 115 175.119 176.583 -1.464 1
1 1386 . 18 1 1 A 115 115 TRP CA C 115 56.856 60.213 -3.357 1
1 1387 . 18 1 1 A 115 115 TRP CB C 115 29.474 29.560 -0.086 1
1 1393 . 18 1 1 A 115 115 TRP N N 115 122.068 124.852 -2.784 1
1 1 . 19 1 1 A 10 10 HIS HA H 10 4.616 4.903 -0.287 1
1 4 . 19 1 1 A 10 10 HIS C C 10 174.981 173.341 1.640 1
1 5 . 19 1 1 A 10 10 HIS CA C 10 56.555 54.642 1.913 1
1 6 . 19 1 1 A 10 10 HIS CB C 10 30.231 33.163 -2.932 1
1 7 . 19 1 1 A 11 11 MET H H 11 8.103 8.244 -0.141 1
1 8 . 19 1 1 A 11 11 MET HA H 11 4.439 4.916 -0.477 1
1 13 . 19 1 1 A 11 11 MET C C 11 175.888 175.579 0.309 1
1 14 . 19 1 1 A 11 11 MET CA C 11 55.090 54.033 1.057 1
1 15 . 19 1 1 A 11 11 MET CB C 11 33.121 33.812 -0.691 1
1 17 . 19 1 1 A 11 11 MET N N 11 120.743 125.308 -4.565 1
1 18 . 19 1 1 A 12 12 LYS H H 12 8.065 8.806 -0.741 1
1 19 . 19 1 1 A 12 12 LYS HA H 12 4.407 4.816 -0.409 1
1 28 . 19 1 1 A 12 12 LYS CA C 12 54.894 52.991 1.903 1
1 29 . 19 1 1 A 12 12 LYS CB C 12 31.863 34.675 -2.812 1
1 33 . 19 1 1 A 12 12 LYS N N 12 123.187 120.161 3.026 1
1 34 . 19 1 1 A 13 13 PRO HA H 13 4.347 4.436 -0.089 1
1 41 . 19 1 1 A 13 13 PRO C C 13 176.891 177.337 -0.446 1
1 42 . 19 1 1 A 13 13 PRO CA C 13 62.542 62.391 0.151 1
1 43 . 19 1 1 A 13 13 PRO CB C 13 32.663 33.038 -0.375 1
1 46 . 19 1 1 A 14 14 LEU H H 14 8.339 8.757 -0.418 1
1 47 . 19 1 1 A 14 14 LEU HA H 14 3.373 3.795 -0.422 1
1 57 . 19 1 1 A 14 14 LEU C C 14 176.683 178.217 -1.534 1
1 58 . 19 1 1 A 14 14 LEU CA C 14 58.555 57.428 1.127 1
1 59 . 19 1 1 A 14 14 LEU CB C 14 41.828 40.983 0.845 1
1 63 . 19 1 1 A 14 14 LEU N N 14 123.191 123.795 -0.604 1
1 64 . 19 1 1 A 15 15 ALA H H 15 8.175 7.824 0.351 1
1 65 . 19 1 1 A 15 15 ALA HA H 15 3.983 4.065 -0.082 1
1 69 . 19 1 1 A 15 15 ALA C C 15 178.697 178.055 0.642 1
1 70 . 19 1 1 A 15 15 ALA CA C 15 54.164 54.263 -0.099 1
1 71 . 19 1 1 A 15 15 ALA CB C 15 18.771 18.231 0.540 1
1 72 . 19 1 1 A 15 15 ALA N N 15 113.594 119.586 -5.992 1
1 73 . 19 1 1 A 16 16 GLU H H 16 7.458 7.517 -0.059 1
1 74 . 19 1 1 A 16 16 GLU HA H 16 4.266 4.258 0.008 1
1 79 . 19 1 1 A 16 16 GLU C C 16 176.510 176.693 -0.183 1
1 80 . 19 1 1 A 16 16 GLU CA C 16 55.196 56.861 -1.665 1
1 81 . 19 1 1 A 16 16 GLU CB C 16 30.907 30.312 0.595 1
1 83 . 19 1 1 A 16 16 GLU N N 16 113.348 116.020 -2.672 1
1 84 . 19 1 1 A 17 17 GLN H H 17 7.501 6.976 0.525 1
1 85 . 19 1 1 A 17 17 GLN HA H 17 3.683 3.897 -0.214 1
1 92 . 19 1 1 A 17 17 GLN C C 17 178.053 175.372 2.681 1
1 93 . 19 1 1 A 17 17 GLN CA C 17 54.606 55.541 -0.935 1
1 94 . 19 1 1 A 17 17 GLN CB C 17 25.758 28.232 -2.474 1
1 96 . 19 1 1 A 17 17 GLN N N 17 119.411 119.178 0.233 1
1 98 . 19 1 1 A 18 18 ASP H H 18 8.949 8.418 0.531 1
1 99 . 19 1 1 A 18 18 ASP HA H 18 4.184 4.157 0.027 1
1 102 . 19 1 1 A 18 18 ASP C C 18 175.263 177.434 -2.171 1
1 103 . 19 1 1 A 18 18 ASP CA C 18 57.275 56.480 0.795 1
1 104 . 19 1 1 A 18 18 ASP CB C 18 40.620 40.442 0.178 1
1 105 . 19 1 1 A 18 18 ASP N N 18 124.676 123.275 1.401 1
1 106 . 19 1 1 A 19 19 TRP H H 19 6.068 7.003 -0.935 1
1 107 . 19 1 1 A 19 19 TRP HA H 19 5.045 4.849 0.196 1
1 116 . 19 1 1 A 19 19 TRP C C 19 175.902 176.267 -0.365 1
1 117 . 19 1 1 A 19 19 TRP CA C 19 53.542 57.283 -3.741 1
1 118 . 19 1 1 A 19 19 TRP CB C 19 29.179 29.178 0.001 1
1 124 . 19 1 1 A 19 19 TRP N N 19 107.757 117.829 -10.072 1
1 126 . 19 1 1 A 20 20 TYR H H 20 7.430 7.302 0.128 1
1 127 . 19 1 1 A 20 20 TYR HA H 20 5.601 5.278 0.323 1
1 132 . 19 1 1 A 20 20 TYR C C 20 175.498 174.364 1.134 1
1 133 . 19 1 1 A 20 20 TYR CA C 20 56.967 57.199 -0.232 1
1 134 . 19 1 1 A 20 20 TYR CB C 20 39.083 39.287 -0.204 1
1 137 . 19 1 1 A 20 20 TYR N N 20 123.173 122.074 1.099 1
1 138 . 19 1 1 A 21 21 HIS H H 21 8.934 8.838 0.096 1
1 139 . 19 1 1 A 21 21 HIS HA H 21 4.295 4.697 -0.402 1
1 144 . 19 1 1 A 21 21 HIS C C 21 175.177 174.743 0.434 1
1 145 . 19 1 1 A 21 21 HIS CA C 21 56.572 53.728 2.844 1
1 146 . 19 1 1 A 21 21 HIS CB C 21 33.365 29.799 3.566 1
1 149 . 19 1 1 A 21 21 HIS N N 21 125.732 126.998 -1.266 1
1 150 . 19 1 1 A 22 22 GLY H H 22 5.280 8.211 -2.931 1
1 151 . 19 1 1 A 22 22 GLY HA2 H 22 3.905 3.521 0.384 1
1 152 . 19 1 1 A 22 22 GLY HA3 H 22 3.585 3.594 -0.009 1
1 153 . 19 1 1 A 22 22 GLY C C 22 174.411 174.396 0.015 1
1 154 . 19 1 1 A 22 22 GLY CA C 22 46.402 46.786 -0.384 1
1 155 . 19 1 1 A 22 22 GLY N N 22 104.568 111.978 -7.410 1
1 156 . 19 1 1 A 23 23 ALA H H 23 8.768 8.515 0.253 1
1 157 . 19 1 1 A 23 23 ALA HA H 23 5.171 4.554 0.617 1
1 161 . 19 1 1 A 23 23 ALA C C 23 177.180 177.160 0.020 1
1 162 . 19 1 1 A 23 23 ALA CA C 23 51.153 50.945 0.208 1
1 163 . 19 1 1 A 23 23 ALA CB C 23 16.999 19.457 -2.458 1
1 164 . 19 1 1 A 23 23 ALA N N 23 130.297 128.617 1.680 1
1 165 . 19 1 1 A 24 24 ILE H H 24 7.267 6.702 0.565 1
1 166 . 19 1 1 A 24 24 ILE HA H 24 4.460 4.337 0.123 1
1 176 . 19 1 1 A 24 24 ILE CA C 24 58.529 59.941 -1.412 1
1 177 . 19 1 1 A 24 24 ILE CB C 24 38.763 37.744 1.019 1
1 181 . 19 1 1 A 24 24 ILE N N 24 118.903 115.214 3.689 1
1 182 . 19 1 1 A 25 25 PRO HA H 25 4.224 4.553 -0.329 1
1 189 . 19 1 1 A 25 25 PRO C C 25 176.918 177.571 -0.653 1
1 190 . 19 1 1 A 25 25 PRO CA C 25 62.907 62.370 0.537 1
1 191 . 19 1 1 A 25 25 PRO CB C 25 32.671 32.742 -0.071 1
1 194 . 19 1 1 A 26 26 ARG H H 26 8.781 9.140 -0.359 1
1 195 . 19 1 1 A 26 26 ARG HA H 26 3.472 3.908 -0.436 1
1 202 . 19 1 1 A 26 26 ARG C C 26 178.112 178.045 0.067 1
1 203 . 19 1 1 A 26 26 ARG CA C 26 60.863 59.473 1.390 1
1 204 . 19 1 1 A 26 26 ARG CB C 26 30.314 29.916 0.398 1
1 207 . 19 1 1 A 26 26 ARG N N 26 124.635 120.939 3.696 1
1 208 . 19 1 1 A 27 27 ILE H H 27 8.540 8.076 0.464 1
1 209 . 19 1 1 A 27 27 ILE HA H 27 3.787 3.620 0.167 1
1 219 . 19 1 1 A 27 27 ILE C C 27 177.390 177.654 -0.264 1
1 220 . 19 1 1 A 27 27 ILE CA C 27 64.329 65.024 -0.695 1
1 221 . 19 1 1 A 27 27 ILE CB C 27 37.413 37.922 -0.509 1
1 225 . 19 1 1 A 27 27 ILE N N 27 115.859 120.312 -4.453 1
1 226 . 19 1 1 A 28 28 GLU H H 28 6.953 8.361 -1.408 1
1 227 . 19 1 1 A 28 28 GLU HA H 28 4.067 4.000 0.067 1
1 232 . 19 1 1 A 28 28 GLU C C 28 179.006 179.195 -0.189 1
1 233 . 19 1 1 A 28 28 GLU CA C 28 58.985 59.435 -0.450 1
1 234 . 19 1 1 A 28 28 GLU CB C 28 29.316 29.038 0.278 1
1 236 . 19 1 1 A 28 28 GLU N N 28 120.554 119.055 1.499 1
1 237 . 19 1 1 A 29 29 ALA H H 29 7.999 7.705 0.294 1
1 238 . 19 1 1 A 29 29 ALA HA H 29 3.822 4.035 -0.213 1
1 242 . 19 1 1 A 29 29 ALA C C 29 178.809 179.846 -1.037 1
1 243 . 19 1 1 A 29 29 ALA CA C 29 54.698 54.784 -0.086 1
1 244 . 19 1 1 A 29 29 ALA CB C 29 18.059 18.390 -0.331 1
1 245 . 19 1 1 A 29 29 ALA N N 29 120.122 122.660 -2.538 1
1 246 . 19 1 1 A 30 30 GLN H H 30 8.168 8.055 0.113 1
1 247 . 19 1 1 A 30 30 GLN HA H 30 3.811 4.187 -0.376 1
1 254 . 19 1 1 A 30 30 GLN C C 30 177.578 178.134 -0.556 1
1 255 . 19 1 1 A 30 30 GLN CA C 30 59.731 58.574 1.157 1
1 256 . 19 1 1 A 30 30 GLN CB C 30 28.161 29.081 -0.920 1
1 258 . 19 1 1 A 30 30 GLN N N 30 112.109 115.961 -3.852 1
1 260 . 19 1 1 A 31 31 GLU H H 31 7.248 8.259 -1.011 1
1 261 . 19 1 1 A 31 31 GLU HA H 31 4.063 4.061 0.002 1
1 266 . 19 1 1 A 31 31 GLU C C 31 177.423 179.657 -2.234 1
1 267 . 19 1 1 A 31 31 GLU CA C 31 57.650 58.838 -1.188 1
1 268 . 19 1 1 A 31 31 GLU CB C 31 29.757 29.571 0.186 1
1 270 . 19 1 1 A 31 31 GLU N N 31 115.340 119.765 -4.425 1
1 271 . 19 1 1 A 32 32 LEU H H 32 7.169 7.433 -0.264 1
1 272 . 19 1 1 A 32 32 LEU HA H 32 4.087 4.020 0.067 1
1 282 . 19 1 1 A 32 32 LEU C C 32 175.850 177.203 -1.353 1
1 283 . 19 1 1 A 32 32 LEU CA C 32 55.580 57.376 -1.796 1
1 284 . 19 1 1 A 32 32 LEU CB C 32 42.910 41.092 1.818 1
1 288 . 19 1 1 A 32 32 LEU N N 32 116.367 116.268 0.099 1
1 289 . 19 1 1 A 33 33 LEU H H 33 7.062 7.591 -0.529 1
1 290 . 19 1 1 A 33 33 LEU HA H 33 4.431 4.043 0.388 1
1 300 . 19 1 1 A 33 33 LEU C C 33 174.837 176.801 -1.964 1
1 301 . 19 1 1 A 33 33 LEU CA C 33 53.521 55.323 -1.802 1
1 302 . 19 1 1 A 33 33 LEU CB C 33 43.301 42.087 1.214 1
1 306 . 19 1 1 A 33 33 LEU N N 33 118.568 122.299 -3.731 1
1 307 . 19 1 1 A 34 34 LYS H H 34 8.749 8.289 0.460 1
1 308 . 19 1 1 A 34 34 LYS HA H 34 4.162 4.163 -0.001 1
1 317 . 19 1 1 A 34 34 LYS C C 34 174.378 175.320 -0.942 1
1 318 . 19 1 1 A 34 34 LYS CA C 34 56.575 56.405 0.170 1
1 319 . 19 1 1 A 34 34 LYS CB C 34 36.918 34.683 2.235 1
1 323 . 19 1 1 A 34 34 LYS N N 34 121.659 117.962 3.697 1
1 324 . 19 1 1 A 35 35 LYS H H 35 8.137 7.620 0.517 1
1 325 . 19 1 1 A 35 35 LYS HA H 35 4.011 5.091 -1.080 1
1 334 . 19 1 1 A 35 35 LYS C C 35 174.343 175.909 -1.566 1
1 335 . 19 1 1 A 35 35 LYS CA C 35 53.960 54.792 -0.832 1
1 336 . 19 1 1 A 35 35 LYS CB C 35 35.587 35.398 0.189 1
1 340 . 19 1 1 A 35 35 LYS N N 35 119.354 116.692 2.662 1
1 341 . 19 1 1 A 36 36 GLN H H 36 8.394 8.744 -0.350 1
1 342 . 19 1 1 A 36 36 GLN HA H 36 4.187 4.237 -0.050 1
1 349 . 19 1 1 A 36 36 GLN C C 36 177.012 176.710 0.302 1
1 350 . 19 1 1 A 36 36 GLN CA C 36 57.750 57.818 -0.068 1
1 351 . 19 1 1 A 36 36 GLN CB C 36 28.433 28.339 0.094 1
1 353 . 19 1 1 A 36 36 GLN N N 36 120.248 123.010 -2.762 1
1 355 . 19 1 1 A 37 37 GLY H H 37 9.597 9.396 0.201 1
1 356 . 19 1 1 A 37 37 GLY HA2 H 37 4.486 4.097 0.389 1
1 357 . 19 1 1 A 37 37 GLY HA3 H 37 3.926 4.107 -0.181 1
1 358 . 19 1 1 A 37 37 GLY C C 37 176.285 174.488 1.797 1
1 359 . 19 1 1 A 37 37 GLY CA C 37 46.146 45.328 0.818 1
1 360 . 19 1 1 A 37 37 GLY N N 37 116.637 114.784 1.853 1
1 361 . 19 1 1 A 38 38 ASP H H 38 8.925 7.829 1.096 1
1 362 . 19 1 1 A 38 38 ASP HA H 38 5.697 4.664 1.033 1
1 365 . 19 1 1 A 38 38 ASP C C 38 176.181 175.796 0.385 1
1 366 . 19 1 1 A 38 38 ASP CA C 38 55.066 55.471 -0.405 1
1 367 . 19 1 1 A 38 38 ASP CB C 38 42.933 41.130 1.803 1
1 368 . 19 1 1 A 38 38 ASP N N 38 127.293 121.946 5.347 1
1 369 . 19 1 1 A 39 39 PHE H H 39 8.647 8.248 0.399 1
1 370 . 19 1 1 A 39 39 PHE HA H 39 6.025 5.968 0.057 1
1 378 . 19 1 1 A 39 39 PHE C C 39 170.948 172.963 -2.015 1
1 379 . 19 1 1 A 39 39 PHE CA C 39 56.376 55.926 0.450 1
1 380 . 19 1 1 A 39 39 PHE CB C 39 44.583 43.309 1.274 1
1 386 . 19 1 1 A 39 39 PHE N N 39 117.102 120.123 -3.021 1
1 387 . 19 1 1 A 40 40 LEU H H 40 9.186 8.938 0.248 1
1 388 . 19 1 1 A 40 40 LEU HA H 40 4.983 5.212 -0.229 1
1 398 . 19 1 1 A 40 40 LEU C C 40 174.787 174.523 0.264 1
1 399 . 19 1 1 A 40 40 LEU CA C 40 54.610 53.689 0.921 1
1 400 . 19 1 1 A 40 40 LEU CB C 40 44.330 46.049 -1.719 1
1 404 . 19 1 1 A 40 40 LEU N N 40 114.388 118.080 -3.692 1
1 405 . 19 1 1 A 41 41 VAL H H 41 9.390 9.357 0.033 1
1 406 . 19 1 1 A 41 41 VAL HA H 41 5.742 5.023 0.719 1
1 414 . 19 1 1 A 41 41 VAL C C 41 172.760 175.464 -2.704 1
1 415 . 19 1 1 A 41 41 VAL CA C 41 60.814 61.520 -0.706 1
1 416 . 19 1 1 A 41 41 VAL CB C 41 34.908 33.387 1.521 1
1 419 . 19 1 1 A 41 41 VAL N N 41 119.873 121.708 -1.835 1
1 420 . 19 1 1 A 42 42 ARG H H 42 9.598 9.265 0.333 1
1 421 . 19 1 1 A 42 42 ARG HA H 42 5.247 5.031 0.216 1
1 429 . 19 1 1 A 42 42 ARG C C 42 173.379 174.874 -1.495 1
1 430 . 19 1 1 A 42 42 ARG CA C 42 53.202 54.517 -1.315 1
1 431 . 19 1 1 A 42 42 ARG CB C 42 33.507 34.041 -0.534 1
1 434 . 19 1 1 A 42 42 ARG N N 42 124.179 124.654 -0.475 1
1 436 . 19 1 1 A 43 43 GLU H H 43 8.234 8.771 -0.537 1
1 437 . 19 1 1 A 43 43 GLU HA H 43 4.890 4.031 0.859 1
1 442 . 19 1 1 A 43 43 GLU C C 43 176.929 176.620 0.309 1
1 443 . 19 1 1 A 43 43 GLU CA C 43 54.846 56.249 -1.403 1
1 444 . 19 1 1 A 43 43 GLU CB C 43 31.599 30.619 0.980 1
1 446 . 19 1 1 A 43 43 GLU N N 43 124.103 124.317 -0.214 1
1 447 . 19 1 1 A 44 44 SER H H 44 9.033 8.569 0.464 1
1 448 . 19 1 1 A 44 44 SER HA H 44 3.957 4.435 -0.478 1
1 451 . 19 1 1 A 44 44 SER C C 44 175.005 174.070 0.935 1
1 452 . 19 1 1 A 44 44 SER CA C 44 59.393 58.158 1.235 1
1 453 . 19 1 1 A 44 44 SER CB C 44 63.619 63.862 -0.243 1
1 454 . 19 1 1 A 44 44 SER N N 44 124.316 121.086 3.230 1
1 455 . 19 1 1 A 45 45 HIS H H 45 8.461 8.593 -0.132 1
1 456 . 19 1 1 A 45 45 HIS HA H 45 4.132 4.286 -0.154 1
1 460 . 19 1 1 A 45 45 HIS C C 45 176.480 176.140 0.340 1
1 461 . 19 1 1 A 45 45 HIS CA C 45 58.887 57.142 1.745 1
1 462 . 19 1 1 A 45 45 HIS CB C 45 30.180 29.569 0.611 1
1 464 . 19 1 1 A 45 45 HIS N N 45 127.694 126.571 1.123 1
1 465 . 19 1 1 A 46 46 GLY H H 46 8.513 8.579 -0.066 1
1 466 . 19 1 1 A 46 46 GLY HA2 H 46 3.827 3.766 0.061 1
1 467 . 19 1 1 A 46 46 GLY HA3 H 46 3.827 3.821 0.006 1
1 468 . 19 1 1 A 46 46 GLY C C 46 173.630 173.802 -0.172 1
1 469 . 19 1 1 A 46 46 GLY CA C 46 45.188 45.300 -0.112 1
1 470 . 19 1 1 A 46 46 GLY N N 46 110.761 114.000 -3.239 1
1 471 . 19 1 1 A 47 47 LYS H H 47 7.216 8.031 -0.815 1
1 472 . 19 1 1 A 47 47 LYS HA H 47 4.540 4.822 -0.282 1
1 481 . 19 1 1 A 47 47 LYS CA C 47 53.475 53.146 0.329 1
1 482 . 19 1 1 A 47 47 LYS CB C 47 33.325 33.936 -0.611 1
1 486 . 19 1 1 A 47 47 LYS N N 47 121.356 120.856 0.500 1
1 487 . 19 1 1 A 48 48 PRO HA H 48 4.181 4.357 -0.176 1
1 494 . 19 1 1 A 48 48 PRO C C 48 178.920 177.311 1.609 1
1 495 . 19 1 1 A 48 48 PRO CA C 48 63.239 63.036 0.203 1
1 496 . 19 1 1 A 48 48 PRO CB C 48 31.523 30.161 1.362 1
1 499 . 19 1 1 A 49 49 GLY H H 49 9.752 8.255 1.497 1
1 500 . 19 1 1 A 49 49 GLY HA2 H 49 4.053 4.070 -0.017 1
1 501 . 19 1 1 A 49 49 GLY HA3 H 49 3.374 4.175 -0.801 1
1 502 . 19 1 1 A 49 49 GLY C C 49 172.093 174.602 -2.509 1
1 503 . 19 1 1 A 49 49 GLY CA C 49 45.041 45.511 -0.470 1
1 504 . 19 1 1 A 49 49 GLY N N 49 112.415 112.676 -0.261 1
1 505 . 19 1 1 A 50 50 GLU H H 50 7.623 7.737 -0.114 1
1 506 . 19 1 1 A 50 50 GLU HA H 50 4.537 4.896 -0.359 1
1 511 . 19 1 1 A 50 50 GLU C C 50 173.297 175.109 -1.812 1
1 512 . 19 1 1 A 50 50 GLU CA C 50 55.174 55.950 -0.776 1
1 513 . 19 1 1 A 50 50 GLU CB C 50 31.651 31.139 0.512 1
1 515 . 19 1 1 A 50 50 GLU N N 50 121.600 121.576 0.024 1
1 516 . 19 1 1 A 51 51 TYR H H 51 9.452 9.263 0.189 1
1 517 . 19 1 1 A 51 51 TYR HA H 51 5.382 5.164 0.218 1
1 524 . 19 1 1 A 51 51 TYR C C 51 174.387 174.950 -0.563 1
1 525 . 19 1 1 A 51 51 TYR CA C 51 57.592 57.202 0.390 1
1 526 . 19 1 1 A 51 51 TYR CB C 51 41.820 43.424 -1.604 1
1 531 . 19 1 1 A 51 51 TYR N N 51 125.790 125.285 0.505 1
1 532 . 19 1 1 A 52 52 VAL H H 52 9.471 9.406 0.065 1
1 533 . 19 1 1 A 52 52 VAL HA H 52 4.840 4.939 -0.099 1
1 541 . 19 1 1 A 52 52 VAL C C 52 174.947 174.647 0.300 1
1 542 . 19 1 1 A 52 52 VAL CA C 52 60.991 61.257 -0.266 1
1 543 . 19 1 1 A 52 52 VAL CB C 52 36.829 34.489 2.340 1
1 546 . 19 1 1 A 52 52 VAL N N 52 120.617 121.879 -1.262 1
1 547 . 19 1 1 A 53 53 LEU H H 53 9.457 9.377 0.080 1
1 548 . 19 1 1 A 53 53 LEU HA H 53 5.294 5.140 0.154 1
1 558 . 19 1 1 A 53 53 LEU C C 53 175.024 175.544 -0.520 1
1 559 . 19 1 1 A 53 53 LEU CA C 53 53.904 54.130 -0.226 1
1 560 . 19 1 1 A 53 53 LEU CB C 53 44.756 43.737 1.019 1
1 564 . 19 1 1 A 53 53 LEU N N 53 127.725 131.239 -3.514 1
1 565 . 19 1 1 A 54 54 SER H H 54 9.461 9.299 0.162 1
1 566 . 19 1 1 A 54 54 SER HA H 54 5.691 4.995 0.696 1
1 569 . 19 1 1 A 54 54 SER C C 54 172.227 172.850 -0.623 1
1 570 . 19 1 1 A 54 54 SER CA C 54 58.551 56.732 1.819 1
1 571 . 19 1 1 A 54 54 SER CB C 54 65.738 64.323 1.415 1
1 572 . 19 1 1 A 54 54 SER N N 54 127.178 122.887 4.291 1
1 573 . 19 1 1 A 55 55 VAL H H 55 9.049 9.006 0.043 1
1 574 . 19 1 1 A 55 55 VAL HA H 55 5.691 5.571 0.120 1
1 582 . 19 1 1 A 55 55 VAL C C 55 173.959 172.754 1.205 1
1 583 . 19 1 1 A 55 55 VAL CA C 55 58.398 59.662 -1.264 1
1 584 . 19 1 1 A 55 55 VAL CB C 55 36.262 35.426 0.836 1
1 587 . 19 1 1 A 55 55 VAL N N 55 120.619 127.695 -7.076 1
1 588 . 19 1 1 A 56 56 TYR H H 56 8.629 9.213 -0.584 1
1 589 . 19 1 1 A 56 56 TYR HA H 56 4.951 5.348 -0.397 1
1 596 . 19 1 1 A 56 56 TYR C C 56 175.224 174.419 0.805 1
1 597 . 19 1 1 A 56 56 TYR CA C 56 56.684 56.037 0.647 1
1 598 . 19 1 1 A 56 56 TYR CB C 56 39.646 41.385 -1.739 1
1 603 . 19 1 1 A 56 56 TYR N N 56 127.444 130.091 -2.647 1
1 604 . 19 1 1 A 57 57 SER H H 57 8.869 8.632 0.237 1
1 605 . 19 1 1 A 57 57 SER HA H 57 4.739 4.734 0.005 1
1 608 . 19 1 1 A 57 57 SER C C 57 174.492 172.697 1.795 1
1 609 . 19 1 1 A 57 57 SER CA C 57 57.591 57.242 0.349 1
1 610 . 19 1 1 A 57 57 SER CB C 57 64.281 66.082 -1.801 1
1 611 . 19 1 1 A 57 57 SER N N 57 122.165 122.882 -0.717 1
1 612 . 19 1 1 A 58 58 ASP H H 58 10.446 9.198 1.248 1
1 613 . 19 1 1 A 58 58 ASP HA H 58 4.382 4.303 0.079 1
1 616 . 19 1 1 A 58 58 ASP C C 58 176.398 176.142 0.256 1
1 617 . 19 1 1 A 58 58 ASP CA C 58 55.215 55.327 -0.112 1
1 618 . 19 1 1 A 58 58 ASP CB C 58 39.513 39.623 -0.110 1
1 619 . 19 1 1 A 58 58 ASP N N 58 132.098 128.186 3.912 1
1 620 . 19 1 1 A 59 59 GLY H H 59 7.861 8.293 -0.432 1
1 621 . 19 1 1 A 59 59 GLY HA2 H 59 3.817 3.787 0.030 1
1 622 . 19 1 1 A 59 59 GLY HA3 H 59 4.086 3.801 0.285 1
1 623 . 19 1 1 A 59 59 GLY C C 59 173.111 173.510 -0.399 1
1 624 . 19 1 1 A 59 59 GLY CA C 59 45.486 45.244 0.242 1
1 625 . 19 1 1 A 59 59 GLY N N 59 102.674 103.565 -0.891 1
1 626 . 19 1 1 A 60 60 GLN H H 60 7.137 7.618 -0.481 1
1 627 . 19 1 1 A 60 60 GLN HA H 60 4.455 4.586 -0.131 1
1 634 . 19 1 1 A 60 60 GLN C C 60 173.549 175.125 -1.576 1
1 635 . 19 1 1 A 60 60 GLN CA C 60 53.388 54.086 -0.698 1
1 636 . 19 1 1 A 60 60 GLN CB C 60 32.373 30.596 1.777 1
1 638 . 19 1 1 A 60 60 GLN N N 60 116.206 119.382 -3.176 1
1 640 . 19 1 1 A 61 61 ARG H H 61 8.589 8.458 0.131 1
1 641 . 19 1 1 A 61 61 ARG HA H 61 4.740 4.526 0.214 1
1 649 . 19 1 1 A 61 61 ARG C C 61 174.458 174.596 -0.138 1
1 650 . 19 1 1 A 61 61 ARG CA C 61 57.116 55.722 1.394 1
1 651 . 19 1 1 A 61 61 ARG CB C 61 29.615 30.740 -1.125 1
1 654 . 19 1 1 A 61 61 ARG N N 61 120.467 122.188 -1.721 1
1 656 . 19 1 1 A 62 62 ARG H H 62 8.867 8.942 -0.075 1
1 657 . 19 1 1 A 62 62 ARG HA H 62 4.297 4.466 -0.169 1
1 665 . 19 1 1 A 62 62 ARG C C 62 173.485 174.752 -1.267 1
1 666 . 19 1 1 A 62 62 ARG CA C 62 53.355 55.214 -1.859 1
1 667 . 19 1 1 A 62 62 ARG CB C 62 33.028 30.877 2.151 1
1 670 . 19 1 1 A 62 62 ARG N N 62 122.641 124.718 -2.077 1
1 672 . 19 1 1 A 63 63 HIS H H 63 7.997 8.645 -0.648 1
1 673 . 19 1 1 A 63 63 HIS HA H 63 5.427 5.401 0.026 1
1 678 . 19 1 1 A 63 63 HIS C C 63 174.946 173.716 1.230 1
1 679 . 19 1 1 A 63 63 HIS CA C 63 54.689 53.806 0.883 1
1 680 . 19 1 1 A 63 63 HIS CB C 63 33.008 32.196 0.812 1
1 683 . 19 1 1 A 63 63 HIS N N 63 119.064 121.936 -2.872 1
1 684 . 19 1 1 A 64 64 PHE H H 64 9.880 9.233 0.647 1
1 685 . 19 1 1 A 64 64 PHE HA H 64 4.824 5.092 -0.268 1
1 693 . 19 1 1 A 64 64 PHE C C 64 174.882 175.165 -0.283 1
1 694 . 19 1 1 A 64 64 PHE CA C 64 56.489 56.615 -0.126 1
1 695 . 19 1 1 A 64 64 PHE CB C 64 41.405 40.949 0.456 1
1 701 . 19 1 1 A 64 64 PHE N N 64 123.961 122.328 1.633 1
1 702 . 19 1 1 A 65 65 ILE H H 65 8.982 9.105 -0.123 1
1 703 . 19 1 1 A 65 65 ILE HA H 65 4.273 4.535 -0.262 1
1 713 . 19 1 1 A 65 65 ILE C C 65 176.556 176.017 0.539 1
1 714 . 19 1 1 A 65 65 ILE CA C 65 62.649 61.108 1.541 1
1 715 . 19 1 1 A 65 65 ILE CB C 65 38.296 38.095 0.201 1
1 719 . 19 1 1 A 65 65 ILE N N 65 126.601 124.586 2.015 1
1 720 . 19 1 1 A 66 66 ILE H H 66 8.947 9.085 -0.138 1
1 721 . 19 1 1 A 66 66 ILE HA H 66 3.780 4.388 -0.608 1
1 731 . 19 1 1 A 66 66 ILE C C 66 175.721 175.615 0.106 1
1 732 . 19 1 1 A 66 66 ILE CA C 66 62.960 61.147 1.813 1
1 733 . 19 1 1 A 66 66 ILE CB C 66 37.209 38.038 -0.829 1
1 737 . 19 1 1 A 66 66 ILE N N 66 130.139 129.379 0.760 1
1 738 . 19 1 1 A 67 67 GLN H H 67 8.410 8.424 -0.014 1
1 739 . 19 1 1 A 67 67 GLN HA H 67 4.422 4.858 -0.436 1
1 746 . 19 1 1 A 67 67 GLN C C 67 174.347 174.069 0.278 1
1 747 . 19 1 1 A 67 67 GLN CA C 67 55.867 54.919 0.948 1
1 748 . 19 1 1 A 67 67 GLN CB C 67 29.950 30.292 -0.342 1
1 750 . 19 1 1 A 67 67 GLN N N 67 128.872 127.092 1.780 1
1 752 . 19 1 1 A 68 68 TYR H H 68 8.619 8.952 -0.333 1
1 753 . 19 1 1 A 68 68 TYR HA H 68 5.300 4.768 0.532 1
1 760 . 19 1 1 A 68 68 TYR C C 68 174.695 174.153 0.542 1
1 761 . 19 1 1 A 68 68 TYR CA C 68 55.579 56.217 -0.638 1
1 762 . 19 1 1 A 68 68 TYR CB C 68 39.479 39.145 0.334 1
1 767 . 19 1 1 A 68 68 TYR N N 68 124.772 125.653 -0.881 1
1 768 . 19 1 1 A 69 69 VAL H H 69 8.539 8.651 -0.112 1
1 769 . 19 1 1 A 69 69 VAL HA H 69 4.046 4.373 -0.327 1
1 777 . 19 1 1 A 69 69 VAL C C 69 175.010 175.050 -0.040 1
1 778 . 19 1 1 A 69 69 VAL CA C 69 60.611 60.672 -0.061 1
1 779 . 19 1 1 A 69 69 VAL CB C 69 35.358 34.243 1.115 1
1 782 . 19 1 1 A 69 69 VAL N N 69 126.652 127.100 -0.448 1
1 783 . 19 1 1 A 70 70 ASP H H 70 9.089 9.291 -0.202 1
1 784 . 19 1 1 A 70 70 ASP HA H 70 4.025 4.197 -0.172 1
1 787 . 19 1 1 A 70 70 ASP C C 70 174.813 175.145 -0.332 1
1 788 . 19 1 1 A 70 70 ASP CA C 70 55.623 55.461 0.162 1
1 789 . 19 1 1 A 70 70 ASP CB C 70 39.081 39.401 -0.320 1
1 790 . 19 1 1 A 70 70 ASP N N 70 128.327 127.875 0.452 1
1 791 . 19 1 1 A 71 71 ASN H H 71 8.128 8.088 0.040 1
1 792 . 19 1 1 A 71 71 ASN HA H 71 3.597 3.487 0.110 1
1 797 . 19 1 1 A 71 71 ASN C C 71 173.250 173.604 -0.354 1
1 798 . 19 1 1 A 71 71 ASN CA C 71 54.728 54.233 0.495 1
1 799 . 19 1 1 A 71 71 ASN CB C 71 37.601 37.075 0.526 1
1 800 . 19 1 1 A 71 71 ASN N N 71 107.230 108.162 -0.932 1
1 802 . 19 1 1 A 72 72 MET H H 72 7.256 7.405 -0.149 1
1 803 . 19 1 1 A 72 72 MET HA H 72 4.740 4.907 -0.167 1
1 808 . 19 1 1 A 72 72 MET C C 72 173.780 174.645 -0.865 1
1 809 . 19 1 1 A 72 72 MET CA C 72 53.703 54.205 -0.502 1
1 810 . 19 1 1 A 72 72 MET CB C 72 36.570 35.662 0.908 1
1 812 . 19 1 1 A 72 72 MET N N 72 117.117 116.670 0.447 1
1 813 . 19 1 1 A 73 73 TYR H H 73 9.430 9.258 0.172 1
1 814 . 19 1 1 A 73 73 TYR HA H 73 5.718 5.066 0.652 1
1 821 . 19 1 1 A 73 73 TYR C C 73 176.140 175.842 0.298 1
1 822 . 19 1 1 A 73 73 TYR CA C 73 57.290 58.317 -1.027 1
1 823 . 19 1 1 A 73 73 TYR CB C 73 40.013 39.565 0.448 1
1 828 . 19 1 1 A 73 73 TYR N N 73 119.856 122.603 -2.747 1
1 829 . 19 1 1 A 74 74 ARG H H 74 9.038 8.847 0.191 1
1 830 . 19 1 1 A 74 74 ARG HA H 74 4.867 5.010 -0.143 1
1 838 . 19 1 1 A 74 74 ARG C C 74 173.954 174.723 -0.769 1
1 839 . 19 1 1 A 74 74 ARG CA C 74 54.887 54.144 0.743 1
1 840 . 19 1 1 A 74 74 ARG CB C 74 34.484 34.288 0.196 1
1 843 . 19 1 1 A 74 74 ARG N N 74 117.344 121.001 -3.657 1
1 845 . 19 1 1 A 75 75 PHE H H 75 9.005 8.725 0.280 1
1 846 . 19 1 1 A 75 75 PHE HA H 75 5.046 4.717 0.329 1
1 854 . 19 1 1 A 75 75 PHE C C 75 176.186 176.921 -0.735 1
1 855 . 19 1 1 A 75 75 PHE CA C 75 59.658 59.413 0.245 1
1 856 . 19 1 1 A 75 75 PHE CB C 75 39.356 40.119 -0.763 1
1 862 . 19 1 1 A 75 75 PHE N N 75 117.865 117.759 0.106 1
1 863 . 19 1 1 A 76 76 GLU H H 76 8.213 8.145 0.068 1
1 864 . 19 1 1 A 76 76 GLU HA H 76 4.586 4.135 0.451 1
1 869 . 19 1 1 A 76 76 GLU C C 76 175.238 177.929 -2.691 1
1 870 . 19 1 1 A 76 76 GLU CA C 76 55.994 59.306 -3.312 1
1 871 . 19 1 1 A 76 76 GLU CB C 76 31.805 30.351 1.454 1
1 873 . 19 1 1 A 76 76 GLU N N 76 116.834 118.781 -1.947 1
1 874 . 19 1 1 A 77 77 GLY H H 77 8.692 7.986 0.706 1
1 875 . 19 1 1 A 77 77 GLY HA2 H 77 4.166 4.160 0.006 1
1 876 . 19 1 1 A 77 77 GLY HA3 H 77 4.015 4.162 -0.147 1
1 877 . 19 1 1 A 77 77 GLY C C 77 173.784 174.046 -0.262 1
1 878 . 19 1 1 A 77 77 GLY CA C 77 45.505 45.633 -0.128 1
1 879 . 19 1 1 A 77 77 GLY N N 77 111.937 107.047 4.890 1
1 880 . 19 1 1 A 78 78 THR H H 78 8.332 7.754 0.578 1
1 881 . 19 1 1 A 78 78 THR HA H 78 3.900 4.320 -0.420 1
1 886 . 19 1 1 A 78 78 THR C C 78 173.591 174.184 -0.593 1
1 887 . 19 1 1 A 78 78 THR CA C 78 63.653 62.574 1.079 1
1 888 . 19 1 1 A 78 78 THR CB C 78 69.649 69.630 0.019 1
1 890 . 19 1 1 A 78 78 THR N N 78 120.765 115.453 5.312 1
1 891 . 19 1 1 A 79 79 GLY H H 79 8.038 8.374 -0.336 1
1 892 . 19 1 1 A 79 79 GLY HA2 H 79 4.748 4.362 0.386 1
1 893 . 19 1 1 A 79 79 GLY HA3 H 79 3.546 4.496 -0.950 1
1 894 . 19 1 1 A 79 79 GLY C C 79 172.580 171.725 0.855 1
1 895 . 19 1 1 A 79 79 GLY CA C 79 44.661 45.236 -0.575 1
1 896 . 19 1 1 A 79 79 GLY N N 79 109.887 112.715 -2.828 1
1 897 . 19 1 1 A 80 80 PHE H H 80 9.064 8.791 0.273 1
1 898 . 19 1 1 A 80 80 PHE HA H 80 4.886 4.971 -0.085 1
1 906 . 19 1 1 A 80 80 PHE C C 80 176.507 176.321 0.186 1
1 907 . 19 1 1 A 80 80 PHE CA C 80 57.257 56.664 0.593 1
1 908 . 19 1 1 A 80 80 PHE CB C 80 44.655 42.493 2.162 1
1 914 . 19 1 1 A 80 80 PHE N N 80 116.862 119.734 -2.872 1
1 915 . 19 1 1 A 81 81 SER H H 81 9.413 8.775 0.638 1
1 916 . 19 1 1 A 81 81 SER HA H 81 4.622 4.524 0.098 1
1 919 . 19 1 1 A 81 81 SER C C 81 173.735 174.942 -1.207 1
1 920 . 19 1 1 A 81 81 SER CA C 81 61.410 62.073 -0.663 1
1 921 . 19 1 1 A 81 81 SER CB C 81 64.165 63.096 1.069 1
1 922 . 19 1 1 A 81 81 SER N N 81 116.467 116.854 -0.387 1
1 923 . 19 1 1 A 82 82 ASN H H 82 7.688 8.166 -0.478 1
1 924 . 19 1 1 A 82 82 ASN HA H 82 4.952 5.294 -0.342 1
1 929 . 19 1 1 A 82 82 ASN C C 82 173.303 175.463 -2.160 1
1 930 . 19 1 1 A 82 82 ASN CA C 82 52.086 52.299 -0.213 1
1 931 . 19 1 1 A 82 82 ASN CB C 82 41.258 40.878 0.380 1
1 932 . 19 1 1 A 82 82 ASN N N 82 113.355 116.760 -3.405 1
1 934 . 19 1 1 A 83 83 ILE H H 83 8.858 8.790 0.068 1
1 935 . 19 1 1 A 83 83 ILE HA H 83 3.571 3.691 -0.120 1
1 945 . 19 1 1 A 83 83 ILE CA C 83 66.416 65.387 1.029 1
1 946 . 19 1 1 A 83 83 ILE CB C 83 35.074 34.674 0.400 1
1 950 . 19 1 1 A 83 83 ILE N N 83 118.908 122.752 -3.844 1
1 951 . 19 1 1 A 84 84 PRO HA H 84 4.411 4.597 -0.186 1
1 958 . 19 1 1 A 84 84 PRO C C 84 177.616 179.567 -1.951 1
1 959 . 19 1 1 A 84 84 PRO CA C 84 67.525 66.624 0.901 1
1 960 . 19 1 1 A 84 84 PRO CB C 84 31.029 30.795 0.234 1
1 963 . 19 1 1 A 85 85 GLN H H 85 8.405 8.230 0.175 1
1 964 . 19 1 1 A 85 85 GLN HA H 85 3.874 4.016 -0.142 1
1 971 . 19 1 1 A 85 85 GLN C C 85 178.213 178.256 -0.043 1
1 972 . 19 1 1 A 85 85 GLN CA C 85 59.495 58.938 0.557 1
1 973 . 19 1 1 A 85 85 GLN CB C 85 29.270 28.150 1.120 1
1 975 . 19 1 1 A 85 85 GLN N N 85 115.597 117.328 -1.731 1
1 977 . 19 1 1 A 86 86 LEU H H 86 7.136 8.219 -1.083 1
1 978 . 19 1 1 A 86 86 LEU HA H 86 3.589 3.746 -0.157 1
1 988 . 19 1 1 A 86 86 LEU C C 86 177.728 178.510 -0.782 1
1 989 . 19 1 1 A 86 86 LEU CA C 86 58.136 58.380 -0.244 1
1 990 . 19 1 1 A 86 86 LEU CB C 86 42.290 41.831 0.459 1
1 994 . 19 1 1 A 86 86 LEU N N 86 121.840 121.861 -0.021 1
1 995 . 19 1 1 A 87 87 ILE H H 87 8.323 8.140 0.183 1
1 996 . 19 1 1 A 87 87 ILE HA H 87 3.415 3.360 0.055 1
1 1006 . 19 1 1 A 87 87 ILE C C 87 178.064 177.649 0.415 1
1 1007 . 19 1 1 A 87 87 ILE CA C 87 61.458 65.433 -3.975 1
1 1008 . 19 1 1 A 87 87 ILE CB C 87 34.561 37.676 -3.115 1
1 1012 . 19 1 1 A 87 87 ILE N N 87 118.117 119.587 -1.470 1
1 1013 . 19 1 1 A 88 88 ASP H H 88 8.805 8.467 0.338 1
1 1014 . 19 1 1 A 88 88 ASP HA H 88 4.548 4.342 0.206 1
1 1017 . 19 1 1 A 88 88 ASP C C 88 179.265 178.156 1.109 1
1 1018 . 19 1 1 A 88 88 ASP CA C 88 58.099 57.404 0.695 1
1 1019 . 19 1 1 A 88 88 ASP CB C 88 42.166 41.826 0.340 1
1 1020 . 19 1 1 A 88 88 ASP N N 88 119.143 120.508 -1.365 1
1 1021 . 19 1 1 A 89 89 HIS H H 89 8.113 8.065 0.048 1
1 1022 . 19 1 1 A 89 89 HIS HA H 89 4.225 4.247 -0.022 1
1 1026 . 19 1 1 A 89 89 HIS C C 89 179.261 177.051 2.210 1
1 1027 . 19 1 1 A 89 89 HIS CA C 89 60.647 59.054 1.593 1
1 1028 . 19 1 1 A 89 89 HIS CB C 89 30.801 29.506 1.295 1
1 1030 . 19 1 1 A 89 89 HIS N N 89 119.595 119.042 0.553 1
1 1031 . 19 1 1 A 90 90 HIS H H 90 7.685 7.892 -0.207 1
1 1032 . 19 1 1 A 90 90 HIS HA H 90 3.628 4.092 -0.464 1
1 1036 . 19 1 1 A 90 90 HIS C C 90 178.454 177.593 0.861 1
1 1037 . 19 1 1 A 90 90 HIS CA C 90 61.797 59.918 1.879 1
1 1038 . 19 1 1 A 90 90 HIS CB C 90 28.165 29.720 -1.555 1
1 1040 . 19 1 1 A 90 90 HIS N N 90 120.061 117.430 2.631 1
1 1041 . 19 1 1 A 91 91 TYR H H 91 9.394 8.245 1.149 1
1 1042 . 19 1 1 A 91 91 TYR HA H 91 4.238 3.848 0.390 1
1 1049 . 19 1 1 A 91 91 TYR C C 91 176.443 177.873 -1.430 1
1 1050 . 19 1 1 A 91 91 TYR CA C 91 60.669 61.765 -1.096 1
1 1051 . 19 1 1 A 91 91 TYR CB C 91 39.169 39.130 0.039 1
1 1056 . 19 1 1 A 91 91 TYR N N 91 123.532 120.112 3.420 1
1 1057 . 19 1 1 A 92 92 THR H H 92 8.774 8.401 0.373 1
1 1058 . 19 1 1 A 92 92 THR HA H 92 3.866 3.988 -0.122 1
1 1063 . 19 1 1 A 92 92 THR C C 92 177.050 175.924 1.126 1
1 1064 . 19 1 1 A 92 92 THR CA C 92 65.240 64.993 0.247 1
1 1065 . 19 1 1 A 92 92 THR CB C 92 69.298 68.760 0.538 1
1 1067 . 19 1 1 A 92 92 THR N N 92 112.000 112.116 -0.116 1
1 1068 . 19 1 1 A 93 93 THR H H 93 7.617 7.267 0.350 1
1 1069 . 19 1 1 A 93 93 THR HA H 93 4.133 4.201 -0.068 1
1 1074 . 19 1 1 A 93 93 THR C C 93 176.234 174.879 1.355 1
1 1075 . 19 1 1 A 93 93 THR CA C 93 63.527 61.842 1.685 1
1 1076 . 19 1 1 A 93 93 THR CB C 93 71.234 69.832 1.402 1
1 1078 . 19 1 1 A 93 93 THR N N 93 109.883 111.165 -1.282 1
1 1079 . 19 1 1 A 94 94 LYS H H 94 7.210 7.639 -0.429 1
1 1080 . 19 1 1 A 94 94 LYS HA H 94 3.830 3.764 0.066 1
1 1089 . 19 1 1 A 94 94 LYS C C 94 174.331 175.952 -1.621 1
1 1090 . 19 1 1 A 94 94 LYS CA C 94 56.776 57.509 -0.733 1
1 1091 . 19 1 1 A 94 94 LYS CB C 94 28.095 30.885 -2.790 1
1 1095 . 19 1 1 A 94 94 LYS N N 94 112.818 120.764 -7.946 1
1 1096 . 19 1 1 A 95 95 GLN H H 95 7.439 7.465 -0.026 1
1 1097 . 19 1 1 A 95 95 GLN HA H 95 4.216 4.513 -0.297 1
1 1104 . 19 1 1 A 95 95 GLN C C 95 179.087 175.740 3.347 1
1 1105 . 19 1 1 A 95 95 GLN CA C 95 56.378 55.375 1.003 1
1 1106 . 19 1 1 A 95 95 GLN CB C 95 28.542 29.890 -1.348 1
1 1108 . 19 1 1 A 95 95 GLN N N 95 117.860 119.750 -1.890 1
1 1110 . 19 1 1 A 96 96 VAL H H 96 8.520 8.559 -0.039 1
1 1111 . 19 1 1 A 96 96 VAL HA H 96 4.297 4.264 0.033 1
1 1119 . 19 1 1 A 96 96 VAL C C 96 177.329 176.719 0.610 1
1 1120 . 19 1 1 A 96 96 VAL CA C 96 61.196 62.375 -1.179 1
1 1121 . 19 1 1 A 96 96 VAL CB C 96 32.735 32.768 -0.033 1
1 1124 . 19 1 1 A 96 96 VAL N N 96 124.208 124.040 0.168 1
1 1125 . 19 1 1 A 97 97 ILE H H 97 8.491 8.333 0.158 1
1 1126 . 19 1 1 A 97 97 ILE HA H 97 2.995 3.509 -0.514 1
1 1136 . 19 1 1 A 97 97 ILE CA C 97 62.066 63.522 -1.456 1
1 1137 . 19 1 1 A 97 97 ILE CB C 97 36.117 37.597 -1.480 1
1 1141 . 19 1 1 A 97 97 ILE N N 97 119.561 125.222 -5.661 1
1 1142 . 19 1 1 A 98 98 THR HA H 98 4.460 4.607 -0.147 1
1 1147 . 19 1 1 A 98 98 THR C C 98 174.335 174.654 -0.319 1
1 1148 . 19 1 1 A 98 98 THR CA C 98 58.244 59.484 -1.240 1
1 1149 . 19 1 1 A 98 98 THR CB C 98 73.056 71.871 1.185 1
1 1151 . 19 1 1 A 99 99 LYS H H 99 9.761 8.967 0.794 1
1 1152 . 19 1 1 A 99 99 LYS HA H 99 3.911 4.004 -0.093 1
1 1161 . 19 1 1 A 99 99 LYS C C 99 179.594 178.536 1.058 1
1 1162 . 19 1 1 A 99 99 LYS CA C 99 59.661 59.347 0.314 1
1 1163 . 19 1 1 A 99 99 LYS CB C 99 31.978 32.085 -0.107 1
1 1167 . 19 1 1 A 99 99 LYS N N 99 125.750 122.142 3.608 1
1 1168 . 19 1 1 A 100 100 LYS H H 100 8.910 7.313 1.597 1
1 1169 . 19 1 1 A 100 100 LYS HA H 100 4.024 4.162 -0.138 1
1 1178 . 19 1 1 A 100 100 LYS C C 100 178.060 177.263 0.797 1
1 1179 . 19 1 1 A 100 100 LYS CA C 100 58.642 58.657 -0.015 1
1 1180 . 19 1 1 A 100 100 LYS CB C 100 32.750 32.311 0.439 1
1 1184 . 19 1 1 A 100 100 LYS N N 100 117.112 119.522 -2.410 1
1 1185 . 19 1 1 A 101 101 SER H H 101 7.721 7.565 0.156 1
1 1186 . 19 1 1 A 101 101 SER HA H 101 4.282 4.682 -0.400 1
1 1189 . 19 1 1 A 101 101 SER C C 101 176.403 175.137 1.266 1
1 1190 . 19 1 1 A 101 101 SER CA C 101 60.442 58.988 1.454 1
1 1191 . 19 1 1 A 101 101 SER CB C 101 63.775 66.020 -2.245 1
1 1192 . 19 1 1 A 101 101 SER N N 101 112.069 111.040 1.029 1
1 1193 . 19 1 1 A 102 102 GLY H H 102 8.038 8.466 -0.428 1
1 1194 . 19 1 1 A 102 102 GLY HA2 H 102 4.024 3.927 0.097 1
1 1195 . 19 1 1 A 102 102 GLY HA3 H 102 3.713 3.945 -0.232 1
1 1196 . 19 1 1 A 102 102 GLY C C 102 173.991 174.538 -0.547 1
1 1197 . 19 1 1 A 102 102 GLY CA C 102 46.458 46.773 -0.315 1
1 1198 . 19 1 1 A 102 102 GLY N N 102 111.144 110.545 0.599 1
1 1199 . 19 1 1 A 103 103 VAL H H 103 7.155 7.718 -0.563 1
1 1200 . 19 1 1 A 103 103 VAL HA H 103 3.652 4.244 -0.592 1
1 1208 . 19 1 1 A 103 103 VAL C C 103 173.805 174.894 -1.089 1
1 1209 . 19 1 1 A 103 103 VAL CA C 103 64.310 62.125 2.185 1
1 1210 . 19 1 1 A 103 103 VAL CB C 103 32.254 33.102 -0.848 1
1 1213 . 19 1 1 A 103 103 VAL N N 103 119.836 119.926 -0.090 1
1 1214 . 19 1 1 A 104 104 VAL H H 104 7.653 9.163 -1.510 1
1 1215 . 19 1 1 A 104 104 VAL HA H 104 4.048 4.461 -0.413 1
1 1223 . 19 1 1 A 104 104 VAL C C 104 175.708 174.636 1.072 1
1 1224 . 19 1 1 A 104 104 VAL CA C 104 60.275 61.094 -0.819 1
1 1225 . 19 1 1 A 104 104 VAL CB C 104 35.112 33.829 1.283 1
1 1228 . 19 1 1 A 104 104 VAL N N 104 125.859 128.513 -2.654 1
1 1229 . 19 1 1 A 105 105 LEU H H 105 8.616 8.293 0.323 1
1 1230 . 19 1 1 A 105 105 LEU HA H 105 3.905 4.511 -0.606 1
1 1240 . 19 1 1 A 105 105 LEU C C 105 175.380 175.922 -0.542 1
1 1241 . 19 1 1 A 105 105 LEU CA C 105 54.471 53.977 0.494 1
1 1242 . 19 1 1 A 105 105 LEU CB C 105 39.821 40.779 -0.958 1
1 1246 . 19 1 1 A 105 105 LEU N N 105 123.839 126.591 -2.752 1
1 1247 . 19 1 1 A 106 106 LEU H H 106 8.894 8.681 0.213 1
1 1248 . 19 1 1 A 106 106 LEU HA H 106 4.839 5.132 -0.293 1
1 1258 . 19 1 1 A 106 106 LEU C C 106 176.930 176.011 0.919 1
1 1259 . 19 1 1 A 106 106 LEU CA C 106 56.288 53.091 3.197 1
1 1260 . 19 1 1 A 106 106 LEU CB C 106 45.237 45.501 -0.264 1
1 1264 . 19 1 1 A 106 106 LEU N N 106 120.590 121.332 -0.742 1
1 1265 . 19 1 1 A 107 107 ASN H H 107 8.124 8.973 -0.849 1
1 1266 . 19 1 1 A 107 107 ASN HA H 107 5.650 4.313 1.337 1
1 1271 . 19 1 1 A 107 107 ASN CA C 107 50.293 53.923 -3.630 1
1 1272 . 19 1 1 A 107 107 ASN CB C 107 41.223 37.215 4.008 1
1 1273 . 19 1 1 A 107 107 ASN N N 107 116.866 116.211 0.655 1
1 1275 . 19 1 1 A 108 108 PRO HA H 108 2.926 3.983 -1.057 1
1 1282 . 19 1 1 A 108 108 PRO C C 108 176.671 176.560 0.111 1
1 1283 . 19 1 1 A 108 108 PRO CA C 108 60.804 62.459 -1.655 1
1 1284 . 19 1 1 A 108 108 PRO CB C 108 31.774 31.463 0.311 1
1 1287 . 19 1 1 A 109 109 ILE H H 109 8.648 7.574 1.074 1
1 1288 . 19 1 1 A 109 109 ILE HA H 109 4.519 4.212 0.307 1
1 1298 . 19 1 1 A 109 109 ILE CA C 109 55.070 59.928 -4.858 1
1 1299 . 19 1 1 A 109 109 ILE CB C 109 36.068 37.891 -1.823 1
1 1303 . 19 1 1 A 109 109 ILE N N 109 128.817 124.059 4.758 1
1 1304 . 19 1 1 A 110 110 PRO HA H 110 4.587 4.526 0.061 1
1 1311 . 19 1 1 A 110 110 PRO C C 110 177.013 176.426 0.587 1
1 1312 . 19 1 1 A 110 110 PRO CA C 110 61.850 62.547 -0.697 1
1 1313 . 19 1 1 A 110 110 PRO CB C 110 32.507 32.316 0.191 1
1 1316 . 19 1 1 A 111 111 LYS H H 111 8.038 8.253 -0.215 1
1 1317 . 19 1 1 A 111 111 LYS HA H 111 3.553 4.570 -1.017 1
1 1326 . 19 1 1 A 111 111 LYS C C 111 176.123 174.911 1.212 1
1 1327 . 19 1 1 A 111 111 LYS CA C 111 56.220 54.964 1.256 1
1 1328 . 19 1 1 A 111 111 LYS CB C 111 32.373 34.031 -1.658 1
1 1332 . 19 1 1 A 111 111 LYS N N 111 120.147 117.796 2.351 1
1 1333 . 19 1 1 A 112 112 ASP H H 112 8.463 8.814 -0.351 1
1 1334 . 19 1 1 A 112 112 ASP HA H 112 4.523 4.838 -0.315 1
1 1337 . 19 1 1 A 112 112 ASP C C 112 175.986 177.079 -1.093 1
1 1338 . 19 1 1 A 112 112 ASP CA C 112 54.256 53.342 0.914 1
1 1339 . 19 1 1 A 112 112 ASP CB C 112 41.563 41.909 -0.346 1
1 1340 . 19 1 1 A 112 112 ASP N N 112 121.863 123.985 -2.122 1
1 1341 . 19 1 1 A 113 113 LYS H H 113 8.059 8.511 -0.452 1
1 1342 . 19 1 1 A 113 113 LYS HA H 113 4.136 4.086 0.050 1
1 1351 . 19 1 1 A 113 113 LYS C C 113 176.010 175.701 0.309 1
1 1352 . 19 1 1 A 113 113 LYS CA C 113 56.253 56.383 -0.130 1
1 1353 . 19 1 1 A 113 113 LYS CB C 113 32.754 31.991 0.763 1
1 1357 . 19 1 1 A 113 113 LYS N N 113 121.725 121.054 0.671 1
1 1358 . 19 1 1 A 114 114 LYS H H 114 8.225 7.378 0.847 1
1 1359 . 19 1 1 A 114 114 LYS HA H 114 4.169 4.424 -0.255 1
1 1368 . 19 1 1 A 114 114 LYS C C 114 176.198 176.333 -0.135 1
1 1369 . 19 1 1 A 114 114 LYS CA C 114 56.413 55.294 1.119 1
1 1370 . 19 1 1 A 114 114 LYS CB C 114 32.725 33.293 -0.568 1
1 1374 . 19 1 1 A 114 114 LYS N N 114 121.857 118.938 2.919 1
1 1375 . 19 1 1 A 115 115 TRP H H 115 8.078 8.517 -0.439 1
1 1376 . 19 1 1 A 115 115 TRP HA H 115 4.709 4.909 -0.200 1
1 1385 . 19 1 1 A 115 115 TRP C C 115 175.119 176.573 -1.454 1
1 1386 . 19 1 1 A 115 115 TRP CA C 115 56.856 56.395 0.461 1
1 1387 . 19 1 1 A 115 115 TRP CB C 115 29.474 29.134 0.340 1
1 1393 . 19 1 1 A 115 115 TRP N N 115 122.068 121.910 0.158 1
1 1 . 20 1 1 A 10 10 HIS HA H 10 4.616 4.235 0.381 1
1 4 . 20 1 1 A 10 10 HIS C C 10 174.981 175.157 -0.176 1
1 5 . 20 1 1 A 10 10 HIS CA C 10 56.555 56.794 -0.239 1
1 6 . 20 1 1 A 10 10 HIS CB C 10 30.231 28.172 2.059 1
1 7 . 20 1 1 A 11 11 MET H H 11 8.103 7.990 0.113 1
1 8 . 20 1 1 A 11 11 MET HA H 11 4.439 4.495 -0.056 1
1 13 . 20 1 1 A 11 11 MET C C 11 175.888 175.449 0.439 1
1 14 . 20 1 1 A 11 11 MET CA C 11 55.090 55.647 -0.557 1
1 15 . 20 1 1 A 11 11 MET CB C 11 33.121 33.646 -0.525 1
1 17 . 20 1 1 A 11 11 MET N N 11 120.743 124.027 -3.284 1
1 18 . 20 1 1 A 12 12 LYS H H 12 8.065 8.513 -0.448 1
1 19 . 20 1 1 A 12 12 LYS HA H 12 4.407 4.680 -0.273 1
1 28 . 20 1 1 A 12 12 LYS CA C 12 54.894 52.194 2.700 1
1 29 . 20 1 1 A 12 12 LYS CB C 12 31.863 34.393 -2.530 1
1 33 . 20 1 1 A 12 12 LYS N N 12 123.187 126.408 -3.221 1
1 34 . 20 1 1 A 13 13 PRO HA H 13 4.347 4.459 -0.112 1
1 41 . 20 1 1 A 13 13 PRO C C 13 176.891 177.300 -0.409 1
1 42 . 20 1 1 A 13 13 PRO CA C 13 62.542 62.225 0.317 1
1 43 . 20 1 1 A 13 13 PRO CB C 13 32.663 33.313 -0.650 1
1 46 . 20 1 1 A 14 14 LEU H H 14 8.339 8.771 -0.432 1
1 47 . 20 1 1 A 14 14 LEU HA H 14 3.373 3.803 -0.430 1
1 57 . 20 1 1 A 14 14 LEU C C 14 176.683 178.172 -1.489 1
1 58 . 20 1 1 A 14 14 LEU CA C 14 58.555 57.545 1.010 1
1 59 . 20 1 1 A 14 14 LEU CB C 14 41.828 40.944 0.884 1
1 63 . 20 1 1 A 14 14 LEU N N 14 123.191 123.457 -0.266 1
1 64 . 20 1 1 A 15 15 ALA H H 15 8.175 7.839 0.336 1
1 65 . 20 1 1 A 15 15 ALA HA H 15 3.983 4.229 -0.246 1
1 69 . 20 1 1 A 15 15 ALA C C 15 178.697 178.111 0.586 1
1 70 . 20 1 1 A 15 15 ALA CA C 15 54.164 54.343 -0.179 1
1 71 . 20 1 1 A 15 15 ALA CB C 15 18.771 18.246 0.525 1
1 72 . 20 1 1 A 15 15 ALA N N 15 113.594 119.934 -6.340 1
1 73 . 20 1 1 A 16 16 GLU H H 16 7.458 7.710 -0.252 1
1 74 . 20 1 1 A 16 16 GLU HA H 16 4.266 4.292 -0.026 1
1 79 . 20 1 1 A 16 16 GLU C C 16 176.510 176.431 0.079 1
1 80 . 20 1 1 A 16 16 GLU CA C 16 55.196 56.236 -1.040 1
1 81 . 20 1 1 A 16 16 GLU CB C 16 30.907 30.297 0.610 1
1 83 . 20 1 1 A 16 16 GLU N N 16 113.348 115.470 -2.122 1
1 84 . 20 1 1 A 17 17 GLN H H 17 7.501 7.091 0.410 1
1 85 . 20 1 1 A 17 17 GLN HA H 17 3.683 4.078 -0.395 1
1 92 . 20 1 1 A 17 17 GLN C C 17 178.053 176.221 1.832 1
1 93 . 20 1 1 A 17 17 GLN CA C 17 54.606 55.284 -0.678 1
1 94 . 20 1 1 A 17 17 GLN CB C 17 25.758 28.333 -2.575 1
1 96 . 20 1 1 A 17 17 GLN N N 17 119.411 119.823 -0.412 1
1 98 . 20 1 1 A 18 18 ASP H H 18 8.949 8.514 0.435 1
1 99 . 20 1 1 A 18 18 ASP HA H 18 4.184 3.997 0.187 1
1 102 . 20 1 1 A 18 18 ASP C C 18 175.263 178.398 -3.135 1
1 103 . 20 1 1 A 18 18 ASP CA C 18 57.275 57.614 -0.339 1
1 104 . 20 1 1 A 18 18 ASP CB C 18 40.620 40.188 0.432 1
1 105 . 20 1 1 A 18 18 ASP N N 18 124.676 123.402 1.274 1
1 106 . 20 1 1 A 19 19 TRP H H 19 6.068 7.463 -1.395 1
1 107 . 20 1 1 A 19 19 TRP HA H 19 5.045 4.618 0.427 1
1 116 . 20 1 1 A 19 19 TRP C C 19 175.902 176.428 -0.526 1
1 117 . 20 1 1 A 19 19 TRP CA C 19 53.542 58.075 -4.533 1
1 118 . 20 1 1 A 19 19 TRP CB C 19 29.179 28.701 0.478 1
1 124 . 20 1 1 A 19 19 TRP N N 19 107.757 117.738 -9.981 1
1 126 . 20 1 1 A 20 20 TYR H H 20 7.430 7.333 0.097 1
1 127 . 20 1 1 A 20 20 TYR HA H 20 5.601 5.239 0.362 1
1 132 . 20 1 1 A 20 20 TYR C C 20 175.498 175.523 -0.025 1
1 133 . 20 1 1 A 20 20 TYR CA C 20 56.967 57.118 -0.151 1
1 134 . 20 1 1 A 20 20 TYR CB C 20 39.083 38.397 0.686 1
1 137 . 20 1 1 A 20 20 TYR N N 20 123.173 121.932 1.241 1
1 138 . 20 1 1 A 21 21 HIS H H 21 8.934 8.640 0.294 1
1 139 . 20 1 1 A 21 21 HIS HA H 21 4.295 4.408 -0.113 1
1 144 . 20 1 1 A 21 21 HIS C C 21 175.177 175.002 0.175 1
1 145 . 20 1 1 A 21 21 HIS CA C 21 56.572 56.080 0.492 1
1 146 . 20 1 1 A 21 21 HIS CB C 21 33.365 30.710 2.655 1
1 149 . 20 1 1 A 21 21 HIS N N 21 125.732 127.384 -1.652 1
1 150 . 20 1 1 A 22 22 GLY H H 22 5.280 6.877 -1.597 1
1 151 . 20 1 1 A 22 22 GLY HA2 H 22 3.905 3.638 0.267 1
1 152 . 20 1 1 A 22 22 GLY HA3 H 22 3.585 4.084 -0.499 1
1 153 . 20 1 1 A 22 22 GLY C C 22 174.411 174.097 0.314 1
1 154 . 20 1 1 A 22 22 GLY CA C 22 46.402 44.496 1.906 1
1 155 . 20 1 1 A 22 22 GLY N N 22 104.568 106.643 -2.075 1
1 156 . 20 1 1 A 23 23 ALA H H 23 8.768 8.237 0.531 1
1 157 . 20 1 1 A 23 23 ALA HA H 23 5.171 4.715 0.456 1
1 161 . 20 1 1 A 23 23 ALA C C 23 177.180 176.799 0.381 1
1 162 . 20 1 1 A 23 23 ALA CA C 23 51.153 51.260 -0.107 1
1 163 . 20 1 1 A 23 23 ALA CB C 23 16.999 17.324 -0.325 1
1 164 . 20 1 1 A 23 23 ALA N N 23 130.297 123.773 6.524 1
1 165 . 20 1 1 A 24 24 ILE H H 24 7.267 7.849 -0.582 1
1 166 . 20 1 1 A 24 24 ILE HA H 24 4.460 4.809 -0.349 1
1 176 . 20 1 1 A 24 24 ILE CA C 24 58.529 59.077 -0.548 1
1 177 . 20 1 1 A 24 24 ILE CB C 24 38.763 38.636 0.127 1
1 181 . 20 1 1 A 24 24 ILE N N 24 118.903 117.537 1.366 1
1 182 . 20 1 1 A 25 25 PRO HA H 25 4.224 4.241 -0.017 1
1 189 . 20 1 1 A 25 25 PRO C C 25 176.918 177.506 -0.588 1
1 190 . 20 1 1 A 25 25 PRO CA C 25 62.907 62.426 0.481 1
1 191 . 20 1 1 A 25 25 PRO CB C 25 32.671 32.518 0.153 1
1 194 . 20 1 1 A 26 26 ARG H H 26 8.781 9.059 -0.278 1
1 195 . 20 1 1 A 26 26 ARG HA H 26 3.472 3.891 -0.419 1
1 202 . 20 1 1 A 26 26 ARG C C 26 178.112 178.128 -0.016 1
1 203 . 20 1 1 A 26 26 ARG CA C 26 60.863 59.468 1.395 1
1 204 . 20 1 1 A 26 26 ARG CB C 26 30.314 29.723 0.591 1
1 207 . 20 1 1 A 26 26 ARG N N 26 124.635 120.981 3.654 1
1 208 . 20 1 1 A 27 27 ILE H H 27 8.540 8.106 0.434 1
1 209 . 20 1 1 A 27 27 ILE HA H 27 3.787 3.683 0.104 1
1 219 . 20 1 1 A 27 27 ILE C C 27 177.390 177.682 -0.292 1
1 220 . 20 1 1 A 27 27 ILE CA C 27 64.329 64.790 -0.461 1
1 221 . 20 1 1 A 27 27 ILE CB C 27 37.413 37.985 -0.572 1
1 225 . 20 1 1 A 27 27 ILE N N 27 115.859 119.954 -4.095 1
1 226 . 20 1 1 A 28 28 GLU H H 28 6.953 8.397 -1.444 1
1 227 . 20 1 1 A 28 28 GLU HA H 28 4.067 4.031 0.036 1
1 232 . 20 1 1 A 28 28 GLU C C 28 179.006 179.066 -0.060 1
1 233 . 20 1 1 A 28 28 GLU CA C 28 58.985 59.595 -0.610 1
1 234 . 20 1 1 A 28 28 GLU CB C 28 29.316 29.392 -0.076 1
1 236 . 20 1 1 A 28 28 GLU N N 28 120.554 119.417 1.137 1
1 237 . 20 1 1 A 29 29 ALA H H 29 7.999 8.142 -0.143 1
1 238 . 20 1 1 A 29 29 ALA HA H 29 3.822 4.068 -0.246 1
1 242 . 20 1 1 A 29 29 ALA C C 29 178.809 179.901 -1.092 1
1 243 . 20 1 1 A 29 29 ALA CA C 29 54.698 54.770 -0.072 1
1 244 . 20 1 1 A 29 29 ALA CB C 29 18.059 18.505 -0.446 1
1 245 . 20 1 1 A 29 29 ALA N N 29 120.122 122.828 -2.706 1
1 246 . 20 1 1 A 30 30 GLN H H 30 8.168 7.866 0.302 1
1 247 . 20 1 1 A 30 30 GLN HA H 30 3.811 4.192 -0.381 1
1 254 . 20 1 1 A 30 30 GLN C C 30 177.578 178.291 -0.713 1
1 255 . 20 1 1 A 30 30 GLN CA C 30 59.731 58.700 1.031 1
1 256 . 20 1 1 A 30 30 GLN CB C 30 28.161 28.674 -0.513 1
1 258 . 20 1 1 A 30 30 GLN N N 30 112.109 115.913 -3.804 1
1 260 . 20 1 1 A 31 31 GLU H H 31 7.248 8.098 -0.850 1
1 261 . 20 1 1 A 31 31 GLU HA H 31 4.063 4.085 -0.022 1
1 266 . 20 1 1 A 31 31 GLU C C 31 177.423 179.211 -1.788 1
1 267 . 20 1 1 A 31 31 GLU CA C 31 57.650 59.123 -1.473 1
1 268 . 20 1 1 A 31 31 GLU CB C 31 29.757 29.168 0.589 1
1 270 . 20 1 1 A 31 31 GLU N N 31 115.340 119.588 -4.248 1
1 271 . 20 1 1 A 32 32 LEU H H 32 7.169 7.478 -0.309 1
1 272 . 20 1 1 A 32 32 LEU HA H 32 4.087 4.176 -0.089 1
1 282 . 20 1 1 A 32 32 LEU C C 32 175.850 176.954 -1.104 1
1 283 . 20 1 1 A 32 32 LEU CA C 32 55.580 56.735 -1.155 1
1 284 . 20 1 1 A 32 32 LEU CB C 32 42.910 41.625 1.285 1
1 288 . 20 1 1 A 32 32 LEU N N 32 116.367 115.679 0.688 1
1 289 . 20 1 1 A 33 33 LEU H H 33 7.062 7.601 -0.539 1
1 290 . 20 1 1 A 33 33 LEU HA H 33 4.431 4.421 0.010 1
1 300 . 20 1 1 A 33 33 LEU C C 33 174.837 177.036 -2.199 1
1 301 . 20 1 1 A 33 33 LEU CA C 33 53.521 54.746 -1.225 1
1 302 . 20 1 1 A 33 33 LEU CB C 33 43.301 42.193 1.108 1
1 306 . 20 1 1 A 33 33 LEU N N 33 118.568 122.439 -3.871 1
1 307 . 20 1 1 A 34 34 LYS H H 34 8.749 8.538 0.211 1
1 308 . 20 1 1 A 34 34 LYS HA H 34 4.162 4.110 0.052 1
1 317 . 20 1 1 A 34 34 LYS C C 34 174.378 175.328 -0.950 1
1 318 . 20 1 1 A 34 34 LYS CA C 34 56.575 56.255 0.320 1
1 319 . 20 1 1 A 34 34 LYS CB C 34 36.918 34.704 2.214 1
1 323 . 20 1 1 A 34 34 LYS N N 34 121.659 118.240 3.419 1
1 324 . 20 1 1 A 35 35 LYS H H 35 8.137 7.562 0.575 1
1 325 . 20 1 1 A 35 35 LYS HA H 35 4.011 4.734 -0.723 1
1 334 . 20 1 1 A 35 35 LYS C C 35 174.343 175.760 -1.417 1
1 335 . 20 1 1 A 35 35 LYS CA C 35 53.960 54.996 -1.036 1
1 336 . 20 1 1 A 35 35 LYS CB C 35 35.587 34.586 1.001 1
1 340 . 20 1 1 A 35 35 LYS N N 35 119.354 116.485 2.869 1
1 341 . 20 1 1 A 36 36 GLN H H 36 8.394 8.700 -0.306 1
1 342 . 20 1 1 A 36 36 GLN HA H 36 4.187 4.778 -0.591 1
1 349 . 20 1 1 A 36 36 GLN C C 36 177.012 176.524 0.488 1
1 350 . 20 1 1 A 36 36 GLN CA C 36 57.750 57.521 0.229 1
1 351 . 20 1 1 A 36 36 GLN CB C 36 28.433 28.511 -0.078 1
1 353 . 20 1 1 A 36 36 GLN N N 36 120.248 123.397 -3.149 1
1 355 . 20 1 1 A 37 37 GLY H H 37 9.597 8.754 0.843 1
1 356 . 20 1 1 A 37 37 GLY HA2 H 37 4.486 4.137 0.349 1
1 357 . 20 1 1 A 37 37 GLY HA3 H 37 3.926 4.138 -0.212 1
1 358 . 20 1 1 A 37 37 GLY C C 37 176.285 174.629 1.656 1
1 359 . 20 1 1 A 37 37 GLY CA C 37 46.146 45.452 0.694 1
1 360 . 20 1 1 A 37 37 GLY N N 37 116.637 113.366 3.271 1
1 361 . 20 1 1 A 38 38 ASP H H 38 8.925 8.037 0.888 1
1 362 . 20 1 1 A 38 38 ASP HA H 38 5.697 4.714 0.983 1
1 365 . 20 1 1 A 38 38 ASP C C 38 176.181 175.674 0.507 1
1 366 . 20 1 1 A 38 38 ASP CA C 38 55.066 55.593 -0.527 1
1 367 . 20 1 1 A 38 38 ASP CB C 38 42.933 41.227 1.706 1
1 368 . 20 1 1 A 38 38 ASP N N 38 127.293 121.939 5.354 1
1 369 . 20 1 1 A 39 39 PHE H H 39 8.647 8.557 0.090 1
1 370 . 20 1 1 A 39 39 PHE HA H 39 6.025 6.032 -0.007 1
1 378 . 20 1 1 A 39 39 PHE C C 39 170.948 173.085 -2.137 1
1 379 . 20 1 1 A 39 39 PHE CA C 39 56.376 56.035 0.341 1
1 380 . 20 1 1 A 39 39 PHE CB C 39 44.583 43.335 1.248 1
1 386 . 20 1 1 A 39 39 PHE N N 39 117.102 119.772 -2.670 1
1 387 . 20 1 1 A 40 40 LEU H H 40 9.186 8.947 0.239 1
1 388 . 20 1 1 A 40 40 LEU HA H 40 4.983 5.403 -0.420 1
1 398 . 20 1 1 A 40 40 LEU C C 40 174.787 174.768 0.019 1
1 399 . 20 1 1 A 40 40 LEU CA C 40 54.610 53.730 0.880 1
1 400 . 20 1 1 A 40 40 LEU CB C 40 44.330 46.216 -1.886 1
1 404 . 20 1 1 A 40 40 LEU N N 40 114.388 118.800 -4.412 1
1 405 . 20 1 1 A 41 41 VAL H H 41 9.390 9.692 -0.302 1
1 406 . 20 1 1 A 41 41 VAL HA H 41 5.742 5.241 0.501 1
1 414 . 20 1 1 A 41 41 VAL C C 41 172.760 176.152 -3.392 1
1 415 . 20 1 1 A 41 41 VAL CA C 41 60.814 61.935 -1.121 1
1 416 . 20 1 1 A 41 41 VAL CB C 41 34.908 33.176 1.732 1
1 419 . 20 1 1 A 41 41 VAL N N 41 119.873 123.069 -3.196 1
1 420 . 20 1 1 A 42 42 ARG H H 42 9.598 9.279 0.319 1
1 421 . 20 1 1 A 42 42 ARG HA H 42 5.247 5.277 -0.030 1
1 429 . 20 1 1 A 42 42 ARG C C 42 173.379 174.623 -1.244 1
1 430 . 20 1 1 A 42 42 ARG CA C 42 53.202 54.853 -1.651 1
1 431 . 20 1 1 A 42 42 ARG CB C 42 33.507 32.907 0.600 1
1 434 . 20 1 1 A 42 42 ARG N N 42 124.179 125.021 -0.842 1
1 436 . 20 1 1 A 43 43 GLU H H 43 8.234 8.800 -0.566 1
1 437 . 20 1 1 A 43 43 GLU HA H 43 4.890 4.624 0.266 1
1 442 . 20 1 1 A 43 43 GLU C C 43 176.929 176.530 0.399 1
1 443 . 20 1 1 A 43 43 GLU CA C 43 54.846 55.039 -0.193 1
1 444 . 20 1 1 A 43 43 GLU CB C 43 31.599 31.586 0.013 1
1 446 . 20 1 1 A 43 43 GLU N N 43 124.103 122.724 1.379 1
1 447 . 20 1 1 A 44 44 SER H H 44 9.033 8.784 0.249 1
1 448 . 20 1 1 A 44 44 SER HA H 44 3.957 4.610 -0.653 1
1 451 . 20 1 1 A 44 44 SER C C 44 175.005 174.478 0.527 1
1 452 . 20 1 1 A 44 44 SER CA C 44 59.393 58.684 0.709 1
1 453 . 20 1 1 A 44 44 SER CB C 44 63.619 63.708 -0.089 1
1 454 . 20 1 1 A 44 44 SER N N 44 124.316 121.642 2.674 1
1 455 . 20 1 1 A 45 45 HIS H H 45 8.461 8.527 -0.066 1
1 456 . 20 1 1 A 45 45 HIS HA H 45 4.132 4.756 -0.624 1
1 460 . 20 1 1 A 45 45 HIS C C 45 176.480 176.531 -0.051 1
1 461 . 20 1 1 A 45 45 HIS CA C 45 58.887 55.065 3.822 1
1 462 . 20 1 1 A 45 45 HIS CB C 45 30.180 31.003 -0.823 1
1 464 . 20 1 1 A 45 45 HIS N N 45 127.694 122.368 5.326 1
1 465 . 20 1 1 A 46 46 GLY H H 46 8.513 8.927 -0.414 1
1 466 . 20 1 1 A 46 46 GLY HA2 H 46 3.827 3.869 -0.042 1
1 467 . 20 1 1 A 46 46 GLY HA3 H 46 3.827 3.887 -0.060 1
1 468 . 20 1 1 A 46 46 GLY C C 46 173.630 173.680 -0.050 1
1 469 . 20 1 1 A 46 46 GLY CA C 46 45.188 45.569 -0.381 1
1 470 . 20 1 1 A 46 46 GLY N N 46 110.761 111.515 -0.754 1
1 471 . 20 1 1 A 47 47 LYS H H 47 7.216 7.901 -0.685 1
1 472 . 20 1 1 A 47 47 LYS HA H 47 4.540 4.745 -0.205 1
1 481 . 20 1 1 A 47 47 LYS CA C 47 53.475 53.254 0.221 1
1 482 . 20 1 1 A 47 47 LYS CB C 47 33.325 33.868 -0.543 1
1 486 . 20 1 1 A 47 47 LYS N N 47 121.356 121.879 -0.523 1
1 487 . 20 1 1 A 48 48 PRO HA H 48 4.181 4.311 -0.130 1
1 494 . 20 1 1 A 48 48 PRO C C 48 178.920 177.481 1.439 1
1 495 . 20 1 1 A 48 48 PRO CA C 48 63.239 63.527 -0.288 1
1 496 . 20 1 1 A 48 48 PRO CB C 48 31.523 31.056 0.467 1
1 499 . 20 1 1 A 49 49 GLY H H 49 9.752 8.427 1.325 1
1 500 . 20 1 1 A 49 49 GLY HA2 H 49 4.053 4.109 -0.056 1
1 501 . 20 1 1 A 49 49 GLY HA3 H 49 3.374 4.235 -0.861 1
1 502 . 20 1 1 A 49 49 GLY C C 49 172.093 174.541 -2.448 1
1 503 . 20 1 1 A 49 49 GLY CA C 49 45.041 45.286 -0.245 1
1 504 . 20 1 1 A 49 49 GLY N N 49 112.415 112.964 -0.549 1
1 505 . 20 1 1 A 50 50 GLU H H 50 7.623 7.841 -0.218 1
1 506 . 20 1 1 A 50 50 GLU HA H 50 4.537 4.499 0.038 1
1 511 . 20 1 1 A 50 50 GLU C C 50 173.297 174.857 -1.560 1
1 512 . 20 1 1 A 50 50 GLU CA C 50 55.174 55.912 -0.738 1
1 513 . 20 1 1 A 50 50 GLU CB C 50 31.651 29.653 1.998 1
1 515 . 20 1 1 A 50 50 GLU N N 50 121.600 121.941 -0.341 1
1 516 . 20 1 1 A 51 51 TYR H H 51 9.452 8.813 0.639 1
1 517 . 20 1 1 A 51 51 TYR HA H 51 5.382 5.510 -0.128 1
1 524 . 20 1 1 A 51 51 TYR C C 51 174.387 175.053 -0.666 1
1 525 . 20 1 1 A 51 51 TYR CA C 51 57.592 57.670 -0.078 1
1 526 . 20 1 1 A 51 51 TYR CB C 51 41.820 40.146 1.674 1
1 531 . 20 1 1 A 51 51 TYR N N 51 125.790 127.287 -1.497 1
1 532 . 20 1 1 A 52 52 VAL H H 52 9.471 9.504 -0.033 1
1 533 . 20 1 1 A 52 52 VAL HA H 52 4.840 5.239 -0.399 1
1 541 . 20 1 1 A 52 52 VAL C C 52 174.947 174.689 0.258 1
1 542 . 20 1 1 A 52 52 VAL CA C 52 60.991 61.467 -0.476 1
1 543 . 20 1 1 A 52 52 VAL CB C 52 36.829 33.674 3.155 1
1 546 . 20 1 1 A 52 52 VAL N N 52 120.617 123.970 -3.353 1
1 547 . 20 1 1 A 53 53 LEU H H 53 9.457 9.538 -0.081 1
1 548 . 20 1 1 A 53 53 LEU HA H 53 5.294 5.299 -0.005 1
1 558 . 20 1 1 A 53 53 LEU C C 53 175.024 174.784 0.240 1
1 559 . 20 1 1 A 53 53 LEU CA C 53 53.904 54.309 -0.405 1
1 560 . 20 1 1 A 53 53 LEU CB C 53 44.756 43.445 1.311 1
1 564 . 20 1 1 A 53 53 LEU N N 53 127.725 131.255 -3.530 1
1 565 . 20 1 1 A 54 54 SER H H 54 9.461 9.437 0.024 1
1 566 . 20 1 1 A 54 54 SER HA H 54 5.691 5.709 -0.018 1
1 569 . 20 1 1 A 54 54 SER C C 54 172.227 173.011 -0.784 1
1 570 . 20 1 1 A 54 54 SER CA C 54 58.551 57.998 0.553 1
1 571 . 20 1 1 A 54 54 SER CB C 54 65.738 64.100 1.638 1
1 572 . 20 1 1 A 54 54 SER N N 54 127.178 124.744 2.434 1
1 573 . 20 1 1 A 55 55 VAL H H 55 9.049 8.891 0.158 1
1 574 . 20 1 1 A 55 55 VAL HA H 55 5.691 5.590 0.101 1
1 582 . 20 1 1 A 55 55 VAL C C 55 173.959 172.968 0.991 1
1 583 . 20 1 1 A 55 55 VAL CA C 55 58.398 59.809 -1.411 1
1 584 . 20 1 1 A 55 55 VAL CB C 55 36.262 35.448 0.814 1
1 587 . 20 1 1 A 55 55 VAL N N 55 120.619 125.421 -4.802 1
1 588 . 20 1 1 A 56 56 TYR H H 56 8.629 9.177 -0.548 1
1 589 . 20 1 1 A 56 56 TYR HA H 56 4.951 4.860 0.091 1
1 596 . 20 1 1 A 56 56 TYR C C 56 175.224 174.803 0.421 1
1 597 . 20 1 1 A 56 56 TYR CA C 56 56.684 56.771 -0.087 1
1 598 . 20 1 1 A 56 56 TYR CB C 56 39.646 39.086 0.560 1
1 603 . 20 1 1 A 56 56 TYR N N 56 127.444 130.130 -2.686 1
1 604 . 20 1 1 A 57 57 SER H H 57 8.869 8.860 0.009 1
1 605 . 20 1 1 A 57 57 SER HA H 57 4.739 4.826 -0.087 1
1 608 . 20 1 1 A 57 57 SER C C 57 174.492 172.750 1.742 1
1 609 . 20 1 1 A 57 57 SER CA C 57 57.591 57.247 0.344 1
1 610 . 20 1 1 A 57 57 SER CB C 57 64.281 66.342 -2.061 1
1 611 . 20 1 1 A 57 57 SER N N 57 122.165 123.028 -0.863 1
1 612 . 20 1 1 A 58 58 ASP H H 58 10.446 9.322 1.124 1
1 613 . 20 1 1 A 58 58 ASP HA H 58 4.382 4.283 0.099 1
1 616 . 20 1 1 A 58 58 ASP C C 58 176.398 176.173 0.225 1
1 617 . 20 1 1 A 58 58 ASP CA C 58 55.215 55.266 -0.051 1
1 618 . 20 1 1 A 58 58 ASP CB C 58 39.513 39.214 0.299 1
1 619 . 20 1 1 A 58 58 ASP N N 58 132.098 128.157 3.941 1
1 620 . 20 1 1 A 59 59 GLY H H 59 7.861 8.366 -0.505 1
1 621 . 20 1 1 A 59 59 GLY HA2 H 59 3.817 3.543 0.274 1
1 622 . 20 1 1 A 59 59 GLY HA3 H 59 4.086 3.746 0.340 1
1 623 . 20 1 1 A 59 59 GLY C C 59 173.111 173.368 -0.257 1
1 624 . 20 1 1 A 59 59 GLY CA C 59 45.486 45.088 0.398 1
1 625 . 20 1 1 A 59 59 GLY N N 59 102.674 104.783 -2.109 1
1 626 . 20 1 1 A 60 60 GLN H H 60 7.137 7.750 -0.613 1
1 627 . 20 1 1 A 60 60 GLN HA H 60 4.455 4.537 -0.082 1
1 634 . 20 1 1 A 60 60 GLN C C 60 173.549 175.043 -1.494 1
1 635 . 20 1 1 A 60 60 GLN CA C 60 53.388 54.009 -0.621 1
1 636 . 20 1 1 A 60 60 GLN CB C 60 32.373 30.720 1.653 1
1 638 . 20 1 1 A 60 60 GLN N N 60 116.206 119.379 -3.173 1
1 640 . 20 1 1 A 61 61 ARG H H 61 8.589 8.450 0.139 1
1 641 . 20 1 1 A 61 61 ARG HA H 61 4.740 4.592 0.148 1
1 649 . 20 1 1 A 61 61 ARG C C 61 174.458 174.736 -0.278 1
1 650 . 20 1 1 A 61 61 ARG CA C 61 57.116 55.442 1.674 1
1 651 . 20 1 1 A 61 61 ARG CB C 61 29.615 30.604 -0.989 1
1 654 . 20 1 1 A 61 61 ARG N N 61 120.467 122.252 -1.785 1
1 656 . 20 1 1 A 62 62 ARG H H 62 8.867 8.525 0.342 1
1 657 . 20 1 1 A 62 62 ARG HA H 62 4.297 4.085 0.212 1
1 665 . 20 1 1 A 62 62 ARG C C 62 173.485 175.905 -2.420 1
1 666 . 20 1 1 A 62 62 ARG CA C 62 53.355 55.767 -2.412 1
1 667 . 20 1 1 A 62 62 ARG CB C 62 33.028 30.593 2.435 1
1 670 . 20 1 1 A 62 62 ARG N N 62 122.641 124.520 -1.879 1
1 672 . 20 1 1 A 63 63 HIS H H 63 7.997 8.365 -0.368 1
1 673 . 20 1 1 A 63 63 HIS HA H 63 5.427 5.209 0.218 1
1 678 . 20 1 1 A 63 63 HIS C C 63 174.946 173.871 1.075 1
1 679 . 20 1 1 A 63 63 HIS CA C 63 54.689 53.939 0.750 1
1 680 . 20 1 1 A 63 63 HIS CB C 63 33.008 31.919 1.089 1
1 683 . 20 1 1 A 63 63 HIS N N 63 119.064 119.739 -0.675 1
1 684 . 20 1 1 A 64 64 PHE H H 64 9.880 9.392 0.488 1
1 685 . 20 1 1 A 64 64 PHE HA H 64 4.824 5.063 -0.239 1
1 693 . 20 1 1 A 64 64 PHE C C 64 174.882 175.287 -0.405 1
1 694 . 20 1 1 A 64 64 PHE CA C 64 56.489 56.315 0.174 1
1 695 . 20 1 1 A 64 64 PHE CB C 64 41.405 42.294 -0.889 1
1 701 . 20 1 1 A 64 64 PHE N N 64 123.961 122.018 1.943 1
1 702 . 20 1 1 A 65 65 ILE H H 65 8.982 9.501 -0.519 1
1 703 . 20 1 1 A 65 65 ILE HA H 65 4.273 5.053 -0.780 1
1 713 . 20 1 1 A 65 65 ILE C C 65 176.556 175.607 0.949 1
1 714 . 20 1 1 A 65 65 ILE CA C 65 62.649 60.142 2.507 1
1 715 . 20 1 1 A 65 65 ILE CB C 65 38.296 40.419 -2.123 1
1 719 . 20 1 1 A 65 65 ILE N N 65 126.601 121.917 4.684 1
1 720 . 20 1 1 A 66 66 ILE H H 66 8.947 8.875 0.072 1
1 721 . 20 1 1 A 66 66 ILE HA H 66 3.780 4.059 -0.279 1
1 731 . 20 1 1 A 66 66 ILE C C 66 175.721 175.588 0.133 1
1 732 . 20 1 1 A 66 66 ILE CA C 66 62.960 60.802 2.158 1
1 733 . 20 1 1 A 66 66 ILE CB C 66 37.209 37.901 -0.692 1
1 737 . 20 1 1 A 66 66 ILE N N 66 130.139 128.916 1.223 1
1 738 . 20 1 1 A 67 67 GLN H H 67 8.410 8.874 -0.464 1
1 739 . 20 1 1 A 67 67 GLN HA H 67 4.422 4.830 -0.408 1
1 746 . 20 1 1 A 67 67 GLN C C 67 174.347 174.044 0.303 1
1 747 . 20 1 1 A 67 67 GLN CA C 67 55.867 55.200 0.667 1
1 748 . 20 1 1 A 67 67 GLN CB C 67 29.950 29.969 -0.019 1
1 750 . 20 1 1 A 67 67 GLN N N 67 128.872 126.986 1.886 1
1 752 . 20 1 1 A 68 68 TYR H H 68 8.619 8.936 -0.317 1
1 753 . 20 1 1 A 68 68 TYR HA H 68 5.300 4.670 0.630 1
1 760 . 20 1 1 A 68 68 TYR C C 68 174.695 174.224 0.471 1
1 761 . 20 1 1 A 68 68 TYR CA C 68 55.579 56.300 -0.721 1
1 762 . 20 1 1 A 68 68 TYR CB C 68 39.479 38.978 0.501 1
1 767 . 20 1 1 A 68 68 TYR N N 68 124.772 125.676 -0.904 1
1 768 . 20 1 1 A 69 69 VAL H H 69 8.539 8.710 -0.171 1
1 769 . 20 1 1 A 69 69 VAL HA H 69 4.046 4.257 -0.211 1
1 777 . 20 1 1 A 69 69 VAL C C 69 175.010 175.420 -0.410 1
1 778 . 20 1 1 A 69 69 VAL CA C 69 60.611 60.925 -0.314 1
1 779 . 20 1 1 A 69 69 VAL CB C 69 35.358 34.282 1.076 1
1 782 . 20 1 1 A 69 69 VAL N N 69 126.652 128.107 -1.455 1
1 783 . 20 1 1 A 70 70 ASP H H 70 9.089 9.247 -0.158 1
1 784 . 20 1 1 A 70 70 ASP HA H 70 4.025 4.136 -0.111 1
1 787 . 20 1 1 A 70 70 ASP C C 70 174.813 175.040 -0.227 1
1 788 . 20 1 1 A 70 70 ASP CA C 70 55.623 55.664 -0.041 1
1 789 . 20 1 1 A 70 70 ASP CB C 70 39.081 38.987 0.094 1
1 790 . 20 1 1 A 70 70 ASP N N 70 128.327 129.226 -0.899 1
1 791 . 20 1 1 A 71 71 ASN H H 71 8.128 8.078 0.050 1
1 792 . 20 1 1 A 71 71 ASN HA H 71 3.597 4.106 -0.509 1
1 797 . 20 1 1 A 71 71 ASN C C 71 173.250 173.896 -0.646 1
1 798 . 20 1 1 A 71 71 ASN CA C 71 54.728 54.545 0.183 1
1 799 . 20 1 1 A 71 71 ASN CB C 71 37.601 37.193 0.408 1
1 800 . 20 1 1 A 71 71 ASN N N 71 107.230 107.478 -0.248 1
1 802 . 20 1 1 A 72 72 MET H H 72 7.256 7.503 -0.247 1
1 803 . 20 1 1 A 72 72 MET HA H 72 4.740 4.808 -0.068 1
1 808 . 20 1 1 A 72 72 MET C C 72 173.780 174.769 -0.989 1
1 809 . 20 1 1 A 72 72 MET CA C 72 53.703 53.842 -0.139 1
1 810 . 20 1 1 A 72 72 MET CB C 72 36.570 34.542 2.028 1
1 812 . 20 1 1 A 72 72 MET N N 72 117.117 117.390 -0.273 1
1 813 . 20 1 1 A 73 73 TYR H H 73 9.430 9.388 0.042 1
1 814 . 20 1 1 A 73 73 TYR HA H 73 5.718 5.076 0.642 1
1 821 . 20 1 1 A 73 73 TYR C C 73 176.140 175.790 0.350 1
1 822 . 20 1 1 A 73 73 TYR CA C 73 57.290 57.962 -0.672 1
1 823 . 20 1 1 A 73 73 TYR CB C 73 40.013 38.844 1.169 1
1 828 . 20 1 1 A 73 73 TYR N N 73 119.856 123.684 -3.828 1
1 829 . 20 1 1 A 74 74 ARG H H 74 9.038 8.789 0.249 1
1 830 . 20 1 1 A 74 74 ARG HA H 74 4.867 4.963 -0.096 1
1 838 . 20 1 1 A 74 74 ARG C C 74 173.954 174.812 -0.858 1
1 839 . 20 1 1 A 74 74 ARG CA C 74 54.887 54.215 0.672 1
1 840 . 20 1 1 A 74 74 ARG CB C 74 34.484 33.906 0.578 1
1 843 . 20 1 1 A 74 74 ARG N N 74 117.344 121.787 -4.443 1
1 845 . 20 1 1 A 75 75 PHE H H 75 9.005 8.793 0.212 1
1 846 . 20 1 1 A 75 75 PHE HA H 75 5.046 4.635 0.411 1
1 854 . 20 1 1 A 75 75 PHE C C 75 176.186 177.303 -1.117 1
1 855 . 20 1 1 A 75 75 PHE CA C 75 59.658 59.754 -0.096 1
1 856 . 20 1 1 A 75 75 PHE CB C 75 39.356 39.957 -0.601 1
1 862 . 20 1 1 A 75 75 PHE N N 75 117.865 119.570 -1.705 1
1 863 . 20 1 1 A 76 76 GLU H H 76 8.213 8.111 0.102 1
1 864 . 20 1 1 A 76 76 GLU HA H 76 4.586 4.271 0.315 1
1 869 . 20 1 1 A 76 76 GLU C C 76 175.238 178.564 -3.326 1
1 870 . 20 1 1 A 76 76 GLU CA C 76 55.994 59.081 -3.087 1
1 871 . 20 1 1 A 76 76 GLU CB C 76 31.805 30.461 1.344 1
1 873 . 20 1 1 A 76 76 GLU N N 76 116.834 119.351 -2.517 1
1 874 . 20 1 1 A 77 77 GLY H H 77 8.692 7.920 0.772 1
1 875 . 20 1 1 A 77 77 GLY HA2 H 77 4.166 4.022 0.144 1
1 876 . 20 1 1 A 77 77 GLY HA3 H 77 4.015 4.029 -0.014 1
1 877 . 20 1 1 A 77 77 GLY C C 77 173.784 173.759 0.025 1
1 878 . 20 1 1 A 77 77 GLY CA C 77 45.505 45.898 -0.393 1
1 879 . 20 1 1 A 77 77 GLY N N 77 111.937 107.813 4.124 1
1 880 . 20 1 1 A 78 78 THR H H 78 8.332 8.113 0.219 1
1 881 . 20 1 1 A 78 78 THR HA H 78 3.900 4.298 -0.398 1
1 886 . 20 1 1 A 78 78 THR C C 78 173.591 174.113 -0.522 1
1 887 . 20 1 1 A 78 78 THR CA C 78 63.653 62.306 1.347 1
1 888 . 20 1 1 A 78 78 THR CB C 78 69.649 69.361 0.288 1
1 890 . 20 1 1 A 78 78 THR N N 78 120.765 116.798 3.967 1
1 891 . 20 1 1 A 79 79 GLY H H 79 8.038 8.392 -0.354 1
1 892 . 20 1 1 A 79 79 GLY HA2 H 79 4.748 4.403 0.345 1
1 893 . 20 1 1 A 79 79 GLY HA3 H 79 3.546 4.523 -0.977 1
1 894 . 20 1 1 A 79 79 GLY C C 79 172.580 171.974 0.606 1
1 895 . 20 1 1 A 79 79 GLY CA C 79 44.661 44.572 0.089 1
1 896 . 20 1 1 A 79 79 GLY N N 79 109.887 112.191 -2.304 1
1 897 . 20 1 1 A 80 80 PHE H H 80 9.064 8.662 0.402 1
1 898 . 20 1 1 A 80 80 PHE HA H 80 4.886 4.955 -0.069 1
1 906 . 20 1 1 A 80 80 PHE C C 80 176.507 176.054 0.453 1
1 907 . 20 1 1 A 80 80 PHE CA C 80 57.257 56.633 0.624 1
1 908 . 20 1 1 A 80 80 PHE CB C 80 44.655 42.621 2.034 1
1 914 . 20 1 1 A 80 80 PHE N N 80 116.862 119.375 -2.513 1
1 915 . 20 1 1 A 81 81 SER H H 81 9.413 9.020 0.393 1
1 916 . 20 1 1 A 81 81 SER HA H 81 4.622 4.527 0.095 1
1 919 . 20 1 1 A 81 81 SER C C 81 173.735 173.918 -0.183 1
1 920 . 20 1 1 A 81 81 SER CA C 81 61.410 60.861 0.549 1
1 921 . 20 1 1 A 81 81 SER CB C 81 64.165 63.289 0.876 1
1 922 . 20 1 1 A 81 81 SER N N 81 116.467 117.460 -0.993 1
1 923 . 20 1 1 A 82 82 ASN H H 82 7.688 8.064 -0.376 1
1 924 . 20 1 1 A 82 82 ASN HA H 82 4.952 5.096 -0.144 1
1 929 . 20 1 1 A 82 82 ASN C C 82 173.303 175.424 -2.121 1
1 930 . 20 1 1 A 82 82 ASN CA C 82 52.086 51.960 0.126 1
1 931 . 20 1 1 A 82 82 ASN CB C 82 41.258 41.599 -0.341 1
1 932 . 20 1 1 A 82 82 ASN N N 82 113.355 116.031 -2.676 1
1 934 . 20 1 1 A 83 83 ILE H H 83 8.858 8.606 0.252 1
1 935 . 20 1 1 A 83 83 ILE HA H 83 3.571 3.648 -0.077 1
1 945 . 20 1 1 A 83 83 ILE CA C 83 66.416 65.517 0.899 1
1 946 . 20 1 1 A 83 83 ILE CB C 83 35.074 35.115 -0.041 1
1 950 . 20 1 1 A 83 83 ILE N N 83 118.908 122.837 -3.929 1
1 951 . 20 1 1 A 84 84 PRO HA H 84 4.411 4.814 -0.403 1
1 958 . 20 1 1 A 84 84 PRO C C 84 177.616 179.209 -1.593 1
1 959 . 20 1 1 A 84 84 PRO CA C 84 67.525 66.391 1.134 1
1 960 . 20 1 1 A 84 84 PRO CB C 84 31.029 30.664 0.365 1
1 963 . 20 1 1 A 85 85 GLN H H 85 8.405 8.321 0.084 1
1 964 . 20 1 1 A 85 85 GLN HA H 85 3.874 4.066 -0.192 1
1 971 . 20 1 1 A 85 85 GLN C C 85 178.213 178.267 -0.054 1
1 972 . 20 1 1 A 85 85 GLN CA C 85 59.495 58.497 0.998 1
1 973 . 20 1 1 A 85 85 GLN CB C 85 29.270 28.246 1.024 1
1 975 . 20 1 1 A 85 85 GLN N N 85 115.597 117.391 -1.794 1
1 977 . 20 1 1 A 86 86 LEU H H 86 7.136 7.902 -0.766 1
1 978 . 20 1 1 A 86 86 LEU HA H 86 3.589 3.413 0.176 1
1 988 . 20 1 1 A 86 86 LEU C C 86 177.728 178.338 -0.610 1
1 989 . 20 1 1 A 86 86 LEU CA C 86 58.136 58.217 -0.081 1
1 990 . 20 1 1 A 86 86 LEU CB C 86 42.290 41.660 0.630 1
1 994 . 20 1 1 A 86 86 LEU N N 86 121.840 121.884 -0.044 1
1 995 . 20 1 1 A 87 87 ILE H H 87 8.323 7.584 0.739 1
1 996 . 20 1 1 A 87 87 ILE HA H 87 3.415 3.314 0.101 1
1 1006 . 20 1 1 A 87 87 ILE C C 87 178.064 177.646 0.418 1
1 1007 . 20 1 1 A 87 87 ILE CA C 87 61.458 65.269 -3.811 1
1 1008 . 20 1 1 A 87 87 ILE CB C 87 34.561 37.081 -2.520 1
1 1012 . 20 1 1 A 87 87 ILE N N 87 118.117 119.293 -1.176 1
1 1013 . 20 1 1 A 88 88 ASP H H 88 8.805 8.368 0.437 1
1 1014 . 20 1 1 A 88 88 ASP HA H 88 4.548 4.328 0.220 1
1 1017 . 20 1 1 A 88 88 ASP C C 88 179.265 178.245 1.020 1
1 1018 . 20 1 1 A 88 88 ASP CA C 88 58.099 57.294 0.805 1
1 1019 . 20 1 1 A 88 88 ASP CB C 88 42.166 41.821 0.345 1
1 1020 . 20 1 1 A 88 88 ASP N N 88 119.143 120.680 -1.537 1
1 1021 . 20 1 1 A 89 89 HIS H H 89 8.113 7.968 0.145 1
1 1022 . 20 1 1 A 89 89 HIS HA H 89 4.225 4.411 -0.186 1
1 1026 . 20 1 1 A 89 89 HIS C C 89 179.261 177.168 2.093 1
1 1027 . 20 1 1 A 89 89 HIS CA C 89 60.647 58.946 1.701 1
1 1028 . 20 1 1 A 89 89 HIS CB C 89 30.801 29.523 1.278 1
1 1030 . 20 1 1 A 89 89 HIS N N 89 119.595 119.145 0.450 1
1 1031 . 20 1 1 A 90 90 HIS H H 90 7.685 7.778 -0.093 1
1 1032 . 20 1 1 A 90 90 HIS HA H 90 3.628 4.066 -0.438 1
1 1036 . 20 1 1 A 90 90 HIS C C 90 178.454 177.554 0.900 1
1 1037 . 20 1 1 A 90 90 HIS CA C 90 61.797 59.869 1.928 1
1 1038 . 20 1 1 A 90 90 HIS CB C 90 28.165 29.878 -1.713 1
1 1040 . 20 1 1 A 90 90 HIS N N 90 120.061 117.163 2.898 1
1 1041 . 20 1 1 A 91 91 TYR H H 91 9.394 8.212 1.182 1
1 1042 . 20 1 1 A 91 91 TYR HA H 91 4.238 4.045 0.193 1
1 1049 . 20 1 1 A 91 91 TYR C C 91 176.443 177.720 -1.277 1
1 1050 . 20 1 1 A 91 91 TYR CA C 91 60.669 61.620 -0.951 1
1 1051 . 20 1 1 A 91 91 TYR CB C 91 39.169 38.870 0.299 1
1 1056 . 20 1 1 A 91 91 TYR N N 91 123.532 120.050 3.482 1
1 1057 . 20 1 1 A 92 92 THR H H 92 8.774 8.552 0.222 1
1 1058 . 20 1 1 A 92 92 THR HA H 92 3.866 4.155 -0.289 1
1 1063 . 20 1 1 A 92 92 THR C C 92 177.050 176.172 0.878 1
1 1064 . 20 1 1 A 92 92 THR CA C 92 65.240 65.504 -0.264 1
1 1065 . 20 1 1 A 92 92 THR CB C 92 69.298 68.302 0.996 1
1 1067 . 20 1 1 A 92 92 THR N N 92 112.000 112.951 -0.951 1
1 1068 . 20 1 1 A 93 93 THR H H 93 7.617 7.624 -0.007 1
1 1069 . 20 1 1 A 93 93 THR HA H 93 4.133 4.184 -0.051 1
1 1074 . 20 1 1 A 93 93 THR C C 93 176.234 174.638 1.596 1
1 1075 . 20 1 1 A 93 93 THR CA C 93 63.527 62.200 1.327 1
1 1076 . 20 1 1 A 93 93 THR CB C 93 71.234 69.740 1.494 1
1 1078 . 20 1 1 A 93 93 THR N N 93 109.883 111.995 -2.112 1
1 1079 . 20 1 1 A 94 94 LYS H H 94 7.210 7.908 -0.698 1
1 1080 . 20 1 1 A 94 94 LYS HA H 94 3.830 3.751 0.079 1
1 1089 . 20 1 1 A 94 94 LYS C C 94 174.331 175.031 -0.700 1
1 1090 . 20 1 1 A 94 94 LYS CA C 94 56.776 57.151 -0.375 1
1 1091 . 20 1 1 A 94 94 LYS CB C 94 28.095 30.773 -2.678 1
1 1095 . 20 1 1 A 94 94 LYS N N 94 112.818 121.402 -8.584 1
1 1096 . 20 1 1 A 95 95 GLN H H 95 7.439 7.690 -0.251 1
1 1097 . 20 1 1 A 95 95 GLN HA H 95 4.216 4.870 -0.654 1
1 1104 . 20 1 1 A 95 95 GLN C C 95 179.087 175.716 3.371 1
1 1105 . 20 1 1 A 95 95 GLN CA C 95 56.378 53.871 2.507 1
1 1106 . 20 1 1 A 95 95 GLN CB C 95 28.542 31.017 -2.475 1
1 1108 . 20 1 1 A 95 95 GLN N N 95 117.860 117.926 -0.066 1
1 1110 . 20 1 1 A 96 96 VAL H H 96 8.520 8.422 0.098 1
1 1111 . 20 1 1 A 96 96 VAL HA H 96 4.297 4.483 -0.186 1
1 1119 . 20 1 1 A 96 96 VAL C C 96 177.329 176.745 0.584 1
1 1120 . 20 1 1 A 96 96 VAL CA C 96 61.196 62.176 -0.980 1
1 1121 . 20 1 1 A 96 96 VAL CB C 96 32.735 32.925 -0.190 1
1 1124 . 20 1 1 A 96 96 VAL N N 96 124.208 119.651 4.557 1
1 1125 . 20 1 1 A 97 97 ILE H H 97 8.491 8.548 -0.057 1
1 1126 . 20 1 1 A 97 97 ILE HA H 97 2.995 3.538 -0.543 1
1 1136 . 20 1 1 A 97 97 ILE CA C 97 62.066 63.097 -1.031 1
1 1137 . 20 1 1 A 97 97 ILE CB C 97 36.117 38.041 -1.924 1
1 1141 . 20 1 1 A 97 97 ILE N N 97 119.561 125.179 -5.618 1
1 1142 . 20 1 1 A 98 98 THR HA H 98 4.460 4.629 -0.169 1
1 1147 . 20 1 1 A 98 98 THR C C 98 174.335 174.788 -0.453 1
1 1148 . 20 1 1 A 98 98 THR CA C 98 58.244 59.784 -1.540 1
1 1149 . 20 1 1 A 98 98 THR CB C 98 73.056 71.497 1.559 1
1 1151 . 20 1 1 A 99 99 LYS H H 99 9.761 8.940 0.821 1
1 1152 . 20 1 1 A 99 99 LYS HA H 99 3.911 3.949 -0.038 1
1 1161 . 20 1 1 A 99 99 LYS C C 99 179.594 178.067 1.527 1
1 1162 . 20 1 1 A 99 99 LYS CA C 99 59.661 60.011 -0.350 1
1 1163 . 20 1 1 A 99 99 LYS CB C 99 31.978 32.152 -0.174 1
1 1167 . 20 1 1 A 99 99 LYS N N 99 125.750 123.072 2.678 1
1 1168 . 20 1 1 A 100 100 LYS H H 100 8.910 8.781 0.129 1
1 1169 . 20 1 1 A 100 100 LYS HA H 100 4.024 4.118 -0.094 1
1 1178 . 20 1 1 A 100 100 LYS C C 100 178.060 177.839 0.221 1
1 1179 . 20 1 1 A 100 100 LYS CA C 100 58.642 58.790 -0.148 1
1 1180 . 20 1 1 A 100 100 LYS CB C 100 32.750 31.752 0.998 1
1 1184 . 20 1 1 A 100 100 LYS N N 100 117.112 118.652 -1.540 1
1 1185 . 20 1 1 A 101 101 SER H H 101 7.721 7.528 0.193 1
1 1186 . 20 1 1 A 101 101 SER HA H 101 4.282 4.572 -0.290 1
1 1189 . 20 1 1 A 101 101 SER C C 101 176.403 175.025 1.378 1
1 1190 . 20 1 1 A 101 101 SER CA C 101 60.442 58.631 1.811 1
1 1191 . 20 1 1 A 101 101 SER CB C 101 63.775 64.680 -0.905 1
1 1192 . 20 1 1 A 101 101 SER N N 101 112.069 115.027 -2.958 1
1 1193 . 20 1 1 A 102 102 GLY H H 102 8.038 8.417 -0.379 1
1 1194 . 20 1 1 A 102 102 GLY HA2 H 102 4.024 3.921 0.103 1
1 1195 . 20 1 1 A 102 102 GLY HA3 H 102 3.713 3.935 -0.222 1
1 1196 . 20 1 1 A 102 102 GLY C C 102 173.991 174.463 -0.472 1
1 1197 . 20 1 1 A 102 102 GLY CA C 102 46.458 46.654 -0.196 1
1 1198 . 20 1 1 A 102 102 GLY N N 102 111.144 109.828 1.316 1
1 1199 . 20 1 1 A 103 103 VAL H H 103 7.155 7.598 -0.443 1
1 1200 . 20 1 1 A 103 103 VAL HA H 103 3.652 4.204 -0.552 1
1 1208 . 20 1 1 A 103 103 VAL C C 103 173.805 175.006 -1.201 1
1 1209 . 20 1 1 A 103 103 VAL CA C 103 64.310 61.784 2.526 1
1 1210 . 20 1 1 A 103 103 VAL CB C 103 32.254 32.993 -0.739 1
1 1213 . 20 1 1 A 103 103 VAL N N 103 119.836 119.886 -0.050 1
1 1214 . 20 1 1 A 104 104 VAL H H 104 7.653 9.080 -1.427 1
1 1215 . 20 1 1 A 104 104 VAL HA H 104 4.048 4.452 -0.404 1
1 1223 . 20 1 1 A 104 104 VAL C C 104 175.708 174.901 0.807 1
1 1224 . 20 1 1 A 104 104 VAL CA C 104 60.275 61.069 -0.794 1
1 1225 . 20 1 1 A 104 104 VAL CB C 104 35.112 33.302 1.810 1
1 1228 . 20 1 1 A 104 104 VAL N N 104 125.859 128.490 -2.631 1
1 1229 . 20 1 1 A 105 105 LEU H H 105 8.616 8.246 0.370 1
1 1230 . 20 1 1 A 105 105 LEU HA H 105 3.905 4.469 -0.564 1
1 1240 . 20 1 1 A 105 105 LEU C C 105 175.380 175.931 -0.551 1
1 1241 . 20 1 1 A 105 105 LEU CA C 105 54.471 53.769 0.702 1
1 1242 . 20 1 1 A 105 105 LEU CB C 105 39.821 40.956 -1.135 1
1 1246 . 20 1 1 A 105 105 LEU N N 105 123.839 126.329 -2.490 1
1 1247 . 20 1 1 A 106 106 LEU H H 106 8.894 8.532 0.362 1
1 1248 . 20 1 1 A 106 106 LEU HA H 106 4.839 4.907 -0.068 1
1 1258 . 20 1 1 A 106 106 LEU C C 106 176.930 176.403 0.527 1
1 1259 . 20 1 1 A 106 106 LEU CA C 106 56.288 53.257 3.031 1
1 1260 . 20 1 1 A 106 106 LEU CB C 106 45.237 45.541 -0.304 1
1 1264 . 20 1 1 A 106 106 LEU N N 106 120.590 121.732 -1.142 1
1 1265 . 20 1 1 A 107 107 ASN H H 107 8.124 9.155 -1.031 1
1 1266 . 20 1 1 A 107 107 ASN HA H 107 5.650 4.626 1.024 1
1 1271 . 20 1 1 A 107 107 ASN CA C 107 50.293 54.023 -3.730 1
1 1272 . 20 1 1 A 107 107 ASN CB C 107 41.223 36.200 5.023 1
1 1273 . 20 1 1 A 107 107 ASN N N 107 116.866 118.795 -1.929 1
1 1275 . 20 1 1 A 108 108 PRO HA H 108 2.926 4.043 -1.117 1
1 1282 . 20 1 1 A 108 108 PRO C C 108 176.671 175.487 1.184 1
1 1283 . 20 1 1 A 108 108 PRO CA C 108 60.804 62.415 -1.611 1
1 1284 . 20 1 1 A 108 108 PRO CB C 108 31.774 32.184 -0.410 1
1 1287 . 20 1 1 A 109 109 ILE H H 109 8.648 8.213 0.435 1
1 1288 . 20 1 1 A 109 109 ILE HA H 109 4.519 4.485 0.034 1
1 1298 . 20 1 1 A 109 109 ILE CA C 109 55.070 58.359 -3.289 1
1 1299 . 20 1 1 A 109 109 ILE CB C 109 36.068 38.254 -2.186 1
1 1303 . 20 1 1 A 109 109 ILE N N 109 128.817 122.526 6.291 1
1 1304 . 20 1 1 A 110 110 PRO HA H 110 4.587 4.769 -0.182 1
1 1311 . 20 1 1 A 110 110 PRO C C 110 177.013 175.968 1.045 1
1 1312 . 20 1 1 A 110 110 PRO CA C 110 61.850 62.308 -0.458 1
1 1313 . 20 1 1 A 110 110 PRO CB C 110 32.507 33.111 -0.604 1
1 1316 . 20 1 1 A 111 111 LYS H H 111 8.038 8.068 -0.030 1
1 1317 . 20 1 1 A 111 111 LYS HA H 111 3.553 4.928 -1.375 1
1 1326 . 20 1 1 A 111 111 LYS C C 111 176.123 174.498 1.625 1
1 1327 . 20 1 1 A 111 111 LYS CA C 111 56.220 55.119 1.101 1
1 1328 . 20 1 1 A 111 111 LYS CB C 111 32.373 35.336 -2.963 1
1 1332 . 20 1 1 A 111 111 LYS N N 111 120.147 117.366 2.781 1
1 1333 . 20 1 1 A 112 112 ASP H H 112 8.463 8.334 0.129 1
1 1334 . 20 1 1 A 112 112 ASP HA H 112 4.523 4.666 -0.143 1
1 1337 . 20 1 1 A 112 112 ASP C C 112 175.986 176.327 -0.341 1
1 1338 . 20 1 1 A 112 112 ASP CA C 112 54.256 54.697 -0.441 1
1 1339 . 20 1 1 A 112 112 ASP CB C 112 41.563 41.762 -0.199 1
1 1340 . 20 1 1 A 112 112 ASP N N 112 121.863 118.829 3.034 1
1 1341 . 20 1 1 A 113 113 LYS H H 113 8.059 8.321 -0.262 1
1 1342 . 20 1 1 A 113 113 LYS HA H 113 4.136 4.396 -0.260 1
1 1351 . 20 1 1 A 113 113 LYS C C 113 176.010 175.171 0.839 1
1 1352 . 20 1 1 A 113 113 LYS CA C 113 56.253 55.598 0.655 1
1 1353 . 20 1 1 A 113 113 LYS CB C 113 32.754 33.924 -1.170 1
1 1357 . 20 1 1 A 113 113 LYS N N 113 121.725 117.775 3.950 1
1 1358 . 20 1 1 A 114 114 LYS H H 114 8.225 7.356 0.869 1
1 1359 . 20 1 1 A 114 114 LYS HA H 114 4.169 4.509 -0.340 1
1 1368 . 20 1 1 A 114 114 LYS C C 114 176.198 175.056 1.142 1
1 1369 . 20 1 1 A 114 114 LYS CA C 114 56.413 55.018 1.395 1
1 1370 . 20 1 1 A 114 114 LYS CB C 114 32.725 33.179 -0.454 1
1 1374 . 20 1 1 A 114 114 LYS N N 114 121.857 120.016 1.841 1
1 1375 . 20 1 1 A 115 115 TRP H H 115 8.078 8.995 -0.917 1
1 1376 . 20 1 1 A 115 115 TRP HA H 115 4.709 4.855 -0.146 1
1 1385 . 20 1 1 A 115 115 TRP C C 115 175.119 175.944 -0.825 1
1 1386 . 20 1 1 A 115 115 TRP CA C 115 56.856 56.259 0.597 1
1 1387 . 20 1 1 A 115 115 TRP CB C 115 29.474 27.359 2.115 1
1 1393 . 20 1 1 A 115 115 TRP N N 115 122.068 125.931 -3.863 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 99 1.185 1
2 1 1 1 "RMS(OBS, PRED)" CA 106 1.347 1
3 1 1 1 "RMS(OBS, PRED)" CB 98 1.406 1
4 1 1 1 "RMS(OBS, PRED)" H 98 0.567 1
5 1 1 1 "RMS(OBS, PRED)" HA 114 0.376 1
6 1 1 1 "RMS(OBS, PRED)" N 98 3.102 1
7 1 2 1 "RMS(OBS, PRED)" C 99 1.169 1
8 1 2 1 "RMS(OBS, PRED)" CA 106 1.313 1
9 1 2 1 "RMS(OBS, PRED)" CB 98 1.347 1
10 1 2 1 "RMS(OBS, PRED)" H 98 0.568 1
11 1 2 1 "RMS(OBS, PRED)" HA 114 0.379 1
12 1 2 1 "RMS(OBS, PRED)" N 98 3.433 1
13 1 3 1 "RMS(OBS, PRED)" C 99 1.162 1
14 1 3 1 "RMS(OBS, PRED)" CA 106 1.226 1
15 1 3 1 "RMS(OBS, PRED)" CB 98 1.270 1
16 1 3 1 "RMS(OBS, PRED)" H 98 0.537 1
17 1 3 1 "RMS(OBS, PRED)" HA 114 0.345 1
18 1 3 1 "RMS(OBS, PRED)" N 98 3.155 1
19 1 4 1 "RMS(OBS, PRED)" C 99 1.138 1
20 1 4 1 "RMS(OBS, PRED)" CA 106 1.217 1
21 1 4 1 "RMS(OBS, PRED)" CB 98 1.291 1
22 1 4 1 "RMS(OBS, PRED)" H 98 0.557 1
23 1 4 1 "RMS(OBS, PRED)" HA 114 0.372 1
24 1 4 1 "RMS(OBS, PRED)" N 98 3.260 1
25 1 5 1 "RMS(OBS, PRED)" C 99 1.062 1
26 1 5 1 "RMS(OBS, PRED)" CA 106 1.213 1
27 1 5 1 "RMS(OBS, PRED)" CB 98 1.333 1
28 1 5 1 "RMS(OBS, PRED)" H 98 0.545 1
29 1 5 1 "RMS(OBS, PRED)" HA 114 0.330 1
30 1 5 1 "RMS(OBS, PRED)" N 98 3.043 1
31 1 6 1 "RMS(OBS, PRED)" C 99 1.124 1
32 1 6 1 "RMS(OBS, PRED)" CA 106 1.247 1
33 1 6 1 "RMS(OBS, PRED)" CB 98 1.443 1
34 1 6 1 "RMS(OBS, PRED)" H 98 0.583 1
35 1 6 1 "RMS(OBS, PRED)" HA 114 0.359 1
36 1 6 1 "RMS(OBS, PRED)" N 98 2.943 1
37 1 7 1 "RMS(OBS, PRED)" C 99 1.152 1
38 1 7 1 "RMS(OBS, PRED)" CA 106 1.253 1
39 1 7 1 "RMS(OBS, PRED)" CB 98 1.332 1
40 1 7 1 "RMS(OBS, PRED)" H 98 0.569 1
41 1 7 1 "RMS(OBS, PRED)" HA 114 0.347 1
42 1 7 1 "RMS(OBS, PRED)" N 98 3.177 1
43 1 8 1 "RMS(OBS, PRED)" C 99 1.124 1
44 1 8 1 "RMS(OBS, PRED)" CA 106 1.357 1
45 1 8 1 "RMS(OBS, PRED)" CB 98 1.333 1
46 1 8 1 "RMS(OBS, PRED)" H 98 0.635 1
47 1 8 1 "RMS(OBS, PRED)" HA 114 0.354 1
48 1 8 1 "RMS(OBS, PRED)" N 98 3.239 1
49 1 9 1 "RMS(OBS, PRED)" C 99 1.187 1
50 1 9 1 "RMS(OBS, PRED)" CA 106 1.270 1
51 1 9 1 "RMS(OBS, PRED)" CB 98 1.354 1
52 1 9 1 "RMS(OBS, PRED)" H 98 0.568 1
53 1 9 1 "RMS(OBS, PRED)" HA 114 0.381 1
54 1 9 1 "RMS(OBS, PRED)" N 98 3.097 1
55 1 10 1 "RMS(OBS, PRED)" C 99 1.144 1
56 1 10 1 "RMS(OBS, PRED)" CA 106 1.315 1
57 1 10 1 "RMS(OBS, PRED)" CB 98 1.401 1
58 1 10 1 "RMS(OBS, PRED)" H 98 0.567 1
59 1 10 1 "RMS(OBS, PRED)" HA 114 0.379 1
60 1 10 1 "RMS(OBS, PRED)" N 98 2.953 1
61 1 11 1 "RMS(OBS, PRED)" C 99 1.143 1
62 1 11 1 "RMS(OBS, PRED)" CA 106 1.338 1
63 1 11 1 "RMS(OBS, PRED)" CB 98 1.311 1
64 1 11 1 "RMS(OBS, PRED)" H 98 0.527 1
65 1 11 1 "RMS(OBS, PRED)" HA 114 0.345 1
66 1 11 1 "RMS(OBS, PRED)" N 98 3.076 1
67 1 12 1 "RMS(OBS, PRED)" C 99 1.172 1
68 1 12 1 "RMS(OBS, PRED)" CA 106 1.259 1
69 1 12 1 "RMS(OBS, PRED)" CB 98 1.368 1
70 1 12 1 "RMS(OBS, PRED)" H 98 0.558 1
71 1 12 1 "RMS(OBS, PRED)" HA 114 0.331 1
72 1 12 1 "RMS(OBS, PRED)" N 98 3.133 1
73 1 13 1 "RMS(OBS, PRED)" C 99 1.186 1
74 1 13 1 "RMS(OBS, PRED)" CA 106 1.334 1
75 1 13 1 "RMS(OBS, PRED)" CB 98 1.546 1
76 1 13 1 "RMS(OBS, PRED)" H 98 0.629 1
77 1 13 1 "RMS(OBS, PRED)" HA 114 0.388 1
78 1 13 1 "RMS(OBS, PRED)" N 98 3.331 1
79 1 14 1 "RMS(OBS, PRED)" C 99 1.090 1
80 1 14 1 "RMS(OBS, PRED)" CA 106 1.302 1
81 1 14 1 "RMS(OBS, PRED)" CB 98 1.422 1
82 1 14 1 "RMS(OBS, PRED)" H 98 0.590 1
83 1 14 1 "RMS(OBS, PRED)" HA 114 0.373 1
84 1 14 1 "RMS(OBS, PRED)" N 98 3.363 1
85 1 15 1 "RMS(OBS, PRED)" C 99 1.086 1
86 1 15 1 "RMS(OBS, PRED)" CA 106 1.239 1
87 1 15 1 "RMS(OBS, PRED)" CB 98 1.396 1
88 1 15 1 "RMS(OBS, PRED)" H 98 0.549 1
89 1 15 1 "RMS(OBS, PRED)" HA 114 0.357 1
90 1 15 1 "RMS(OBS, PRED)" N 98 3.042 1
91 1 16 1 "RMS(OBS, PRED)" C 99 1.140 1
92 1 16 1 "RMS(OBS, PRED)" CA 106 1.283 1
93 1 16 1 "RMS(OBS, PRED)" CB 98 1.337 1
94 1 16 1 "RMS(OBS, PRED)" H 98 0.612 1
95 1 16 1 "RMS(OBS, PRED)" HA 114 0.377 1
96 1 16 1 "RMS(OBS, PRED)" N 98 3.398 1
97 1 17 1 "RMS(OBS, PRED)" C 99 1.111 1
98 1 17 1 "RMS(OBS, PRED)" CA 106 1.267 1
99 1 17 1 "RMS(OBS, PRED)" CB 98 1.310 1
100 1 17 1 "RMS(OBS, PRED)" H 98 0.529 1
101 1 17 1 "RMS(OBS, PRED)" HA 114 0.341 1
102 1 17 1 "RMS(OBS, PRED)" N 98 3.201 1
103 1 18 1 "RMS(OBS, PRED)" C 99 1.137 1
104 1 18 1 "RMS(OBS, PRED)" CA 106 1.326 1
105 1 18 1 "RMS(OBS, PRED)" CB 98 1.302 1
106 1 18 1 "RMS(OBS, PRED)" H 98 0.611 1
107 1 18 1 "RMS(OBS, PRED)" HA 114 0.370 1
108 1 18 1 "RMS(OBS, PRED)" N 98 3.416 1
109 1 19 1 "RMS(OBS, PRED)" C 99 1.190 1
110 1 19 1 "RMS(OBS, PRED)" CA 106 1.363 1
111 1 19 1 "RMS(OBS, PRED)" CB 98 1.337 1
112 1 19 1 "RMS(OBS, PRED)" H 98 0.630 1
113 1 19 1 "RMS(OBS, PRED)" HA 114 0.390 1
114 1 19 1 "RMS(OBS, PRED)" N 98 3.078 1
115 1 20 1 "RMS(OBS, PRED)" C 99 1.199 1
116 1 20 1 "RMS(OBS, PRED)" CA 106 1.363 1
117 1 20 1 "RMS(OBS, PRED)" CB 98 1.421 1
118 1 20 1 "RMS(OBS, PRED)" H 98 0.553 1
119 1 20 1 "RMS(OBS, PRED)" HA 114 0.381 1
120 1 20 1 "RMS(OBS, PRED)" N 98 3.189 1
stop_
save_
save_delta_chem_shifts_average
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_average
_Entity_delta_chem_shifts.Conformer_type "average"
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 1 . 1 1 A 10 10 HIS HA H 10 4.616 4.794 -0.178 2
1 4 . 1 1 A 10 10 HIS C C 10 174.981 174.397 0.584 2
1 5 . 1 1 A 10 10 HIS CA C 10 56.555 55.986 0.569 2
1 6 . 1 1 A 10 10 HIS CB C 10 30.231 31.501 -1.270 2
1 7 . 1 1 A 11 11 MET H H 11 8.103 8.387 -0.284 2
1 8 . 1 1 A 11 11 MET HA H 11 4.439 4.592 -0.153 2
1 13 . 1 1 A 11 11 MET C C 11 175.888 175.607 0.281 2
1 14 . 1 1 A 11 11 MET CA C 11 55.090 54.818 0.272 2
1 15 . 1 1 A 11 11 MET CB C 11 33.121 33.662 -0.541 2
1 17 . 1 1 A 11 11 MET N N 11 120.743 121.700 -0.957 2
1 18 . 1 1 A 12 12 LYS H H 12 8.065 8.512 -0.447 2
1 19 . 1 1 A 12 12 LYS HA H 12 4.407 4.688 -0.281 2
1 28 . 1 1 A 12 12 LYS CA C 12 54.894 53.430 1.464 2
1 29 . 1 1 A 12 12 LYS CB C 12 31.863 32.795 -0.932 2
1 33 . 1 1 A 12 12 LYS N N 12 123.187 123.497 -0.310 2
1 34 . 1 1 A 13 13 PRO HA H 13 4.347 4.475 -0.128 2
1 41 . 1 1 A 13 13 PRO C C 13 176.891 177.380 -0.489 2
1 42 . 1 1 A 13 13 PRO CA C 13 62.542 62.377 0.165 2
1 43 . 1 1 A 13 13 PRO CB C 13 32.663 32.947 -0.284 2
1 46 . 1 1 A 14 14 LEU H H 14 8.339 8.758 -0.419 2
1 47 . 1 1 A 14 14 LEU HA H 14 3.373 3.825 -0.452 2
1 57 . 1 1 A 14 14 LEU C C 14 176.683 178.194 -1.511 2
1 58 . 1 1 A 14 14 LEU CA C 14 58.555 57.534 1.021 2
1 59 . 1 1 A 14 14 LEU CB C 14 41.828 41.033 0.795 2
1 63 . 1 1 A 14 14 LEU N N 14 123.191 123.758 -0.567 2
1 64 . 1 1 A 15 15 ALA H H 15 8.175 7.905 0.270 2
1 65 . 1 1 A 15 15 ALA HA H 15 3.983 4.090 -0.107 2
1 69 . 1 1 A 15 15 ALA C C 15 178.697 178.579 0.118 2
1 70 . 1 1 A 15 15 ALA CA C 15 54.164 54.587 -0.423 2
1 71 . 1 1 A 15 15 ALA CB C 15 18.771 18.216 0.555 2
1 72 . 1 1 A 15 15 ALA N N 15 113.594 119.898 -6.304 2
1 73 . 1 1 A 16 16 GLU H H 16 7.458 7.591 -0.134 2
1 74 . 1 1 A 16 16 GLU HA H 16 4.266 4.317 -0.051 2
1 79 . 1 1 A 16 16 GLU C C 16 176.510 176.699 -0.189 2
1 80 . 1 1 A 16 16 GLU CA C 16 55.196 56.843 -1.647 2
1 81 . 1 1 A 16 16 GLU CB C 16 30.907 30.097 0.810 2
1 83 . 1 1 A 16 16 GLU N N 16 113.348 115.369 -2.021 2
1 84 . 1 1 A 17 17 GLN H H 17 7.501 7.010 0.491 2
1 85 . 1 1 A 17 17 GLN HA H 17 3.683 4.032 -0.349 2
1 92 . 1 1 A 17 17 GLN C C 17 178.053 176.157 1.896 2
1 93 . 1 1 A 17 17 GLN CA C 17 54.606 55.356 -0.751 2
1 94 . 1 1 A 17 17 GLN CB C 17 25.758 28.337 -2.579 2
1 96 . 1 1 A 17 17 GLN N N 17 119.411 119.441 -0.030 2
1 98 . 1 1 A 18 18 ASP H H 18 8.949 8.595 0.353 2
1 99 . 1 1 A 18 18 ASP HA H 18 4.184 4.133 0.051 2
1 102 . 1 1 A 18 18 ASP C C 18 175.263 177.835 -2.572 2
1 103 . 1 1 A 18 18 ASP CA C 18 57.275 56.757 0.518 2
1 104 . 1 1 A 18 18 ASP CB C 18 40.620 40.061 0.559 2
1 105 . 1 1 A 18 18 ASP N N 18 124.676 123.680 0.996 2
1 106 . 1 1 A 19 19 TRP H H 19 6.068 7.287 -1.219 2
1 107 . 1 1 A 19 19 TRP HA H 19 5.045 4.686 0.359 2
1 116 . 1 1 A 19 19 TRP C C 19 175.902 176.284 -0.382 2
1 117 . 1 1 A 19 19 TRP CA C 19 53.542 57.714 -4.172 2
1 118 . 1 1 A 19 19 TRP CB C 19 29.179 28.820 0.358 2
1 124 . 1 1 A 19 19 TRP N N 19 107.757 117.434 -9.677 2
1 126 . 1 1 A 20 20 TYR H H 20 7.430 7.412 0.018 2
1 127 . 1 1 A 20 20 TYR HA H 20 5.601 5.299 0.302 2
1 132 . 1 1 A 20 20 TYR C C 20 175.498 175.293 0.205 2
1 133 . 1 1 A 20 20 TYR CA C 20 56.967 56.967 -0.000 2
1 134 . 1 1 A 20 20 TYR CB C 20 39.083 38.765 0.318 2
1 137 . 1 1 A 20 20 TYR N N 20 123.173 121.888 1.285 2
1 138 . 1 1 A 21 21 HIS H H 21 8.934 8.776 0.158 2
1 139 . 1 1 A 21 21 HIS HA H 21 4.295 4.460 -0.165 2
1 144 . 1 1 A 21 21 HIS C C 21 175.177 174.943 0.234 2
1 145 . 1 1 A 21 21 HIS CA C 21 56.572 55.499 1.073 2
1 146 . 1 1 A 21 21 HIS CB C 21 33.365 30.339 3.026 2
1 149 . 1 1 A 21 21 HIS N N 21 125.732 127.036 -1.304 2
1 150 . 1 1 A 22 22 GLY H H 22 5.280 7.202 -1.922 2
1 151 . 1 1 A 22 22 GLY HA2 H 22 3.905 3.501 0.404 2
1 152 . 1 1 A 22 22 GLY HA3 H 22 3.585 3.739 -0.154 2
1 153 . 1 1 A 22 22 GLY C C 22 174.411 174.045 0.366 2
1 154 . 1 1 A 22 22 GLY CA C 22 46.402 45.270 1.132 2
1 155 . 1 1 A 22 22 GLY N N 22 104.568 107.757 -3.189 2
1 156 . 1 1 A 23 23 ALA H H 23 8.768 8.179 0.589 2
1 157 . 1 1 A 23 23 ALA HA H 23 5.171 4.514 0.657 2
1 161 . 1 1 A 23 23 ALA C C 23 177.180 176.771 0.409 2
1 162 . 1 1 A 23 23 ALA CA C 23 51.153 51.692 -0.539 2
1 163 . 1 1 A 23 23 ALA CB C 23 16.999 18.036 -1.037 2
1 164 . 1 1 A 23 23 ALA N N 23 130.297 122.694 7.603 2
1 165 . 1 1 A 24 24 ILE H H 24 7.267 7.730 -0.463 2
1 166 . 1 1 A 24 24 ILE HA H 24 4.460 4.648 -0.188 2
1 176 . 1 1 A 24 24 ILE CA C 24 58.529 58.656 -0.127 2
1 177 . 1 1 A 24 24 ILE CB C 24 38.763 38.565 0.198 2
1 181 . 1 1 A 24 24 ILE N N 24 118.903 116.356 2.547 2
1 182 . 1 1 A 25 25 PRO HA H 25 4.224 4.502 -0.278 2
1 189 . 1 1 A 25 25 PRO C C 25 176.918 177.576 -0.658 2
1 190 . 1 1 A 25 25 PRO CA C 25 62.907 62.606 0.301 2
1 191 . 1 1 A 25 25 PRO CB C 25 32.671 32.658 0.013 2
1 194 . 1 1 A 26 26 ARG H H 26 8.781 9.075 -0.294 2
1 195 . 1 1 A 26 26 ARG HA H 26 3.472 3.892 -0.419 2
1 202 . 1 1 A 26 26 ARG C C 26 178.112 178.010 0.102 2
1 203 . 1 1 A 26 26 ARG CA C 26 60.863 59.451 1.412 2
1 204 . 1 1 A 26 26 ARG CB C 26 30.314 29.826 0.488 2
1 207 . 1 1 A 26 26 ARG N N 26 124.635 121.847 2.788 2
1 208 . 1 1 A 27 27 ILE H H 27 8.540 8.120 0.420 2
1 209 . 1 1 A 27 27 ILE HA H 27 3.787 3.650 0.137 2
1 219 . 1 1 A 27 27 ILE C C 27 177.390 177.563 -0.173 2
1 220 . 1 1 A 27 27 ILE CA C 27 64.329 64.979 -0.650 2
1 221 . 1 1 A 27 27 ILE CB C 27 37.413 37.950 -0.537 2
1 225 . 1 1 A 27 27 ILE N N 27 115.859 120.040 -4.181 2
1 226 . 1 1 A 28 28 GLU H H 28 6.953 8.477 -1.524 2
1 227 . 1 1 A 28 28 GLU HA H 28 4.067 4.020 0.047 2
1 232 . 1 1 A 28 28 GLU C C 28 179.006 179.279 -0.273 2
1 233 . 1 1 A 28 28 GLU CA C 28 58.985 59.561 -0.576 2
1 234 . 1 1 A 28 28 GLU CB C 28 29.316 29.155 0.161 2
1 236 . 1 1 A 28 28 GLU N N 28 120.554 119.288 1.266 2
1 237 . 1 1 A 29 29 ALA H H 29 7.999 7.920 0.080 2
1 238 . 1 1 A 29 29 ALA HA H 29 3.822 4.019 -0.196 2
1 242 . 1 1 A 29 29 ALA C C 29 178.809 179.854 -1.045 2
1 243 . 1 1 A 29 29 ALA CA C 29 54.698 54.975 -0.277 2
1 244 . 1 1 A 29 29 ALA CB C 29 18.059 18.370 -0.311 2
1 245 . 1 1 A 29 29 ALA N N 29 120.122 122.643 -2.521 2
1 246 . 1 1 A 30 30 GLN H H 30 8.168 7.974 0.194 2
1 247 . 1 1 A 30 30 GLN HA H 30 3.811 4.177 -0.366 2
1 254 . 1 1 A 30 30 GLN C C 30 177.578 178.015 -0.437 2
1 255 . 1 1 A 30 30 GLN CA C 30 59.731 58.569 1.162 2
1 256 . 1 1 A 30 30 GLN CB C 30 28.161 28.668 -0.507 2
1 258 . 1 1 A 30 30 GLN N N 30 112.109 115.948 -3.839 2
1 260 . 1 1 A 31 31 GLU H H 31 7.248 8.244 -0.996 2
1 261 . 1 1 A 31 31 GLU HA H 31 4.063 4.078 -0.015 2
1 266 . 1 1 A 31 31 GLU C C 31 177.423 179.026 -1.603 2
1 267 . 1 1 A 31 31 GLU CA C 31 57.650 59.056 -1.406 2
1 268 . 1 1 A 31 31 GLU CB C 31 29.757 29.302 0.455 2
1 270 . 1 1 A 31 31 GLU N N 31 115.340 119.522 -4.182 2
1 271 . 1 1 A 32 32 LEU H H 32 7.169 7.565 -0.396 2
1 272 . 1 1 A 32 32 LEU HA H 32 4.087 4.245 -0.158 2
1 282 . 1 1 A 32 32 LEU C C 32 175.850 176.936 -1.086 2
1 283 . 1 1 A 32 32 LEU CA C 32 55.580 56.509 -0.929 2
1 284 . 1 1 A 32 32 LEU CB C 32 42.910 41.633 1.277 2
1 288 . 1 1 A 32 32 LEU N N 32 116.367 114.992 1.375 2
1 289 . 1 1 A 33 33 LEU H H 33 7.062 7.637 -0.575 2
1 290 . 1 1 A 33 33 LEU HA H 33 4.431 4.320 0.111 2
1 300 . 1 1 A 33 33 LEU C C 33 174.837 177.034 -2.197 2
1 301 . 1 1 A 33 33 LEU CA C 33 53.521 54.808 -1.287 2
1 302 . 1 1 A 33 33 LEU CB C 33 43.301 41.538 1.763 2
1 306 . 1 1 A 33 33 LEU N N 33 118.568 122.393 -3.825 2
1 307 . 1 1 A 34 34 LYS H H 34 8.749 8.564 0.185 2
1 308 . 1 1 A 34 34 LYS HA H 34 4.162 4.275 -0.113 2
1 317 . 1 1 A 34 34 LYS C C 34 174.378 175.305 -0.927 2
1 318 . 1 1 A 34 34 LYS CA C 34 56.575 56.164 0.410 2
1 319 . 1 1 A 34 34 LYS CB C 34 36.918 34.350 2.568 2
1 323 . 1 1 A 34 34 LYS N N 34 121.659 118.382 3.277 2
1 324 . 1 1 A 35 35 LYS H H 35 8.137 7.437 0.700 2
1 325 . 1 1 A 35 35 LYS HA H 35 4.011 4.724 -0.713 2
1 334 . 1 1 A 35 35 LYS C C 35 174.343 175.240 -0.897 2
1 335 . 1 1 A 35 35 LYS CA C 35 53.960 54.514 -0.554 2
1 336 . 1 1 A 35 35 LYS CB C 35 35.587 35.320 0.267 2
1 340 . 1 1 A 35 35 LYS N N 35 119.354 116.238 3.116 2
1 341 . 1 1 A 36 36 GLN H H 36 8.394 8.666 -0.272 2
1 342 . 1 1 A 36 36 GLN HA H 36 4.187 4.515 -0.328 2
1 349 . 1 1 A 36 36 GLN C C 36 177.012 176.645 0.367 2
1 350 . 1 1 A 36 36 GLN CA C 36 57.750 57.726 0.024 2
1 351 . 1 1 A 36 36 GLN CB C 36 28.433 28.497 -0.064 2
1 353 . 1 1 A 36 36 GLN N N 36 120.248 122.826 -2.578 2
1 355 . 1 1 A 37 37 GLY H H 37 9.597 8.976 0.621 2
1 356 . 1 1 A 37 37 GLY HA2 H 37 4.486 4.115 0.371 2
1 357 . 1 1 A 37 37 GLY HA3 H 37 3.926 4.121 -0.195 2
1 358 . 1 1 A 37 37 GLY C C 37 176.285 174.470 1.815 2
1 359 . 1 1 A 37 37 GLY CA C 37 46.146 45.359 0.787 2
1 360 . 1 1 A 37 37 GLY N N 37 116.637 114.478 2.159 2
1 361 . 1 1 A 38 38 ASP H H 38 8.925 7.961 0.964 2
1 362 . 1 1 A 38 38 ASP HA H 38 5.697 4.691 1.006 2
1 365 . 1 1 A 38 38 ASP C C 38 176.181 175.712 0.469 2
1 366 . 1 1 A 38 38 ASP CA C 38 55.066 55.479 -0.413 2
1 367 . 1 1 A 38 38 ASP CB C 38 42.933 41.266 1.667 2
1 368 . 1 1 A 38 38 ASP N N 38 127.293 122.002 5.291 2
1 369 . 1 1 A 39 39 PHE H H 39 8.647 8.517 0.130 2
1 370 . 1 1 A 39 39 PHE HA H 39 6.025 5.956 0.069 2
1 378 . 1 1 A 39 39 PHE C C 39 170.948 173.015 -2.067 2
1 379 . 1 1 A 39 39 PHE CA C 39 56.376 56.063 0.313 2
1 380 . 1 1 A 39 39 PHE CB C 39 44.583 43.083 1.500 2
1 386 . 1 1 A 39 39 PHE N N 39 117.102 119.842 -2.740 2
1 387 . 1 1 A 40 40 LEU H H 40 9.186 9.029 0.157 2
1 388 . 1 1 A 40 40 LEU HA H 40 4.983 5.220 -0.237 2
1 398 . 1 1 A 40 40 LEU C C 40 174.787 174.537 0.250 2
1 399 . 1 1 A 40 40 LEU CA C 40 54.610 53.842 0.768 2
1 400 . 1 1 A 40 40 LEU CB C 40 44.330 45.896 -1.566 2
1 404 . 1 1 A 40 40 LEU N N 40 114.388 117.754 -3.366 2
1 405 . 1 1 A 41 41 VAL H H 41 9.390 9.377 0.013 2
1 406 . 1 1 A 41 41 VAL HA H 41 5.742 5.115 0.627 2
1 414 . 1 1 A 41 41 VAL C C 41 172.760 175.268 -2.508 2
1 415 . 1 1 A 41 41 VAL CA C 41 60.814 61.574 -0.760 2
1 416 . 1 1 A 41 41 VAL CB C 41 34.908 33.502 1.406 2
1 419 . 1 1 A 41 41 VAL N N 41 119.873 122.025 -2.152 2
1 420 . 1 1 A 42 42 ARG H H 42 9.598 9.241 0.357 2
1 421 . 1 1 A 42 42 ARG HA H 42 5.247 5.185 0.062 2
1 429 . 1 1 A 42 42 ARG C C 42 173.379 174.361 -0.982 2
1 430 . 1 1 A 42 42 ARG CA C 42 53.202 54.014 -0.812 2
1 431 . 1 1 A 42 42 ARG CB C 42 33.507 33.943 -0.436 2
1 434 . 1 1 A 42 42 ARG N N 42 124.179 124.722 -0.543 2
1 436 . 1 1 A 43 43 GLU H H 43 8.234 8.715 -0.481 2
1 437 . 1 1 A 43 43 GLU HA H 43 4.890 4.534 0.356 2
1 442 . 1 1 A 43 43 GLU C C 43 176.929 176.258 0.671 2
1 443 . 1 1 A 43 43 GLU CA C 43 54.846 55.333 -0.487 2
1 444 . 1 1 A 43 43 GLU CB C 43 31.599 31.503 0.096 2
1 446 . 1 1 A 43 43 GLU N N 43 124.103 122.797 1.306 2
1 447 . 1 1 A 44 44 SER H H 44 9.033 8.851 0.182 2
1 448 . 1 1 A 44 44 SER HA H 44 3.957 4.462 -0.505 2
1 451 . 1 1 A 44 44 SER C C 44 175.005 174.757 0.248 2
1 452 . 1 1 A 44 44 SER CA C 44 59.393 58.475 0.918 2
1 453 . 1 1 A 44 44 SER CB C 44 63.619 63.670 -0.051 2
1 454 . 1 1 A 44 44 SER N N 44 124.316 121.188 3.128 2
1 455 . 1 1 A 45 45 HIS H H 45 8.461 8.776 -0.315 2
1 456 . 1 1 A 45 45 HIS HA H 45 4.132 4.271 -0.139 2
1 460 . 1 1 A 45 45 HIS C C 45 176.480 177.196 -0.716 2
1 461 . 1 1 A 45 45 HIS CA C 45 58.887 58.310 0.577 2
1 462 . 1 1 A 45 45 HIS CB C 45 30.180 29.907 0.273 2
1 464 . 1 1 A 45 45 HIS N N 45 127.694 125.765 1.929 2
1 465 . 1 1 A 46 46 GLY H H 46 8.513 8.321 0.192 2
1 466 . 1 1 A 46 46 GLY HA2 H 46 3.827 3.844 -0.017 2
1 467 . 1 1 A 46 46 GLY HA3 H 46 3.827 3.870 -0.043 2
1 468 . 1 1 A 46 46 GLY C C 46 173.630 174.074 -0.444 2
1 469 . 1 1 A 46 46 GLY CA C 46 45.188 46.080 -0.892 2
1 470 . 1 1 A 46 46 GLY N N 46 110.761 108.594 2.167 2
1 471 . 1 1 A 47 47 LYS H H 47 7.216 7.742 -0.526 2
1 472 . 1 1 A 47 47 LYS HA H 47 4.540 4.747 -0.207 2
1 481 . 1 1 A 47 47 LYS CA C 47 53.475 52.998 0.478 2
1 482 . 1 1 A 47 47 LYS CB C 47 33.325 33.928 -0.603 2
1 486 . 1 1 A 47 47 LYS N N 47 121.356 120.730 0.626 2
1 487 . 1 1 A 48 48 PRO HA H 48 4.181 4.261 -0.080 2
1 494 . 1 1 A 48 48 PRO C C 48 178.920 177.550 1.370 2
1 495 . 1 1 A 48 48 PRO CA C 48 63.239 63.717 -0.478 2
1 496 . 1 1 A 48 48 PRO CB C 48 31.523 31.288 0.235 2
1 499 . 1 1 A 49 49 GLY H H 49 9.752 8.655 1.097 2
1 500 . 1 1 A 49 49 GLY HA2 H 49 4.053 3.926 0.127 2
1 501 . 1 1 A 49 49 GLY HA3 H 49 3.374 3.999 -0.625 2
1 502 . 1 1 A 49 49 GLY C C 49 172.093 173.983 -1.890 2
1 503 . 1 1 A 49 49 GLY CA C 49 45.041 45.237 -0.196 2
1 504 . 1 1 A 49 49 GLY N N 49 112.415 112.717 -0.302 2
1 505 . 1 1 A 50 50 GLU H H 50 7.623 7.706 -0.083 2
1 506 . 1 1 A 50 50 GLU HA H 50 4.537 4.679 -0.142 2
1 511 . 1 1 A 50 50 GLU C C 50 173.297 174.980 -1.683 2
1 512 . 1 1 A 50 50 GLU CA C 50 55.174 55.626 -0.452 2
1 513 . 1 1 A 50 50 GLU CB C 50 31.651 30.672 0.979 2
1 515 . 1 1 A 50 50 GLU N N 50 121.600 121.535 0.065 2
1 516 . 1 1 A 51 51 TYR H H 51 9.452 9.190 0.262 2
1 517 . 1 1 A 51 51 TYR HA H 51 5.382 5.340 0.042 2
1 524 . 1 1 A 51 51 TYR C C 51 174.387 175.251 -0.864 2
1 525 . 1 1 A 51 51 TYR CA C 51 57.592 57.330 0.262 2
1 526 . 1 1 A 51 51 TYR CB C 51 41.820 40.782 1.038 2
1 531 . 1 1 A 51 51 TYR N N 51 125.790 126.894 -1.104 2
1 532 . 1 1 A 52 52 VAL H H 52 9.471 9.475 -0.004 2
1 533 . 1 1 A 52 52 VAL HA H 52 4.840 4.977 -0.137 2
1 541 . 1 1 A 52 52 VAL C C 52 174.947 174.863 0.084 2
1 542 . 1 1 A 52 52 VAL CA C 52 60.991 61.254 -0.263 2
1 543 . 1 1 A 52 52 VAL CB C 52 36.829 34.364 2.465 2
1 546 . 1 1 A 52 52 VAL N N 52 120.617 122.899 -2.282 2
1 547 . 1 1 A 53 53 LEU H H 53 9.457 9.367 0.090 2
1 548 . 1 1 A 53 53 LEU HA H 53 5.294 5.165 0.129 2
1 558 . 1 1 A 53 53 LEU C C 53 175.024 175.116 -0.092 2
1 559 . 1 1 A 53 53 LEU CA C 53 53.904 54.467 -0.563 2
1 560 . 1 1 A 53 53 LEU CB C 53 44.756 44.035 0.721 2
1 564 . 1 1 A 53 53 LEU N N 53 127.725 131.313 -3.588 2
1 565 . 1 1 A 54 54 SER H H 54 9.461 9.346 0.115 2
1 566 . 1 1 A 54 54 SER HA H 54 5.691 5.405 0.286 2
1 569 . 1 1 A 54 54 SER C C 54 172.227 173.124 -0.897 2
1 570 . 1 1 A 54 54 SER CA C 54 58.551 57.525 1.026 2
1 571 . 1 1 A 54 54 SER CB C 54 65.738 64.649 1.089 2
1 572 . 1 1 A 54 54 SER N N 54 127.178 123.893 3.285 2
1 573 . 1 1 A 55 55 VAL H H 55 9.049 8.941 0.108 2
1 574 . 1 1 A 55 55 VAL HA H 55 5.691 5.435 0.256 2
1 582 . 1 1 A 55 55 VAL C C 55 173.959 172.968 0.991 2
1 583 . 1 1 A 55 55 VAL CA C 55 58.398 59.730 -1.333 2
1 584 . 1 1 A 55 55 VAL CB C 55 36.262 35.665 0.597 2
1 587 . 1 1 A 55 55 VAL N N 55 120.619 125.503 -4.884 2
1 588 . 1 1 A 56 56 TYR H H 56 8.629 9.239 -0.610 2
1 589 . 1 1 A 56 56 TYR HA H 56 4.951 4.983 -0.032 2
1 596 . 1 1 A 56 56 TYR C C 56 175.224 174.562 0.662 2
1 597 . 1 1 A 56 56 TYR CA C 56 56.684 56.612 0.072 2
1 598 . 1 1 A 56 56 TYR CB C 56 39.646 39.362 0.284 2
1 603 . 1 1 A 56 56 TYR N N 56 127.444 130.131 -2.687 2
1 604 . 1 1 A 57 57 SER H H 57 8.869 8.785 0.084 2
1 605 . 1 1 A 57 57 SER HA H 57 4.739 4.926 -0.187 2
1 608 . 1 1 A 57 57 SER C C 57 174.492 172.999 1.493 2
1 609 . 1 1 A 57 57 SER CA C 57 57.591 56.982 0.609 2
1 610 . 1 1 A 57 57 SER CB C 57 64.281 66.171 -1.890 2
1 611 . 1 1 A 57 57 SER N N 57 122.165 122.888 -0.723 2
1 612 . 1 1 A 58 58 ASP H H 58 10.446 9.360 1.086 2
1 613 . 1 1 A 58 58 ASP HA H 58 4.382 4.289 0.093 2
1 616 . 1 1 A 58 58 ASP C C 58 176.398 175.883 0.515 2
1 617 . 1 1 A 58 58 ASP CA C 58 55.215 55.185 0.030 2
1 618 . 1 1 A 58 58 ASP CB C 58 39.513 39.423 0.090 2
1 619 . 1 1 A 58 58 ASP N N 58 132.098 127.859 4.238 2
1 620 . 1 1 A 59 59 GLY H H 59 7.861 8.358 -0.497 2
1 621 . 1 1 A 59 59 GLY HA2 H 59 3.817 3.724 0.093 2
1 622 . 1 1 A 59 59 GLY HA3 H 59 4.086 3.796 0.290 2
1 623 . 1 1 A 59 59 GLY C C 59 173.111 173.444 -0.333 2
1 624 . 1 1 A 59 59 GLY CA C 59 45.486 45.249 0.237 2
1 625 . 1 1 A 59 59 GLY N N 59 102.674 104.447 -1.773 2
1 626 . 1 1 A 60 60 GLN H H 60 7.137 7.574 -0.437 2
1 627 . 1 1 A 60 60 GLN HA H 60 4.455 4.533 -0.078 2
1 634 . 1 1 A 60 60 GLN C C 60 173.549 174.839 -1.290 2
1 635 . 1 1 A 60 60 GLN CA C 60 53.388 53.891 -0.503 2
1 636 . 1 1 A 60 60 GLN CB C 60 32.373 31.021 1.352 2
1 638 . 1 1 A 60 60 GLN N N 60 116.206 119.160 -2.954 2
1 640 . 1 1 A 61 61 ARG H H 61 8.589 8.380 0.208 2
1 641 . 1 1 A 61 61 ARG HA H 61 4.740 4.446 0.294 2
1 649 . 1 1 A 61 61 ARG C C 61 174.458 174.655 -0.197 2
1 650 . 1 1 A 61 61 ARG CA C 61 57.116 55.502 1.614 2
1 651 . 1 1 A 61 61 ARG CB C 61 29.615 30.624 -1.009 2
1 654 . 1 1 A 61 61 ARG N N 61 120.467 121.932 -1.465 2
1 656 . 1 1 A 62 62 ARG H H 62 8.867 8.833 0.034 2
1 657 . 1 1 A 62 62 ARG HA H 62 4.297 4.312 -0.015 2
1 665 . 1 1 A 62 62 ARG C C 62 173.485 175.312 -1.827 2
1 666 . 1 1 A 62 62 ARG CA C 62 53.355 55.404 -2.049 2
1 667 . 1 1 A 62 62 ARG CB C 62 33.028 31.076 1.952 2
1 670 . 1 1 A 62 62 ARG N N 62 122.641 124.565 -1.924 2
1 672 . 1 1 A 63 63 HIS H H 63 7.997 8.448 -0.451 2
1 673 . 1 1 A 63 63 HIS HA H 63 5.427 5.369 0.058 2
1 678 . 1 1 A 63 63 HIS C C 63 174.946 173.939 1.008 2
1 679 . 1 1 A 63 63 HIS CA C 63 54.689 53.886 0.803 2
1 680 . 1 1 A 63 63 HIS CB C 63 33.008 32.211 0.797 2
1 683 . 1 1 A 63 63 HIS N N 63 119.064 119.974 -0.910 2
1 684 . 1 1 A 64 64 PHE H H 64 9.880 9.355 0.525 2
1 685 . 1 1 A 64 64 PHE HA H 64 4.824 5.056 -0.232 2
1 693 . 1 1 A 64 64 PHE C C 64 174.882 175.244 -0.362 2
1 694 . 1 1 A 64 64 PHE CA C 64 56.489 56.477 0.012 2
1 695 . 1 1 A 64 64 PHE CB C 64 41.405 41.319 0.086 2
1 701 . 1 1 A 64 64 PHE N N 64 123.961 122.076 1.885 2
1 702 . 1 1 A 65 65 ILE H H 65 8.982 9.137 -0.155 2
1 703 . 1 1 A 65 65 ILE HA H 65 4.273 4.628 -0.355 2
1 713 . 1 1 A 65 65 ILE C C 65 176.556 175.871 0.685 2
1 714 . 1 1 A 65 65 ILE CA C 65 62.649 61.168 1.481 2
1 715 . 1 1 A 65 65 ILE CB C 65 38.296 38.584 -0.288 2
1 719 . 1 1 A 65 65 ILE N N 65 126.601 124.207 2.394 2
1 720 . 1 1 A 66 66 ILE H H 66 8.947 9.033 -0.086 2
1 721 . 1 1 A 66 66 ILE HA H 66 3.780 4.328 -0.548 2
1 731 . 1 1 A 66 66 ILE C C 66 175.721 175.584 0.137 2
1 732 . 1 1 A 66 66 ILE CA C 66 62.960 60.865 2.095 2
1 733 . 1 1 A 66 66 ILE CB C 66 37.209 38.230 -1.021 2
1 737 . 1 1 A 66 66 ILE N N 66 130.139 129.069 1.070 2
1 738 . 1 1 A 67 67 GLN H H 67 8.410 8.798 -0.388 2
1 739 . 1 1 A 67 67 GLN HA H 67 4.422 4.846 -0.424 2
1 746 . 1 1 A 67 67 GLN C C 67 174.347 174.168 0.179 2
1 747 . 1 1 A 67 67 GLN CA C 67 55.867 55.258 0.608 2
1 748 . 1 1 A 67 67 GLN CB C 67 29.950 30.158 -0.208 2
1 750 . 1 1 A 67 67 GLN N N 67 128.872 127.164 1.708 2
1 752 . 1 1 A 68 68 TYR H H 68 8.619 8.945 -0.326 2
1 753 . 1 1 A 68 68 TYR HA H 68 5.300 4.828 0.472 2
1 760 . 1 1 A 68 68 TYR C C 68 174.695 174.222 0.473 2
1 761 . 1 1 A 68 68 TYR CA C 68 55.579 56.315 -0.736 2
1 762 . 1 1 A 68 68 TYR CB C 68 39.479 39.058 0.421 2
1 767 . 1 1 A 68 68 TYR N N 68 124.772 125.507 -0.735 2
1 768 . 1 1 A 69 69 VAL H H 69 8.539 8.643 -0.104 2
1 769 . 1 1 A 69 69 VAL HA H 69 4.046 4.344 -0.298 2
1 777 . 1 1 A 69 69 VAL C C 69 175.010 175.225 -0.215 2
1 778 . 1 1 A 69 69 VAL CA C 69 60.611 60.783 -0.172 2
1 779 . 1 1 A 69 69 VAL CB C 69 35.358 34.270 1.088 2
1 782 . 1 1 A 69 69 VAL N N 69 126.652 127.529 -0.877 2
1 783 . 1 1 A 70 70 ASP H H 70 9.089 9.300 -0.211 2
1 784 . 1 1 A 70 70 ASP HA H 70 4.025 4.185 -0.160 2
1 787 . 1 1 A 70 70 ASP C C 70 174.813 175.050 -0.237 2
1 788 . 1 1 A 70 70 ASP CA C 70 55.623 55.510 0.113 2
1 789 . 1 1 A 70 70 ASP CB C 70 39.081 39.123 -0.042 2
1 790 . 1 1 A 70 70 ASP N N 70 128.327 128.495 -0.168 2
1 791 . 1 1 A 71 71 ASN H H 71 8.128 8.068 0.060 2
1 792 . 1 1 A 71 71 ASN HA H 71 3.597 3.659 -0.062 2
1 797 . 1 1 A 71 71 ASN C C 71 173.250 173.669 -0.419 2
1 798 . 1 1 A 71 71 ASN CA C 71 54.728 54.325 0.403 2
1 799 . 1 1 A 71 71 ASN CB C 71 37.601 37.097 0.504 2
1 800 . 1 1 A 71 71 ASN N N 71 107.230 107.857 -0.627 2
1 802 . 1 1 A 72 72 MET H H 72 7.256 7.394 -0.138 2
1 803 . 1 1 A 72 72 MET HA H 72 4.740 4.848 -0.108 2
1 808 . 1 1 A 72 72 MET C C 72 173.780 174.397 -0.617 2
1 809 . 1 1 A 72 72 MET CA C 72 53.703 54.118 -0.416 2
1 810 . 1 1 A 72 72 MET CB C 72 36.570 35.874 0.696 2
1 812 . 1 1 A 72 72 MET N N 72 117.117 117.054 0.063 2
1 813 . 1 1 A 73 73 TYR H H 73 9.430 9.213 0.217 2
1 814 . 1 1 A 73 73 TYR HA H 73 5.718 5.143 0.575 2
1 821 . 1 1 A 73 73 TYR C C 73 176.140 175.799 0.341 2
1 822 . 1 1 A 73 73 TYR CA C 73 57.290 57.745 -0.455 2
1 823 . 1 1 A 73 73 TYR CB C 73 40.013 39.533 0.480 2
1 828 . 1 1 A 73 73 TYR N N 73 119.856 122.176 -2.320 2
1 829 . 1 1 A 74 74 ARG H H 74 9.038 8.842 0.196 2
1 830 . 1 1 A 74 74 ARG HA H 74 4.867 4.984 -0.117 2
1 838 . 1 1 A 74 74 ARG C C 74 173.954 175.067 -1.113 2
1 839 . 1 1 A 74 74 ARG CA C 74 54.887 54.346 0.541 2
1 840 . 1 1 A 74 74 ARG CB C 74 34.484 34.039 0.445 2
1 843 . 1 1 A 74 74 ARG N N 74 117.344 121.117 -3.773 2
1 845 . 1 1 A 75 75 PHE H H 75 9.005 8.826 0.179 2
1 846 . 1 1 A 75 75 PHE HA H 75 5.046 4.667 0.379 2
1 854 . 1 1 A 75 75 PHE C C 75 176.186 176.570 -0.384 2
1 855 . 1 1 A 75 75 PHE CA C 75 59.658 59.623 0.035 2
1 856 . 1 1 A 75 75 PHE CB C 75 39.356 40.203 -0.847 2
1 862 . 1 1 A 75 75 PHE N N 75 117.865 119.984 -2.119 2
1 863 . 1 1 A 76 76 GLU H H 76 8.213 8.292 -0.079 2
1 864 . 1 1 A 76 76 GLU HA H 76 4.586 4.534 0.052 2
1 869 . 1 1 A 76 76 GLU C C 76 175.238 177.583 -2.345 2
1 870 . 1 1 A 76 76 GLU CA C 76 55.994 57.736 -1.742 2
1 871 . 1 1 A 76 76 GLU CB C 76 31.805 31.085 0.720 2
1 873 . 1 1 A 76 76 GLU N N 76 116.834 118.104 -1.270 2
1 874 . 1 1 A 77 77 GLY H H 77 8.692 7.966 0.726 2
1 875 . 1 1 A 77 77 GLY HA2 H 77 4.166 4.038 0.128 2
1 876 . 1 1 A 77 77 GLY HA3 H 77 4.015 4.044 -0.029 2
1 877 . 1 1 A 77 77 GLY C C 77 173.784 174.153 -0.369 2
1 878 . 1 1 A 77 77 GLY CA C 77 45.505 45.804 -0.299 2
1 879 . 1 1 A 77 77 GLY N N 77 111.937 108.136 3.801 2
1 880 . 1 1 A 78 78 THR H H 78 8.332 7.986 0.346 2
1 881 . 1 1 A 78 78 THR HA H 78 3.900 4.284 -0.384 2
1 886 . 1 1 A 78 78 THR C C 78 173.591 174.330 -0.739 2
1 887 . 1 1 A 78 78 THR CA C 78 63.653 62.894 0.759 2
1 888 . 1 1 A 78 78 THR CB C 78 69.649 69.341 0.308 2
1 890 . 1 1 A 78 78 THR N N 78 120.765 115.706 5.059 2
1 891 . 1 1 A 79 79 GLY H H 79 8.038 8.440 -0.402 2
1 892 . 1 1 A 79 79 GLY HA2 H 79 4.748 4.328 0.420 2
1 893 . 1 1 A 79 79 GLY HA3 H 79 3.546 4.454 -0.908 2
1 894 . 1 1 A 79 79 GLY C C 79 172.580 171.983 0.597 2
1 895 . 1 1 A 79 79 GLY CA C 79 44.661 44.858 -0.197 2
1 896 . 1 1 A 79 79 GLY N N 79 109.887 113.210 -3.323 2
1 897 . 1 1 A 80 80 PHE H H 80 9.064 8.701 0.362 2
1 898 . 1 1 A 80 80 PHE HA H 80 4.886 4.976 -0.090 2
1 906 . 1 1 A 80 80 PHE C C 80 176.507 176.200 0.307 2
1 907 . 1 1 A 80 80 PHE CA C 80 57.257 56.709 0.548 2
1 908 . 1 1 A 80 80 PHE CB C 80 44.655 42.654 2.001 2
1 914 . 1 1 A 80 80 PHE N N 80 116.862 120.118 -3.256 2
1 915 . 1 1 A 81 81 SER H H 81 9.413 8.870 0.543 2
1 916 . 1 1 A 81 81 SER HA H 81 4.622 4.500 0.122 2
1 919 . 1 1 A 81 81 SER C C 81 173.735 174.535 -0.799 2
1 920 . 1 1 A 81 81 SER CA C 81 61.410 61.188 0.222 2
1 921 . 1 1 A 81 81 SER CB C 81 64.165 63.328 0.837 2
1 922 . 1 1 A 81 81 SER N N 81 116.467 116.861 -0.394 2
1 923 . 1 1 A 82 82 ASN H H 82 7.688 8.122 -0.434 2
1 924 . 1 1 A 82 82 ASN HA H 82 4.952 5.232 -0.280 2
1 929 . 1 1 A 82 82 ASN C C 82 173.303 175.551 -2.248 2
1 930 . 1 1 A 82 82 ASN CA C 82 52.086 52.200 -0.114 2
1 931 . 1 1 A 82 82 ASN CB C 82 41.258 40.983 0.275 2
1 932 . 1 1 A 82 82 ASN N N 82 113.355 116.909 -3.554 2
1 934 . 1 1 A 83 83 ILE H H 83 8.858 8.715 0.143 2
1 935 . 1 1 A 83 83 ILE HA H 83 3.571 3.710 -0.139 2
1 945 . 1 1 A 83 83 ILE CA C 83 66.416 65.379 1.037 2
1 946 . 1 1 A 83 83 ILE CB C 83 35.074 34.799 0.275 2
1 950 . 1 1 A 83 83 ILE N N 83 118.908 123.316 -4.408 2
1 951 . 1 1 A 84 84 PRO HA H 84 4.411 4.687 -0.276 2
1 958 . 1 1 A 84 84 PRO C C 84 177.616 179.419 -1.803 2
1 959 . 1 1 A 84 84 PRO CA C 84 67.525 66.501 1.024 2
1 960 . 1 1 A 84 84 PRO CB C 84 31.029 30.830 0.199 2
1 963 . 1 1 A 85 85 GLN H H 85 8.405 8.318 0.087 2
1 964 . 1 1 A 85 85 GLN HA H 85 3.874 4.032 -0.158 2
1 971 . 1 1 A 85 85 GLN C C 85 178.213 178.247 -0.034 2
1 972 . 1 1 A 85 85 GLN CA C 85 59.495 58.645 0.850 2
1 973 . 1 1 A 85 85 GLN CB C 85 29.270 28.195 1.075 2
1 975 . 1 1 A 85 85 GLN N N 85 115.597 117.387 -1.790 2
1 977 . 1 1 A 86 86 LEU H H 86 7.136 8.080 -0.944 2
1 978 . 1 1 A 86 86 LEU HA H 86 3.589 3.632 -0.043 2
1 988 . 1 1 A 86 86 LEU C C 86 177.728 178.438 -0.710 2
1 989 . 1 1 A 86 86 LEU CA C 86 58.136 58.320 -0.184 2
1 990 . 1 1 A 86 86 LEU CB C 86 42.290 41.755 0.536 2
1 994 . 1 1 A 86 86 LEU N N 86 121.840 121.918 -0.078 2
1 995 . 1 1 A 87 87 ILE H H 87 8.323 7.958 0.365 2
1 996 . 1 1 A 87 87 ILE HA H 87 3.415 3.361 0.054 2
1 1006 . 1 1 A 87 87 ILE C C 87 178.064 177.696 0.368 2
1 1007 . 1 1 A 87 87 ILE CA C 87 61.458 65.385 -3.927 2
1 1008 . 1 1 A 87 87 ILE CB C 87 34.561 37.464 -2.903 2
1 1012 . 1 1 A 87 87 ILE N N 87 118.117 119.549 -1.433 2
1 1013 . 1 1 A 88 88 ASP H H 88 8.805 8.395 0.410 2
1 1014 . 1 1 A 88 88 ASP HA H 88 4.548 4.292 0.256 2
1 1017 . 1 1 A 88 88 ASP C C 88 179.265 178.181 1.084 2
1 1018 . 1 1 A 88 88 ASP CA C 88 58.099 57.343 0.756 2
1 1019 . 1 1 A 88 88 ASP CB C 88 42.166 41.869 0.297 2
1 1020 . 1 1 A 88 88 ASP N N 88 119.143 120.528 -1.385 2
1 1021 . 1 1 A 89 89 HIS H H 89 8.113 8.017 0.096 2
1 1022 . 1 1 A 89 89 HIS HA H 89 4.225 4.292 -0.067 2
1 1026 . 1 1 A 89 89 HIS C C 89 179.261 177.077 2.184 2
1 1027 . 1 1 A 89 89 HIS CA C 89 60.647 59.086 1.561 2
1 1028 . 1 1 A 89 89 HIS CB C 89 30.801 29.642 1.159 2
1 1030 . 1 1 A 89 89 HIS N N 89 119.595 119.032 0.563 2
1 1031 . 1 1 A 90 90 HIS H H 90 7.685 7.857 -0.172 2
1 1032 . 1 1 A 90 90 HIS HA H 90 3.628 4.108 -0.480 2
1 1036 . 1 1 A 90 90 HIS C C 90 178.454 177.474 0.980 2
1 1037 . 1 1 A 90 90 HIS CA C 90 61.797 59.957 1.840 2
1 1038 . 1 1 A 90 90 HIS CB C 90 28.165 29.980 -1.815 2
1 1040 . 1 1 A 90 90 HIS N N 90 120.061 117.342 2.719 2
1 1041 . 1 1 A 91 91 TYR H H 91 9.394 8.293 1.101 2
1 1042 . 1 1 A 91 91 TYR HA H 91 4.238 3.920 0.318 2
1 1049 . 1 1 A 91 91 TYR C C 91 176.443 177.558 -1.115 2
1 1050 . 1 1 A 91 91 TYR CA C 91 60.669 61.730 -1.061 2
1 1051 . 1 1 A 91 91 TYR CB C 91 39.169 38.904 0.265 2
1 1056 . 1 1 A 91 91 TYR N N 91 123.532 120.054 3.478 2
1 1057 . 1 1 A 92 92 THR H H 92 8.774 8.502 0.272 2
1 1058 . 1 1 A 92 92 THR HA H 92 3.866 4.047 -0.181 2
1 1063 . 1 1 A 92 92 THR C C 92 177.050 176.234 0.816 2
1 1064 . 1 1 A 92 92 THR CA C 92 65.240 65.343 -0.103 2
1 1065 . 1 1 A 92 92 THR CB C 92 69.298 68.123 1.175 2
1 1067 . 1 1 A 92 92 THR N N 92 112.000 112.775 -0.775 2
1 1068 . 1 1 A 93 93 THR H H 93 7.617 7.516 0.101 2
1 1069 . 1 1 A 93 93 THR HA H 93 4.133 4.136 -0.003 2
1 1074 . 1 1 A 93 93 THR C C 93 176.234 174.896 1.338 2
1 1075 . 1 1 A 93 93 THR CA C 93 63.527 62.526 1.001 2
1 1076 . 1 1 A 93 93 THR CB C 93 71.234 69.742 1.492 2
1 1078 . 1 1 A 93 93 THR N N 93 109.883 112.510 -2.627 2
1 1079 . 1 1 A 94 94 LYS H H 94 7.210 7.715 -0.505 2
1 1080 . 1 1 A 94 94 LYS HA H 94 3.830 3.753 0.077 2
1 1089 . 1 1 A 94 94 LYS C C 94 174.331 175.311 -0.980 2
1 1090 . 1 1 A 94 94 LYS CA C 94 56.776 57.358 -0.582 2
1 1091 . 1 1 A 94 94 LYS CB C 94 28.095 30.940 -2.845 2
1 1095 . 1 1 A 94 94 LYS N N 94 112.818 121.229 -8.411 2
1 1096 . 1 1 A 95 95 GLN H H 95 7.439 7.540 -0.101 2
1 1097 . 1 1 A 95 95 GLN HA H 95 4.216 4.578 -0.362 2
1 1104 . 1 1 A 95 95 GLN C C 95 179.087 175.717 3.370 2
1 1105 . 1 1 A 95 95 GLN CA C 95 56.378 54.803 1.575 2
1 1106 . 1 1 A 95 95 GLN CB C 95 28.542 30.257 -1.715 2
1 1108 . 1 1 A 95 95 GLN N N 95 117.860 118.980 -1.120 2
1 1110 . 1 1 A 96 96 VAL H H 96 8.520 8.514 0.006 2
1 1111 . 1 1 A 96 96 VAL HA H 96 4.297 4.505 -0.208 2
1 1119 . 1 1 A 96 96 VAL C C 96 177.329 176.658 0.671 2
1 1120 . 1 1 A 96 96 VAL CA C 96 61.196 61.809 -0.613 2
1 1121 . 1 1 A 96 96 VAL CB C 96 32.735 33.243 -0.508 2
1 1124 . 1 1 A 96 96 VAL N N 96 124.208 120.315 3.893 2
1 1125 . 1 1 A 97 97 ILE H H 97 8.491 8.499 -0.008 2
1 1126 . 1 1 A 97 97 ILE HA H 97 2.995 3.576 -0.581 2
1 1136 . 1 1 A 97 97 ILE CA C 97 62.066 63.151 -1.085 2
1 1137 . 1 1 A 97 97 ILE CB C 97 36.117 37.797 -1.680 2
1 1141 . 1 1 A 97 97 ILE N N 97 119.561 124.188 -4.627 2
1 1142 . 1 1 A 98 98 THR HA H 98 4.460 4.594 -0.134 2
1 1147 . 1 1 A 98 98 THR C C 98 174.335 174.801 -0.466 2
1 1148 . 1 1 A 98 98 THR CA C 98 58.244 59.531 -1.287 2
1 1149 . 1 1 A 98 98 THR CB C 98 73.056 71.619 1.437 2
1 1151 . 1 1 A 99 99 LYS H H 99 9.761 8.991 0.770 2
1 1152 . 1 1 A 99 99 LYS HA H 99 3.911 4.028 -0.117 2
1 1161 . 1 1 A 99 99 LYS C C 99 179.594 178.483 1.111 2
1 1162 . 1 1 A 99 99 LYS CA C 99 59.661 58.998 0.663 2
1 1163 . 1 1 A 99 99 LYS CB C 99 31.978 32.064 -0.086 2
1 1167 . 1 1 A 99 99 LYS N N 99 125.750 122.427 3.324 2
1 1168 . 1 1 A 100 100 LYS H H 100 8.910 7.776 1.134 2
1 1169 . 1 1 A 100 100 LYS HA H 100 4.024 4.134 -0.110 2
1 1178 . 1 1 A 100 100 LYS C C 100 178.060 177.623 0.437 2
1 1179 . 1 1 A 100 100 LYS CA C 100 58.642 58.781 -0.139 2
1 1180 . 1 1 A 100 100 LYS CB C 100 32.750 32.311 0.439 2
1 1184 . 1 1 A 100 100 LYS N N 100 117.112 119.534 -2.422 2
1 1185 . 1 1 A 101 101 SER H H 101 7.721 7.614 0.107 2
1 1186 . 1 1 A 101 101 SER HA H 101 4.282 4.622 -0.340 2
1 1189 . 1 1 A 101 101 SER C C 101 176.403 175.316 1.087 2
1 1190 . 1 1 A 101 101 SER CA C 101 60.442 58.948 1.494 2
1 1191 . 1 1 A 101 101 SER CB C 101 63.775 65.094 -1.319 2
1 1192 . 1 1 A 101 101 SER N N 101 112.069 111.740 0.329 2
1 1193 . 1 1 A 102 102 GLY H H 102 8.038 8.402 -0.364 2
1 1194 . 1 1 A 102 102 GLY HA2 H 102 4.024 3.899 0.125 2
1 1195 . 1 1 A 102 102 GLY HA3 H 102 3.713 3.920 -0.207 2
1 1196 . 1 1 A 102 102 GLY C C 102 173.991 174.596 -0.605 2
1 1197 . 1 1 A 102 102 GLY CA C 102 46.458 46.210 0.248 2
1 1198 . 1 1 A 102 102 GLY N N 102 111.144 109.978 1.166 2
1 1199 . 1 1 A 103 103 VAL H H 103 7.155 7.718 -0.563 2
1 1200 . 1 1 A 103 103 VAL HA H 103 3.652 4.096 -0.444 2
1 1208 . 1 1 A 103 103 VAL C C 103 173.805 175.120 -1.315 2
1 1209 . 1 1 A 103 103 VAL CA C 103 64.310 62.350 1.960 2
1 1210 . 1 1 A 103 103 VAL CB C 103 32.254 32.467 -0.213 2
1 1213 . 1 1 A 103 103 VAL N N 103 119.836 120.989 -1.153 2
1 1214 . 1 1 A 104 104 VAL H H 104 7.653 9.035 -1.382 2
1 1215 . 1 1 A 104 104 VAL HA H 104 4.048 4.515 -0.467 2
1 1223 . 1 1 A 104 104 VAL C C 104 175.708 174.366 1.342 2
1 1224 . 1 1 A 104 104 VAL CA C 104 60.275 60.782 -0.507 2
1 1225 . 1 1 A 104 104 VAL CB C 104 35.112 34.315 0.797 2
1 1228 . 1 1 A 104 104 VAL N N 104 125.859 127.925 -2.066 2
1 1229 . 1 1 A 105 105 LEU H H 105 8.616 8.346 0.270 2
1 1230 . 1 1 A 105 105 LEU HA H 105 3.905 4.629 -0.724 2
1 1240 . 1 1 A 105 105 LEU C C 105 175.380 175.835 -0.455 2
1 1241 . 1 1 A 105 105 LEU CA C 105 54.471 53.680 0.791 2
1 1242 . 1 1 A 105 105 LEU CB C 105 39.821 41.649 -1.828 2
1 1246 . 1 1 A 105 105 LEU N N 105 123.839 126.432 -2.593 2
1 1247 . 1 1 A 106 106 LEU H H 106 8.894 8.567 0.327 2
1 1248 . 1 1 A 106 106 LEU HA H 106 4.839 4.996 -0.157 2
1 1258 . 1 1 A 106 106 LEU C C 106 176.930 176.348 0.582 2
1 1259 . 1 1 A 106 106 LEU CA C 106 56.288 53.180 3.108 2
1 1260 . 1 1 A 106 106 LEU CB C 106 45.237 45.532 -0.295 2
1 1264 . 1 1 A 106 106 LEU N N 106 120.590 121.469 -0.879 2
1 1265 . 1 1 A 107 107 ASN H H 107 8.124 9.045 -0.921 2
1 1266 . 1 1 A 107 107 ASN HA H 107 5.650 4.606 1.044 2
1 1271 . 1 1 A 107 107 ASN CA C 107 50.293 53.968 -3.675 2
1 1272 . 1 1 A 107 107 ASN CB C 107 41.223 36.296 4.927 2
1 1273 . 1 1 A 107 107 ASN N N 107 116.866 118.089 -1.223 2
1 1275 . 1 1 A 108 108 PRO HA H 108 2.926 3.893 -0.967 2
1 1282 . 1 1 A 108 108 PRO C C 108 176.671 175.824 0.847 2
1 1283 . 1 1 A 108 108 PRO CA C 108 60.804 62.427 -1.623 2
1 1284 . 1 1 A 108 108 PRO CB C 108 31.774 31.967 -0.193 2
1 1287 . 1 1 A 109 109 ILE H H 109 8.648 7.760 0.888 2
1 1288 . 1 1 A 109 109 ILE HA H 109 4.519 4.470 0.049 2
1 1298 . 1 1 A 109 109 ILE CA C 109 55.070 58.662 -3.592 2
1 1299 . 1 1 A 109 109 ILE CB C 109 36.068 38.323 -2.255 2
1 1303 . 1 1 A 109 109 ILE N N 109 128.817 123.025 5.792 2
1 1304 . 1 1 A 110 110 PRO HA H 110 4.587 4.546 0.041 2
1 1311 . 1 1 A 110 110 PRO C C 110 177.013 176.318 0.695 2
1 1312 . 1 1 A 110 110 PRO CA C 110 61.850 62.571 -0.721 2
1 1313 . 1 1 A 110 110 PRO CB C 110 32.507 32.415 0.092 2
1 1316 . 1 1 A 111 111 LYS H H 111 8.038 8.206 -0.168 2
1 1317 . 1 1 A 111 111 LYS HA H 111 3.553 4.185 -0.632 2
1 1326 . 1 1 A 111 111 LYS C C 111 176.123 175.056 1.067 2
1 1327 . 1 1 A 111 111 LYS CA C 111 56.220 54.764 1.456 2
1 1328 . 1 1 A 111 111 LYS CB C 111 32.373 34.218 -1.845 2
1 1332 . 1 1 A 111 111 LYS N N 111 120.147 117.686 2.461 2
1 1333 . 1 1 A 112 112 ASP H H 112 8.463 8.512 -0.049 2
1 1334 . 1 1 A 112 112 ASP HA H 112 4.523 4.750 -0.227 2
1 1337 . 1 1 A 112 112 ASP C C 112 175.986 175.911 0.075 2
1 1338 . 1 1 A 112 112 ASP CA C 112 54.256 53.446 0.810 2
1 1339 . 1 1 A 112 112 ASP CB C 112 41.563 41.981 -0.418 2
1 1340 . 1 1 A 112 112 ASP N N 112 121.863 121.289 0.574 2
1 1341 . 1 1 A 113 113 LYS H H 113 8.059 8.452 -0.393 2
1 1342 . 1 1 A 113 113 LYS HA H 113 4.136 4.271 -0.135 2
1 1351 . 1 1 A 113 113 LYS C C 113 176.010 175.894 0.116 2
1 1352 . 1 1 A 113 113 LYS CA C 113 56.253 56.167 0.086 2
1 1353 . 1 1 A 113 113 LYS CB C 113 32.754 32.206 0.548 2
1 1357 . 1 1 A 113 113 LYS N N 113 121.725 121.291 0.434 2
1 1358 . 1 1 A 114 114 LYS H H 114 8.225 7.471 0.754 2
1 1359 . 1 1 A 114 114 LYS HA H 114 4.169 4.439 -0.270 2
1 1368 . 1 1 A 114 114 LYS C C 114 176.198 176.273 -0.075 2
1 1369 . 1 1 A 114 114 LYS CA C 114 56.413 55.138 1.275 2
1 1370 . 1 1 A 114 114 LYS CB C 114 32.725 33.125 -0.400 2
1 1374 . 1 1 A 114 114 LYS N N 114 121.857 120.022 1.835 2
1 1375 . 1 1 A 115 115 TRP H H 115 8.078 8.286 -0.208 2
1 1376 . 1 1 A 115 115 TRP HA H 115 4.709 4.744 -0.035 2
1 1385 . 1 1 A 115 115 TRP C C 115 175.119 176.498 -1.379 2
1 1386 . 1 1 A 115 115 TRP CA C 115 56.856 57.239 -0.383 2
1 1387 . 1 1 A 115 115 TRP CB C 115 29.474 28.834 0.640 2
1 1393 . 1 1 A 115 115 TRP N N 115 122.068 123.440 -1.372 2
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