data_16114_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 16114
_Entry.PDB_ID 2KDI
_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 2 . 1 1 1 A 3 3 HIS CB C 3 33.709 27.994 5.715 1
1 3 . 1 1 1 A 7 7 HIS H H 7 8.731 8.876 -0.145 1
1 4 . 1 1 1 A 7 7 HIS HA H 7 4.564 4.877 -0.313 1
1 7 . 1 1 1 A 7 7 HIS CA C 7 53.649 53.806 -0.157 1
1 8 . 1 1 1 A 7 7 HIS CB C 7 26.268 29.280 -3.012 1
1 9 . 1 1 1 A 7 7 HIS N N 7 121.126 118.767 2.359 1
1 10 . 1 1 1 A 8 8 GLY H H 8 8.540 8.758 -0.218 1
1 11 . 1 1 1 A 8 8 GLY HA2 H 8 3.973 3.807 0.166 1
1 12 . 1 1 1 A 8 8 GLY HA3 H 8 3.811 3.818 -0.007 1
1 13 . 1 1 1 A 8 8 GLY CA C 8 42.618 47.417 -4.799 1
1 14 . 1 1 1 A 8 8 GLY N N 8 110.662 109.444 1.218 1
1 15 . 1 1 1 A 9 9 GLU H H 9 8.239 8.827 -0.588 1
1 16 . 1 1 1 A 9 9 GLU HA H 9 4.568 4.251 0.317 1
1 18 . 1 1 1 A 9 9 GLU CA C 9 53.605 57.368 -3.763 1
1 19 . 1 1 1 A 9 9 GLU CB C 9 28.019 29.468 -1.449 1
1 20 . 1 1 1 A 9 9 GLU N N 9 121.669 123.111 -1.442 1
1 21 . 1 1 1 A 10 10 PHE H H 10 8.785 7.670 1.115 1
1 22 . 1 1 1 A 10 10 PHE HA H 10 4.850 5.178 -0.328 1
1 25 . 1 1 1 A 10 10 PHE CA C 10 52.630 56.730 -4.100 1
1 26 . 1 1 1 A 10 10 PHE CB C 10 37.906 41.443 -3.537 1
1 27 . 1 1 1 A 10 10 PHE N N 10 118.401 117.040 1.361 1
1 28 . 1 1 1 A 11 11 GLN H H 11 8.552 8.571 -0.019 1
1 29 . 1 1 1 A 11 11 GLN HA H 11 5.425 5.112 0.313 1
1 34 . 1 1 1 A 11 11 GLN CA C 11 51.663 54.210 -2.547 1
1 35 . 1 1 1 A 11 11 GLN CB C 11 28.427 31.487 -3.060 1
1 37 . 1 1 1 A 11 11 GLN N N 11 117.519 122.190 -4.671 1
1 38 . 1 1 1 A 12 12 ILE H H 12 8.239 8.482 -0.243 1
1 39 . 1 1 1 A 12 12 ILE HA H 12 4.103 5.483 -1.380 1
1 49 . 1 1 1 A 12 12 ILE CA C 12 57.134 59.367 -2.233 1
1 50 . 1 1 1 A 12 12 ILE CB C 12 39.491 42.404 -2.913 1
1 54 . 1 1 1 A 12 12 ILE N N 12 114.043 117.001 -2.958 1
1 55 . 1 1 1 A 13 13 PHE H H 13 8.538 8.356 0.182 1
1 56 . 1 1 1 A 13 13 PHE HA H 13 5.620 5.235 0.385 1
1 59 . 1 1 1 A 13 13 PHE CA C 13 52.438 56.273 -3.835 1
1 60 . 1 1 1 A 13 13 PHE CB C 13 39.253 42.479 -3.226 1
1 61 . 1 1 1 A 13 13 PHE N N 13 117.015 119.559 -2.544 1
1 62 . 1 1 1 A 14 14 ALA H H 14 9.238 9.637 -0.399 1
1 63 . 1 1 1 A 14 14 ALA HA H 14 5.311 5.721 -0.410 1
1 67 . 1 1 1 A 14 14 ALA CA C 14 47.183 50.009 -2.826 1
1 68 . 1 1 1 A 14 14 ALA CB C 14 17.811 22.412 -4.601 1
1 69 . 1 1 1 A 14 14 ALA N N 14 123.503 124.917 -1.414 1
1 70 . 1 1 1 A 15 15 LYS H H 15 8.810 9.080 -0.270 1
1 71 . 1 1 1 A 15 15 LYS HA H 15 5.511 5.308 0.203 1
1 80 . 1 1 1 A 15 15 LYS CA C 15 51.718 54.381 -2.663 1
1 81 . 1 1 1 A 15 15 LYS CB C 15 33.635 35.374 -1.739 1
1 85 . 1 1 1 A 15 15 LYS N N 15 123.382 123.396 -0.014 1
1 86 . 1 1 1 A 16 16 THR H H 16 8.830 8.892 -0.062 1
1 87 . 1 1 1 A 16 16 THR HA H 16 5.212 4.812 0.400 1
1 92 . 1 1 1 A 16 16 THR CA C 16 57.614 61.187 -3.573 1
1 93 . 1 1 1 A 16 16 THR CB C 16 68.210 70.855 -2.645 1
1 95 . 1 1 1 A 16 16 THR N N 16 116.517 116.534 -0.017 1
1 96 . 1 1 1 A 17 17 LEU H H 17 9.428 8.388 1.040 1
1 97 . 1 1 1 A 17 17 LEU HA H 17 4.286 3.996 0.290 1
1 107 . 1 1 1 A 17 17 LEU CA C 17 54.504 58.466 -3.962 1
1 108 . 1 1 1 A 17 17 LEU CB C 17 38.564 41.242 -2.678 1
1 112 . 1 1 1 A 17 17 LEU N N 17 121.786 123.299 -1.513 1
1 113 . 1 1 1 A 18 18 THR H H 18 7.546 7.823 -0.277 1
1 114 . 1 1 1 A 18 18 THR HA H 18 4.391 4.258 0.133 1
1 119 . 1 1 1 A 18 18 THR CA C 18 58.524 63.352 -4.828 1
1 120 . 1 1 1 A 18 18 THR CB C 18 66.166 70.479 -4.313 1
1 122 . 1 1 1 A 18 18 THR N N 18 105.598 108.535 -2.937 1
1 123 . 1 1 1 A 19 19 GLY H H 19 7.683 8.072 -0.389 1
1 124 . 1 1 1 A 19 19 GLY HA2 H 19 3.300 3.969 -0.669 1
1 125 . 1 1 1 A 19 19 GLY HA3 H 19 4.248 3.995 0.253 1
1 126 . 1 1 1 A 19 19 GLY CA C 19 42.947 45.353 -2.406 1
1 127 . 1 1 1 A 19 19 GLY N N 19 109.243 111.302 -2.059 1
1 128 . 1 1 1 A 20 20 LYS H H 20 7.375 8.222 -0.847 1
1 129 . 1 1 1 A 20 20 LYS HA H 20 4.331 4.411 -0.080 1
1 138 . 1 1 1 A 20 20 LYS CA C 20 53.829 55.672 -1.843 1
1 139 . 1 1 1 A 20 20 LYS CB C 20 30.385 33.216 -2.831 1
1 143 . 1 1 1 A 20 20 LYS N N 20 122.757 122.110 0.647 1
1 144 . 1 1 1 A 21 21 THR H H 21 8.637 8.505 0.132 1
1 145 . 1 1 1 A 21 21 THR HA H 21 4.852 4.750 0.102 1
1 150 . 1 1 1 A 21 21 THR CA C 21 59.846 62.567 -2.721 1
1 151 . 1 1 1 A 21 21 THR CB C 21 67.140 69.787 -2.647 1
1 153 . 1 1 1 A 21 21 THR N N 21 121.524 122.995 -1.471 1
1 154 . 1 1 1 A 22 22 ILE H H 22 9.509 9.423 0.086 1
1 155 . 1 1 1 A 22 22 ILE HA H 22 4.349 4.826 -0.477 1
1 165 . 1 1 1 A 22 22 ILE CA C 22 57.634 60.063 -2.429 1
1 166 . 1 1 1 A 22 22 ILE CB C 22 38.334 41.752 -3.418 1
1 170 . 1 1 1 A 22 22 ILE N N 22 129.772 127.246 2.526 1
1 171 . 1 1 1 A 23 23 THR H H 23 8.838 8.659 0.179 1
1 172 . 1 1 1 A 23 23 THR HA H 23 4.653 4.515 0.138 1
1 177 . 1 1 1 A 23 23 THR CA C 23 60.194 61.627 -1.433 1
1 178 . 1 1 1 A 23 23 THR CB C 23 66.577 69.435 -2.858 1
1 180 . 1 1 1 A 23 23 THR N N 23 124.070 123.807 0.263 1
1 181 . 1 1 1 A 24 24 LEU H H 24 8.749 8.438 0.311 1
1 182 . 1 1 1 A 24 24 LEU HA H 24 4.619 5.060 -0.441 1
1 192 . 1 1 1 A 24 24 LEU CA C 24 50.257 52.776 -2.519 1
1 193 . 1 1 1 A 24 24 LEU CB C 24 42.932 45.688 -2.756 1
1 197 . 1 1 1 A 24 24 LEU N N 24 126.499 123.527 2.972 1
1 198 . 1 1 1 A 25 25 GLU H H 25 7.990 8.510 -0.520 1
1 199 . 1 1 1 A 25 25 GLU HA H 25 4.591 4.705 -0.114 1
1 204 . 1 1 1 A 25 25 GLU CA C 25 52.845 56.196 -3.351 1
1 205 . 1 1 1 A 25 25 GLU CB C 25 27.210 30.351 -3.141 1
1 207 . 1 1 1 A 25 25 GLU N N 25 121.644 120.628 1.016 1
1 208 . 1 1 1 A 26 26 VAL H H 26 8.657 8.770 -0.113 1
1 209 . 1 1 1 A 26 26 VAL HA H 26 4.403 5.024 -0.621 1
1 217 . 1 1 1 A 26 26 VAL CA C 26 56.020 59.157 -3.137 1
1 218 . 1 1 1 A 26 26 VAL CB C 26 33.631 35.552 -1.921 1
1 221 . 1 1 1 A 26 26 VAL N N 26 116.647 117.507 -0.860 1
1 222 . 1 1 1 A 27 27 GLU H H 27 7.970 8.640 -0.670 1
1 223 . 1 1 1 A 27 27 GLU HA H 27 4.447 4.642 -0.195 1
1 228 . 1 1 1 A 27 27 GLU CA C 27 51.386 54.788 -3.402 1
1 229 . 1 1 1 A 27 27 GLU CB C 27 30.905 31.785 -0.880 1
1 231 . 1 1 1 A 27 27 GLU N N 27 115.496 121.140 -5.644 1
1 232 . 1 1 1 A 28 28 SER H H 28 9.192 8.822 0.370 1
1 233 . 1 1 1 A 28 28 SER HA H 28 4.108 4.074 0.034 1
1 236 . 1 1 1 A 28 28 SER CA C 28 59.909 61.230 -1.321 1
1 237 . 1 1 1 A 28 28 SER CB C 28 60.399 62.700 -2.301 1
1 238 . 1 1 1 A 28 28 SER N N 28 117.720 118.720 -1.000 1
1 239 . 1 1 1 A 29 29 SER H H 29 7.371 7.703 -0.332 1
1 240 . 1 1 1 A 29 29 SER HA H 29 4.327 4.481 -0.154 1
1 243 . 1 1 1 A 29 29 SER CA C 29 54.805 57.153 -2.348 1
1 244 . 1 1 1 A 29 29 SER CB C 29 60.775 64.213 -3.438 1
1 245 . 1 1 1 A 29 29 SER N N 29 108.936 112.126 -3.190 1
1 246 . 1 1 1 A 30 30 ASP H H 30 7.852 7.537 0.315 1
1 247 . 1 1 1 A 30 30 ASP HA H 30 4.591 4.434 0.157 1
1 250 . 1 1 1 A 30 30 ASP CA C 30 53.040 54.678 -1.638 1
1 251 . 1 1 1 A 30 30 ASP CB C 30 37.942 41.746 -3.804 1
1 252 . 1 1 1 A 30 30 ASP N N 30 123.735 123.416 0.319 1
1 253 . 1 1 1 A 31 31 THR H H 31 7.852 8.308 -0.456 1
1 254 . 1 1 1 A 31 31 THR HA H 31 4.918 4.858 0.060 1
1 259 . 1 1 1 A 31 31 THR CA C 31 56.929 59.980 -3.051 1
1 260 . 1 1 1 A 31 31 THR CB C 31 68.674 71.761 -3.087 1
1 262 . 1 1 1 A 31 31 THR N N 31 109.181 113.477 -4.296 1
1 263 . 1 1 1 A 32 32 ILE H H 32 8.582 8.698 -0.116 1
1 264 . 1 1 1 A 32 32 ILE HA H 32 3.624 3.800 -0.176 1
1 274 . 1 1 1 A 32 32 ILE CA C 32 59.474 65.528 -6.054 1
1 275 . 1 1 1 A 32 32 ILE CB C 32 31.561 37.857 -6.296 1
1 279 . 1 1 1 A 32 32 ILE N N 32 121.833 122.860 -1.027 1
1 280 . 1 1 1 A 33 33 ASP H H 33 9.255 8.488 0.767 1
1 281 . 1 1 1 A 33 33 ASP HA H 33 4.201 4.283 -0.082 1
1 284 . 1 1 1 A 33 33 ASP CA C 33 54.679 57.415 -2.736 1
1 285 . 1 1 1 A 33 33 ASP CB C 33 37.700 40.069 -2.369 1
1 286 . 1 1 1 A 33 33 ASP N N 33 119.823 120.540 -0.717 1
1 287 . 1 1 1 A 34 34 ASN H H 34 8.026 7.387 0.639 1
1 288 . 1 1 1 A 34 34 ASN HA H 34 4.409 4.545 -0.136 1
1 291 . 1 1 1 A 34 34 ASN CA C 34 53.324 56.176 -2.852 1
1 292 . 1 1 1 A 34 34 ASN CB C 34 35.782 38.536 -2.754 1
1 293 . 1 1 1 A 34 34 ASN N N 34 119.540 117.682 1.858 1
1 294 . 1 1 1 A 35 35 VAL H H 35 8.167 8.198 -0.031 1
1 295 . 1 1 1 A 35 35 VAL HA H 35 3.249 3.441 -0.192 1
1 303 . 1 1 1 A 35 35 VAL CA C 35 65.308 67.016 -1.708 1
1 304 . 1 1 1 A 35 35 VAL CB C 35 27.965 31.628 -3.663 1
1 307 . 1 1 1 A 35 35 VAL N N 35 122.223 120.518 1.705 1
1 308 . 1 1 1 A 36 36 LYS H H 36 8.460 8.788 -0.328 1
1 313 . 1 1 1 A 36 36 LYS CB C 36 30.753 32.209 -1.456 1
1 315 . 1 1 1 A 36 36 LYS N N 36 119.438 119.462 -0.024 1
1 316 . 1 1 1 A 37 37 SER H H 37 8.196 8.029 0.167 1
1 317 . 1 1 1 A 37 37 SER HA H 37 4.130 4.060 0.070 1
1 320 . 1 1 1 A 37 37 SER CA C 37 58.528 61.641 -3.113 1
1 321 . 1 1 1 A 37 37 SER CB C 37 59.768 63.010 -3.242 1
1 322 . 1 1 1 A 37 37 SER N N 37 117.791 114.162 3.629 1
1 323 . 1 1 1 A 38 38 LYS H H 38 8.043 7.955 0.088 1
1 324 . 1 1 1 A 38 38 LYS HA H 38 4.095 3.999 0.096 1
1 325 . 1 1 1 A 38 38 LYS CA C 38 57.377 58.975 -1.598 1
1 326 . 1 1 1 A 38 38 LYS N N 38 124.094 120.644 3.450 1
1 327 . 1 1 1 A 39 39 ILE H H 39 8.254 8.294 -0.040 1
1 328 . 1 1 1 A 39 39 ILE HA H 39 3.439 3.837 -0.398 1
1 338 . 1 1 1 A 39 39 ILE CA C 39 63.977 63.060 0.917 1
1 339 . 1 1 1 A 39 39 ILE CB C 39 33.935 37.208 -3.273 1
1 343 . 1 1 1 A 39 39 ILE N N 39 122.107 120.283 1.824 1
1 344 . 1 1 1 A 40 40 GLN H H 40 8.379 8.346 0.033 1
1 345 . 1 1 1 A 40 40 GLN HA H 40 3.746 4.249 -0.503 1
1 350 . 1 1 1 A 40 40 GLN CA C 40 57.472 58.107 -0.635 1
1 351 . 1 1 1 A 40 40 GLN CB C 40 25.072 28.418 -3.346 1
1 353 . 1 1 1 A 40 40 GLN N N 40 123.725 119.484 4.241 1
1 354 . 1 1 1 A 41 41 ASP H H 41 8.210 7.782 0.428 1
1 355 . 1 1 1 A 41 41 ASP HA H 41 4.247 4.385 -0.138 1
1 358 . 1 1 1 A 41 41 ASP CA C 41 54.646 56.227 -1.581 1
1 359 . 1 1 1 A 41 41 ASP CB C 41 38.136 40.861 -2.725 1
1 360 . 1 1 1 A 41 41 ASP N N 41 120.564 120.114 0.450 1
1 361 . 1 1 1 A 42 42 LYS H H 42 7.381 8.050 -0.669 1
1 362 . 1 1 1 A 42 42 LYS HA H 42 4.246 4.280 -0.034 1
1 369 . 1 1 1 A 42 42 LYS CA C 42 55.579 57.686 -2.107 1
1 370 . 1 1 1 A 42 42 LYS CB C 42 31.406 33.477 -2.071 1
1 373 . 1 1 1 A 42 42 LYS N N 42 115.674 116.739 -1.065 1
1 374 . 1 1 1 A 43 43 GLU H H 43 8.537 8.775 -0.238 1
1 375 . 1 1 1 A 43 43 GLU HA H 43 4.522 4.519 0.003 1
1 380 . 1 1 1 A 43 43 GLU CA C 43 52.772 55.584 -2.812 1
1 381 . 1 1 1 A 43 43 GLU CB C 43 30.535 30.993 -0.458 1
1 383 . 1 1 1 A 43 43 GLU N N 43 114.355 116.001 -1.646 1
1 384 . 1 1 1 A 44 44 GLY H H 44 8.611 8.379 0.232 1
1 385 . 1 1 1 A 44 44 GLY HA2 H 44 4.067 3.948 0.119 1
1 386 . 1 1 1 A 44 44 GLY HA3 H 44 3.819 3.949 -0.130 1
1 387 . 1 1 1 A 44 44 GLY CA C 44 43.205 45.297 -2.092 1
1 388 . 1 1 1 A 44 44 GLY N N 44 109.406 108.235 1.171 1
1 389 . 1 1 1 A 45 45 ILE H H 45 6.092 7.864 -1.772 1
1 390 . 1 1 1 A 45 45 ILE HA H 45 4.324 4.075 0.249 1
1 400 . 1 1 1 A 45 45 ILE CA C 45 55.211 60.222 -5.011 1
1 401 . 1 1 1 A 45 45 ILE CB C 45 37.903 38.114 -0.211 1
1 405 . 1 1 1 A 45 45 ILE N N 45 120.791 122.468 -1.677 1
1 406 . 1 1 1 A 46 46 PRO HA H 46 4.547 4.658 -0.111 1
1 413 . 1 1 1 A 46 46 PRO CA C 46 58.971 61.855 -2.884 1
1 414 . 1 1 1 A 46 46 PRO CB C 46 29.142 32.463 -3.321 1
1 417 . 1 1 1 A 47 47 PRO HA H 47 4.062 4.155 -0.093 1
1 424 . 1 1 1 A 47 47 PRO CA C 47 63.476 65.814 -2.338 1
1 425 . 1 1 1 A 47 47 PRO CB C 47 30.113 31.975 -1.862 1
1 428 . 1 1 1 A 48 48 ASP H H 48 8.418 9.085 -0.667 1
1 429 . 1 1 1 A 48 48 ASP HA H 48 4.346 4.414 -0.068 1
1 432 . 1 1 1 A 48 48 ASP CA C 48 52.838 55.715 -2.877 1
1 433 . 1 1 1 A 48 48 ASP CB C 48 36.926 39.325 -2.399 1
1 434 . 1 1 1 A 48 48 ASP N N 48 113.462 116.248 -2.786 1
1 435 . 1 1 1 A 49 49 GLN H H 49 7.822 8.040 -0.218 1
1 436 . 1 1 1 A 49 49 GLN HA H 49 4.283 4.348 -0.065 1
1 439 . 1 1 1 A 49 49 GLN CA C 49 52.770 56.954 -4.184 1
1 441 . 1 1 1 A 49 49 GLN N N 49 117.377 118.056 -0.679 1
1 442 . 1 1 1 A 50 50 GLN H H 50 7.451 7.771 -0.320 1
1 443 . 1 1 1 A 50 50 GLN HA H 50 4.260 4.791 -0.531 1
1 448 . 1 1 1 A 50 50 GLN CA C 50 53.725 55.160 -1.435 1
1 449 . 1 1 1 A 50 50 GLN CB C 50 29.142 30.544 -1.402 1
1 451 . 1 1 1 A 50 50 GLN N N 50 117.526 118.528 -1.002 1
1 452 . 1 1 1 A 51 51 ARG H H 51 8.534 8.566 -0.032 1
1 453 . 1 1 1 A 51 51 ARG HA H 51 4.486 5.085 -0.599 1
1 460 . 1 1 1 A 51 51 ARG CA C 51 52.492 54.181 -1.689 1
1 461 . 1 1 1 A 51 51 ARG CB C 51 29.096 33.865 -4.769 1
1 464 . 1 1 1 A 51 51 ARG N N 51 121.655 123.951 -2.296 1
1 465 . 1 1 1 A 52 52 LEU H H 52 8.683 8.992 -0.309 1
1 466 . 1 1 1 A 52 52 LEU HA H 52 5.255 5.060 0.195 1
1 476 . 1 1 1 A 52 52 LEU CA C 52 50.618 53.799 -3.181 1
1 477 . 1 1 1 A 52 52 LEU CB C 52 43.007 44.240 -1.233 1
1 481 . 1 1 1 A 52 52 LEU N N 52 122.929 125.918 -2.989 1
1 482 . 1 1 1 A 53 53 ILE H H 53 9.286 9.060 0.226 1
1 483 . 1 1 1 A 53 53 ILE HA H 53 5.096 5.130 -0.034 1
1 492 . 1 1 1 A 53 53 ILE CA C 53 56.795 60.159 -3.364 1
1 496 . 1 1 1 A 53 53 ILE N N 53 124.718 125.688 -0.970 1
1 497 . 1 1 1 A 54 54 TRP H H 54 8.871 9.146 -0.275 1
1 499 . 1 1 1 A 54 54 TRP N N 54 127.412 128.323 -0.911 1
1 501 . 1 1 1 A 55 55 ALA H H 55 8.401 8.347 0.054 1
1 502 . 1 1 1 A 55 55 ALA HA H 55 3.183 3.476 -0.293 1
1 506 . 1 1 1 A 55 55 ALA CA C 55 49.712 52.816 -3.104 1
1 507 . 1 1 1 A 55 55 ALA CB C 55 13.252 17.320 -4.068 1
1 508 . 1 1 1 A 55 55 ALA N N 55 128.894 130.044 -1.150 1
1 509 . 1 1 1 A 56 56 GLY H H 56 8.248 8.414 -0.166 1
1 510 . 1 1 1 A 56 56 GLY HA2 H 56 3.968 3.755 0.213 1
1 511 . 1 1 1 A 56 56 GLY HA3 H 56 3.916 3.759 0.157 1
1 512 . 1 1 1 A 56 56 GLY CA C 56 43.142 45.546 -2.404 1
1 513 . 1 1 1 A 56 56 GLY N N 56 101.499 102.537 -1.038 1
1 514 . 1 1 1 A 57 57 LYS H H 57 8.028 7.525 0.503 1
1 515 . 1 1 1 A 57 57 LYS HA H 57 4.609 4.710 -0.101 1
1 522 . 1 1 1 A 57 57 LYS CA C 57 51.928 54.548 -2.620 1
1 523 . 1 1 1 A 57 57 LYS CB C 57 32.613 35.083 -2.470 1
1 526 . 1 1 1 A 57 57 LYS N N 57 118.995 121.405 -2.410 1
1 527 . 1 1 1 A 58 58 GLN H H 58 8.607 8.372 0.235 1
1 528 . 1 1 1 A 58 58 GLN HA H 58 4.617 4.676 -0.059 1
1 533 . 1 1 1 A 58 58 GLN CA C 58 53.261 55.948 -2.687 1
1 534 . 1 1 1 A 58 58 GLN CB C 58 26.613 29.318 -2.705 1
1 536 . 1 1 1 A 58 58 GLN N N 58 119.825 124.919 -5.094 1
1 537 . 1 1 1 A 59 59 LEU H H 59 8.653 8.851 -0.198 1
1 538 . 1 1 1 A 59 59 LEU HA H 59 4.138 4.388 -0.250 1
1 548 . 1 1 1 A 59 59 LEU CA C 59 51.991 55.061 -3.070 1
1 549 . 1 1 1 A 59 59 LEU CB C 59 39.006 42.122 -3.116 1
1 553 . 1 1 1 A 59 59 LEU N N 59 125.484 125.244 0.240 1
1 554 . 1 1 1 A 60 60 GLU H H 60 8.461 8.834 -0.373 1
1 555 . 1 1 1 A 60 60 GLU HA H 60 4.371 4.365 0.006 1
1 559 . 1 1 1 A 60 60 GLU CA C 60 53.436 56.404 -2.968 1
1 560 . 1 1 1 A 60 60 GLU CB C 60 29.057 30.581 -1.524 1
1 562 . 1 1 1 A 60 60 GLU N N 60 123.237 123.840 -0.603 1
1 563 . 1 1 1 A 61 61 ASP H H 61 8.076 8.649 -0.573 1
1 564 . 1 1 1 A 61 61 ASP HA H 61 4.265 4.276 -0.011 1
1 567 . 1 1 1 A 61 61 ASP CA C 61 54.398 56.632 -2.234 1
1 568 . 1 1 1 A 61 61 ASP CB C 61 38.340 40.462 -2.122 1
1 569 . 1 1 1 A 61 61 ASP N N 61 120.701 123.018 -2.317 1
1 570 . 1 1 1 A 62 62 GLY HA2 H 62 4.104 3.963 0.141 1
1 571 . 1 1 1 A 62 62 GLY HA3 H 62 3.832 3.966 -0.134 1
1 572 . 1 1 1 A 62 62 GLY CA C 62 42.576 45.279 -2.703 1
1 573 . 1 1 1 A 63 63 ARG H H 63 7.319 8.653 -1.334 1
1 574 . 1 1 1 A 63 63 ARG HA H 63 4.595 4.559 0.036 1
1 579 . 1 1 1 A 63 63 ARG CA C 63 51.971 55.416 -3.445 1
1 582 . 1 1 1 A 63 63 ARG N N 63 119.206 120.302 -1.096 1
1 583 . 1 1 1 A 64 64 THR H H 64 8.735 8.608 0.127 1
1 584 . 1 1 1 A 64 64 THR HA H 64 5.208 4.953 0.255 1
1 589 . 1 1 1 A 64 64 THR CA C 64 57.126 59.562 -2.436 1
1 590 . 1 1 1 A 64 64 THR CB C 64 69.885 71.828 -1.943 1
1 592 . 1 1 1 A 64 64 THR N N 64 108.713 111.796 -3.083 1
1 593 . 1 1 1 A 65 65 LEU H H 65 8.241 9.073 -0.832 1
1 594 . 1 1 1 A 65 65 LEU HA H 65 4.003 3.890 0.113 1
1 604 . 1 1 1 A 65 65 LEU CA C 65 56.409 57.753 -1.344 1
1 605 . 1 1 1 A 65 65 LEU CB C 65 37.179 41.523 -4.344 1
1 609 . 1 1 1 A 65 65 LEU N N 65 118.111 122.700 -4.589 1
1 610 . 1 1 1 A 66 66 SER H H 66 8.296 8.181 0.115 1
1 611 . 1 1 1 A 66 66 SER HA H 66 4.201 4.239 -0.038 1
1 614 . 1 1 1 A 66 66 SER CA C 66 58.454 60.480 -2.026 1
1 615 . 1 1 1 A 66 66 SER CB C 66 59.969 62.712 -2.743 1
1 616 . 1 1 1 A 66 66 SER N N 66 113.148 113.453 -0.305 1
1 617 . 1 1 1 A 67 67 ASP H H 67 7.984 8.178 -0.194 1
1 618 . 1 1 1 A 67 67 ASP HA H 67 4.187 4.299 -0.112 1
1 621 . 1 1 1 A 67 67 ASP CA C 67 54.744 57.087 -2.343 1
1 622 . 1 1 1 A 67 67 ASP CB C 67 37.794 41.290 -3.496 1
1 623 . 1 1 1 A 67 67 ASP N N 67 124.130 123.251 0.879 1
1 624 . 1 1 1 A 68 68 TYR H H 68 7.177 7.792 -0.615 1
1 625 . 1 1 1 A 68 68 TYR N N 68 115.334 120.920 -5.586 1
1 626 . 1 1 1 A 69 69 ASN H H 69 8.111 8.156 -0.045 1
1 627 . 1 1 1 A 69 69 ASN HA H 69 4.253 4.325 -0.072 1
1 630 . 1 1 1 A 69 69 ASN CA C 69 51.386 54.329 -2.943 1
1 631 . 1 1 1 A 69 69 ASN CB C 69 34.867 37.659 -2.792 1
1 632 . 1 1 1 A 69 69 ASN N N 69 116.867 117.994 -1.127 1
1 633 . 1 1 1 A 70 70 ILE H H 70 7.460 7.611 -0.151 1
1 634 . 1 1 1 A 70 70 ILE HA H 70 3.210 3.923 -0.713 1
1 644 . 1 1 1 A 70 70 ILE CA C 70 60.157 62.047 -1.890 1
1 645 . 1 1 1 A 70 70 ILE CB C 70 34.754 37.382 -2.628 1
1 649 . 1 1 1 A 70 70 ILE N N 70 119.821 120.023 -0.202 1
1 650 . 1 1 1 A 71 71 GLN H H 71 7.368 8.581 -1.213 1
1 651 . 1 1 1 A 71 71 GLN HA H 71 4.099 4.331 -0.232 1
1 656 . 1 1 1 A 71 71 GLN CA C 71 50.906 54.655 -3.749 1
1 657 . 1 1 1 A 71 71 GLN CB C 71 28.793 30.110 -1.317 1
1 659 . 1 1 1 A 71 71 GLN N N 71 124.287 128.016 -3.729 1
1 660 . 1 1 1 A 72 72 ARG H H 72 7.583 8.580 -0.997 1
1 661 . 1 1 1 A 72 72 ARG HA H 72 3.907 4.438 -0.531 1
1 668 . 1 1 1 A 72 72 ARG CA C 72 54.527 57.957 -3.430 1
1 669 . 1 1 1 A 72 72 ARG CB C 72 27.470 31.489 -4.019 1
1 672 . 1 1 1 A 72 72 ARG N N 72 119.007 120.929 -1.922 1
1 673 . 1 1 1 A 73 73 GLU H H 73 9.262 7.785 1.477 1
1 674 . 1 1 1 A 73 73 GLU HA H 73 3.586 4.551 -0.965 1
1 679 . 1 1 1 A 73 73 GLU CA C 73 55.703 56.097 -0.394 1
1 680 . 1 1 1 A 73 73 GLU CB C 73 23.669 27.989 -4.320 1
1 682 . 1 1 1 A 73 73 GLU N N 73 115.180 118.477 -3.297 1
1 683 . 1 1 1 A 74 74 SER H H 74 7.551 8.009 -0.458 1
1 684 . 1 1 1 A 74 74 SER HA H 74 4.613 5.479 -0.866 1
1 687 . 1 1 1 A 74 74 SER CA C 74 58.305 55.955 2.350 1
1 688 . 1 1 1 A 74 74 SER CB C 74 62.156 66.106 -3.950 1
1 689 . 1 1 1 A 74 74 SER N N 74 115.104 114.117 0.987 1
1 690 . 1 1 1 A 75 75 THR H H 75 8.785 9.014 -0.229 1
1 691 . 1 1 1 A 75 75 THR HA H 75 5.014 5.093 -0.079 1
1 696 . 1 1 1 A 75 75 THR CA C 75 59.835 62.368 -2.533 1
1 697 . 1 1 1 A 75 75 THR CB C 75 67.258 69.113 -1.855 1
1 699 . 1 1 1 A 75 75 THR N N 75 118.401 119.030 -0.629 1
1 700 . 1 1 1 A 76 76 LEU H H 76 9.447 9.921 -0.474 1
1 701 . 1 1 1 A 76 76 LEU HA H 76 4.930 4.765 0.165 1
1 711 . 1 1 1 A 76 76 LEU CA C 76 51.107 54.513 -3.406 1
1 712 . 1 1 1 A 76 76 LEU CB C 76 40.841 40.967 -0.126 1
1 716 . 1 1 1 A 76 76 LEU N N 76 127.905 128.426 -0.521 1
1 717 . 1 1 1 A 77 77 HIS HA H 77 4.976 4.878 0.098 1
1 720 . 1 1 1 A 77 77 HIS CA C 77 53.776 57.201 -3.425 1
1 721 . 1 1 1 A 77 77 HIS CB C 77 28.438 29.357 -0.919 1
1 722 . 1 1 1 A 78 78 LEU H H 78 8.450 8.877 -0.427 1
1 723 . 1 1 1 A 78 78 LEU HA H 78 5.085 5.057 0.028 1
1 733 . 1 1 1 A 78 78 LEU CA C 78 50.896 53.583 -2.687 1
1 734 . 1 1 1 A 78 78 LEU CB C 78 41.916 45.169 -3.253 1
1 738 . 1 1 1 A 78 78 LEU N N 78 126.178 127.379 -1.201 1
1 739 . 1 1 1 A 79 79 VAL H H 79 9.093 8.963 0.130 1
1 740 . 1 1 1 A 79 79 VAL HA H 79 4.053 4.900 -0.847 1
1 748 . 1 1 1 A 79 79 VAL CA C 79 59.054 60.214 -1.160 1
1 749 . 1 1 1 A 79 79 VAL CB C 79 32.115 34.511 -2.396 1
1 752 . 1 1 1 A 79 79 VAL N N 79 128.372 120.856 7.516 1
1 753 . 1 1 1 A 80 80 LEU H H 80 8.000 8.934 -0.934 1
1 754 . 1 1 1 A 80 80 LEU HA H 80 5.105 4.447 0.658 1
1 764 . 1 1 1 A 80 80 LEU CA C 80 50.556 54.203 -3.647 1
1 765 . 1 1 1 A 80 80 LEU CB C 80 39.597 41.447 -1.850 1
1 769 . 1 1 1 A 80 80 LEU N N 80 126.145 127.985 -1.840 1
1 770 . 1 1 1 A 81 81 ARG H H 81 8.470 8.250 0.220 1
1 771 . 1 1 1 A 81 81 ARG HA H 81 4.197 4.486 -0.289 1
1 778 . 1 1 1 A 81 81 ARG CA C 81 53.133 56.420 -3.287 1
1 779 . 1 1 1 A 81 81 ARG CB C 81 28.413 31.628 -3.215 1
1 782 . 1 1 1 A 81 81 ARG N N 81 121.625 125.005 -3.380 1
1 783 . 1 1 1 A 82 82 LEU H H 82 8.454 8.362 0.092 1
1 784 . 1 1 1 A 82 82 LEU HA H 82 4.339 4.707 -0.368 1
1 794 . 1 1 1 A 82 82 LEU CA C 82 52.081 54.324 -2.243 1
1 795 . 1 1 1 A 82 82 LEU CB C 82 39.810 44.096 -4.286 1
1 799 . 1 1 1 A 82 82 LEU N N 82 123.832 122.541 1.291 1
1 800 . 1 1 1 A 83 83 ARG H H 83 8.404 8.607 -0.203 1
1 801 . 1 1 1 A 83 83 ARG HA H 83 4.308 4.532 -0.224 1
1 808 . 1 1 1 A 83 83 ARG CA C 83 53.258 57.777 -4.519 1
1 809 . 1 1 1 A 83 83 ARG CB C 83 28.160 30.739 -2.579 1
1 812 . 1 1 1 A 83 83 ARG N N 83 121.447 125.432 -3.985 1
1 813 . 1 1 1 A 84 84 GLY H H 84 8.410 7.748 0.662 1
1 814 . 1 1 1 A 84 84 GLY HA2 H 84 3.929 4.059 -0.130 1
1 815 . 1 1 1 A 84 84 GLY HA3 H 84 3.929 4.059 -0.130 1
1 816 . 1 1 1 A 84 84 GLY CA C 84 42.751 44.863 -2.112 1
1 817 . 1 1 1 A 84 84 GLY N N 84 110.030 108.339 1.691 1
1 818 . 1 1 1 A 85 85 GLY H H 85 8.295 8.473 -0.178 1
1 819 . 1 1 1 A 85 85 GLY HA2 H 85 3.950 4.039 -0.089 1
1 820 . 1 1 1 A 85 85 GLY HA3 H 85 3.950 4.040 -0.090 1
1 821 . 1 1 1 A 85 85 GLY CA C 85 42.831 45.821 -2.990 1
1 822 . 1 1 1 A 85 85 GLY N N 85 108.838 108.991 -0.153 1
1 823 . 1 1 1 A 86 86 SER H H 86 8.292 8.502 -0.210 1
1 824 . 1 1 1 A 86 86 SER HA H 86 4.405 4.353 0.052 1
1 827 . 1 1 1 A 86 86 SER CA C 86 55.965 59.657 -3.692 1
1 828 . 1 1 1 A 86 86 SER CB C 86 61.232 63.958 -2.726 1
1 829 . 1 1 1 A 86 86 SER N N 86 116.028 119.324 -3.296 1
1 830 . 1 1 1 A 87 87 MET H H 87 8.470 8.712 -0.242 1
1 831 . 1 1 1 A 87 87 MET HA H 87 4.447 4.060 0.387 1
1 836 . 1 1 1 A 87 87 MET CA C 87 53.281 57.552 -4.271 1
1 837 . 1 1 1 A 87 87 MET CB C 87 29.788 33.608 -3.820 1
1 839 . 1 1 1 A 87 87 MET N N 87 121.625 126.921 -5.296 1
1 840 . 1 1 1 A 88 88 GLY H H 88 8.320 8.596 -0.276 1
1 841 . 1 1 1 A 88 88 GLY HA2 H 88 3.919 3.936 -0.017 1
1 842 . 1 1 1 A 88 88 GLY HA3 H 88 3.896 3.936 -0.040 1
1 843 . 1 1 1 A 88 88 GLY CA C 88 43.060 46.708 -3.648 1
1 844 . 1 1 1 A 88 88 GLY N N 88 109.625 108.217 1.408 1
1 845 . 1 1 1 A 89 89 GLY H H 89 8.256 7.744 0.512 1
1 846 . 1 1 1 A 89 89 GLY HA2 H 89 3.940 4.109 -0.169 1
1 847 . 1 1 1 A 89 89 GLY HA3 H 89 3.910 4.109 -0.199 1
1 848 . 1 1 1 A 89 89 GLY CA C 89 42.678 44.402 -1.724 1
1 849 . 1 1 1 A 89 89 GLY N N 89 108.982 107.504 1.478 1
1 850 . 1 1 1 A 90 90 ALA H H 90 8.203 8.588 -0.385 1
1 851 . 1 1 1 A 90 90 ALA HA H 90 4.255 4.119 0.136 1
1 855 . 1 1 1 A 90 90 ALA CA C 90 50.763 54.631 -3.868 1
1 856 . 1 1 1 A 90 90 ALA CB C 90 16.364 19.073 -2.709 1
1 857 . 1 1 1 A 90 90 ALA N N 90 124.065 122.170 1.895 1
1 858 . 1 1 1 A 91 91 ALA H H 91 8.273 7.845 0.428 1
1 859 . 1 1 1 A 91 91 ALA HA H 91 4.204 4.643 -0.439 1
1 863 . 1 1 1 A 91 91 ALA CA C 91 51.080 50.452 0.628 1
1 864 . 1 1 1 A 91 91 ALA CB C 91 16.036 20.992 -4.956 1
1 865 . 1 1 1 A 91 91 ALA N N 91 121.985 119.789 2.196 1
1 866 . 1 1 1 A 92 92 ASP H H 92 8.022 9.286 -1.264 1
1 867 . 1 1 1 A 92 92 ASP HA H 92 4.455 4.850 -0.395 1
1 870 . 1 1 1 A 92 92 ASP CA C 92 52.664 54.934 -2.270 1
1 871 . 1 1 1 A 92 92 ASP CB C 92 37.925 42.767 -4.842 1
1 872 . 1 1 1 A 92 92 ASP N N 92 118.621 122.709 -4.088 1
1 873 . 1 1 1 A 93 93 GLU H H 93 8.282 8.191 0.091 1
1 874 . 1 1 1 A 93 93 GLU HA H 93 3.912 4.683 -0.771 1
1 879 . 1 1 1 A 93 93 GLU CA C 93 56.947 57.983 -1.036 1
1 880 . 1 1 1 A 93 93 GLU CB C 93 27.413 32.590 -5.177 1
1 882 . 1 1 1 A 93 93 GLU N N 93 122.247 116.381 5.866 1
1 883 . 1 1 1 A 94 94 GLU H H 94 8.194 8.144 0.050 1
1 884 . 1 1 1 A 94 94 GLU HA H 94 3.940 4.472 -0.532 1
1 889 . 1 1 1 A 94 94 GLU CA C 94 56.681 58.557 -1.876 1
1 890 . 1 1 1 A 94 94 GLU CB C 94 26.127 30.824 -4.697 1
1 892 . 1 1 1 A 94 94 GLU N N 94 118.024 118.279 -0.255 1
1 893 . 1 1 1 A 95 95 GLU H H 95 7.816 8.292 -0.476 1
1 894 . 1 1 1 A 95 95 GLU HA H 95 4.121 4.174 -0.053 1
1 898 . 1 1 1 A 95 95 GLU CA C 95 56.162 58.587 -2.425 1
1 899 . 1 1 1 A 95 95 GLU CB C 95 26.403 28.141 -1.738 1
1 901 . 1 1 1 A 95 95 GLU N N 95 120.028 118.939 1.089 1
1 902 . 1 1 1 A 96 96 LEU H H 96 7.637 7.724 -0.087 1
1 903 . 1 1 1 A 96 96 LEU HA H 96 3.988 4.098 -0.110 1
1 913 . 1 1 1 A 96 96 LEU CA C 96 55.303 56.702 -1.399 1
1 914 . 1 1 1 A 96 96 LEU CB C 96 39.038 41.308 -2.270 1
1 918 . 1 1 1 A 96 96 LEU N N 96 119.866 118.313 1.553 1
1 919 . 1 1 1 A 97 97 ILE H H 97 8.044 7.557 0.487 1
1 920 . 1 1 1 A 97 97 ILE HA H 97 3.478 3.957 -0.479 1
1 930 . 1 1 1 A 97 97 ILE CA C 97 62.054 64.108 -2.054 1
1 931 . 1 1 1 A 97 97 ILE CB C 97 34.541 38.037 -3.496 1
1 935 . 1 1 1 A 97 97 ILE N N 97 119.088 119.749 -0.661 1
1 936 . 1 1 1 A 98 98 ARG H H 98 7.991 8.349 -0.358 1
1 937 . 1 1 1 A 98 98 ARG HA H 98 3.793 4.061 -0.268 1
1 944 . 1 1 1 A 98 98 ARG CA C 98 57.509 58.833 -1.324 1
1 945 . 1 1 1 A 98 98 ARG CB C 98 27.191 30.032 -2.841 1
1 948 . 1 1 1 A 98 98 ARG N N 98 119.225 120.647 -1.422 1
1 949 . 1 1 1 A 99 99 LYS H H 99 8.101 7.650 0.451 1
1 950 . 1 1 1 A 99 99 LYS HA H 99 3.968 4.076 -0.108 1
1 959 . 1 1 1 A 99 99 LYS CA C 99 56.455 59.190 -2.735 1
1 960 . 1 1 1 A 99 99 LYS CB C 99 29.531 32.164 -2.633 1
1 964 . 1 1 1 A 99 99 LYS N N 99 119.464 118.506 0.958 1
1 965 . 1 1 1 A 100 100 ALA H H 100 8.167 8.025 0.142 1
1 966 . 1 1 1 A 100 100 ALA HA H 100 3.789 4.206 -0.417 1
1 970 . 1 1 1 A 100 100 ALA CA C 100 52.451 54.290 -1.839 1
1 971 . 1 1 1 A 100 100 ALA CB C 100 16.259 18.337 -2.078 1
1 972 . 1 1 1 A 100 100 ALA N N 100 122.398 120.981 1.417 1
1 973 . 1 1 1 A 101 101 ILE H H 101 8.777 7.283 1.494 1
1 974 . 1 1 1 A 101 101 ILE HA H 101 3.191 3.846 -0.655 1
1 984 . 1 1 1 A 101 101 ILE CA C 101 62.910 63.598 -0.688 1
1 985 . 1 1 1 A 101 101 ILE CB C 101 34.544 38.021 -3.477 1
1 989 . 1 1 1 A 101 101 ILE N N 101 120.431 115.910 4.521 1
1 990 . 1 1 1 A 102 102 GLU H H 102 7.890 7.788 0.102 1
1 991 . 1 1 1 A 102 102 GLU HA H 102 3.848 4.192 -0.344 1
1 996 . 1 1 1 A 102 102 GLU CA C 102 57.079 57.709 -0.630 1
1 997 . 1 1 1 A 102 102 GLU CB C 102 26.769 30.147 -3.378 1
1 999 . 1 1 1 A 102 102 GLU N N 102 120.248 120.160 0.088 1
1 1000 . 1 1 1 A 103 103 LEU H H 103 8.194 7.691 0.503 1
1 1001 . 1 1 1 A 103 103 LEU HA H 103 3.912 4.313 -0.401 1
1 1011 . 1 1 1 A 103 103 LEU CA C 103 55.078 56.227 -1.149 1
1 1012 . 1 1 1 A 103 103 LEU CB C 103 38.963 42.585 -3.622 1
1 1016 . 1 1 1 A 103 103 LEU N N 103 120.341 117.109 3.232 1
1 1017 . 1 1 1 A 104 104 SER H H 104 8.268 7.910 0.358 1
1 1018 . 1 1 1 A 104 104 SER HA H 104 4.120 4.380 -0.260 1
1 1021 . 1 1 1 A 104 104 SER CA C 104 58.301 59.236 -0.935 1
1 1022 . 1 1 1 A 104 104 SER CB C 104 60.193 63.961 -3.768 1
1 1023 . 1 1 1 A 104 104 SER N N 104 115.150 116.376 -1.226 1
1 1024 . 1 1 1 A 105 105 LEU H H 105 7.501 7.542 -0.041 1
1 1025 . 1 1 1 A 105 105 LEU HA H 105 4.041 4.007 0.034 1
1 1035 . 1 1 1 A 105 105 LEU CA C 105 53.995 56.450 -2.455 1
1 1036 . 1 1 1 A 105 105 LEU CB C 105 39.597 41.818 -2.221 1
1 1040 . 1 1 1 A 105 105 LEU N N 105 124.223 119.596 4.627 1
1 1041 . 1 1 1 A 106 106 LYS H H 106 7.542 7.969 -0.427 1
1 1042 . 1 1 1 A 106 106 LYS HA H 106 4.090 4.021 0.069 1
1 1050 . 1 1 1 A 106 106 LYS CA C 106 55.495 58.891 -3.396 1
1 1051 . 1 1 1 A 106 106 LYS CB C 106 29.941 31.671 -1.730 1
1 1055 . 1 1 1 A 106 106 LYS N N 106 120.328 117.644 2.684 1
1 1056 . 1 1 1 A 107 107 GLU H H 107 7.884 8.366 -0.482 1
1 1057 . 1 1 1 A 107 107 GLU HA H 107 4.210 4.036 0.174 1
1 1060 . 1 1 1 A 107 107 GLU CA C 107 54.509 59.594 -5.085 1
1 1061 . 1 1 1 A 107 107 GLU CB C 107 27.239 29.328 -2.089 1
1 1062 . 1 1 1 A 107 107 GLU N N 107 118.621 120.188 -1.567 1
1 1063 . 1 1 1 A 108 108 SER H H 108 7.923 8.746 -0.823 1
1 1064 . 1 1 1 A 108 108 SER HA H 108 4.385 4.110 0.275 1
1 1067 . 1 1 1 A 108 108 SER CA C 108 56.442 61.212 -4.770 1
1 1068 . 1 1 1 A 108 108 SER CB C 108 60.953 62.159 -1.206 1
1 1069 . 1 1 1 A 108 108 SER N N 108 115.670 115.923 -0.253 1
1 1070 . 1 1 1 A 109 109 ARG H H 109 8.068 7.716 0.352 1
1 1071 . 1 1 1 A 109 109 ARG HA H 109 4.307 4.062 0.245 1
1 1078 . 1 1 1 A 109 109 ARG CA C 109 53.732 58.858 -5.126 1
1 1079 . 1 1 1 A 109 109 ARG CB C 109 27.968 29.326 -1.358 1
1 1082 . 1 1 1 A 109 109 ARG N N 109 122.313 121.943 0.370 1
1 1083 . 1 1 1 A 110 110 ASN H H 110 8.292 8.357 -0.065 1
1 1084 . 1 1 1 A 110 110 ASN HA H 110 4.720 4.568 0.152 1
1 1087 . 1 1 1 A 110 110 ASN CA C 110 50.750 55.682 -4.932 1
1 1088 . 1 1 1 A 110 110 ASN CB C 110 36.197 39.057 -2.860 1
1 1089 . 1 1 1 A 110 110 ASN N N 110 119.304 118.819 0.485 1
1 1090 . 1 1 1 A 111 111 SER H H 111 8.244 8.109 0.135 1
1 1091 . 1 1 1 A 111 111 SER HA H 111 4.423 4.177 0.246 1
1 1094 . 1 1 1 A 111 111 SER CA C 111 55.990 60.789 -4.799 1
1 1095 . 1 1 1 A 111 111 SER CB C 111 61.027 62.798 -1.771 1
1 1096 . 1 1 1 A 111 111 SER N N 111 116.119 114.451 1.668 1
1 1097 . 1 1 1 A 112 112 GLY H H 112 8.327 8.284 0.043 1
1 1098 . 1 1 1 A 112 112 GLY HA2 H 112 3.944 3.946 -0.002 1
1 1099 . 1 1 1 A 112 112 GLY HA3 H 112 3.912 3.951 -0.039 1
1 1100 . 1 1 1 A 112 112 GLY CA C 112 42.733 46.392 -3.659 1
1 1101 . 1 1 1 A 112 112 GLY N N 112 110.442 110.303 0.139 1
1 1102 . 1 1 1 A 113 113 GLY H H 113 8.097 8.253 -0.156 1
1 1103 . 1 1 1 A 113 113 GLY HA2 H 113 3.831 3.896 -0.065 1
1 1104 . 1 1 1 A 113 113 GLY HA3 H 113 3.785 3.908 -0.123 1
1 1105 . 1 1 1 A 113 113 GLY CA C 113 42.435 46.632 -4.197 1
1 1106 . 1 1 1 A 113 113 GLY N N 113 108.745 109.423 -0.678 1
1 2 . 2 1 1 A 3 3 HIS CB C 3 33.709 28.284 5.425 1
1 3 . 2 1 1 A 7 7 HIS H H 7 8.731 7.689 1.042 1
1 4 . 2 1 1 A 7 7 HIS HA H 7 4.564 5.257 -0.693 1
1 7 . 2 1 1 A 7 7 HIS CA C 7 53.649 53.975 -0.326 1
1 8 . 2 1 1 A 7 7 HIS CB C 7 26.268 33.007 -6.739 1
1 9 . 2 1 1 A 7 7 HIS N N 7 121.126 114.024 7.102 1
1 10 . 2 1 1 A 8 8 GLY H H 8 8.540 8.497 0.043 1
1 11 . 2 1 1 A 8 8 GLY HA2 H 8 3.973 4.107 -0.134 1
1 12 . 2 1 1 A 8 8 GLY HA3 H 8 3.811 4.183 -0.372 1
1 13 . 2 1 1 A 8 8 GLY CA C 8 42.618 45.811 -3.193 1
1 14 . 2 1 1 A 8 8 GLY N N 8 110.662 105.967 4.695 1
1 15 . 2 1 1 A 9 9 GLU H H 9 8.239 8.868 -0.629 1
1 16 . 2 1 1 A 9 9 GLU HA H 9 4.568 4.329 0.239 1
1 18 . 2 1 1 A 9 9 GLU CA C 9 53.605 54.129 -0.524 1
1 19 . 2 1 1 A 9 9 GLU CB C 9 28.019 31.861 -3.842 1
1 20 . 2 1 1 A 9 9 GLU N N 9 121.669 121.576 0.093 1
1 21 . 2 1 1 A 10 10 PHE H H 10 8.785 7.911 0.874 1
1 22 . 2 1 1 A 10 10 PHE HA H 10 4.850 5.216 -0.366 1
1 25 . 2 1 1 A 10 10 PHE CA C 10 52.630 56.155 -3.525 1
1 26 . 2 1 1 A 10 10 PHE CB C 10 37.906 41.903 -3.997 1
1 27 . 2 1 1 A 10 10 PHE N N 10 118.401 117.854 0.547 1
1 28 . 2 1 1 A 11 11 GLN H H 11 8.552 9.118 -0.566 1
1 29 . 2 1 1 A 11 11 GLN HA H 11 5.425 5.140 0.285 1
1 34 . 2 1 1 A 11 11 GLN CA C 11 51.663 54.471 -2.808 1
1 35 . 2 1 1 A 11 11 GLN CB C 11 28.427 30.479 -2.052 1
1 37 . 2 1 1 A 11 11 GLN N N 11 117.519 122.481 -4.962 1
1 38 . 2 1 1 A 12 12 ILE H H 12 8.239 8.133 0.106 1
1 39 . 2 1 1 A 12 12 ILE HA H 12 4.103 4.787 -0.684 1
1 49 . 2 1 1 A 12 12 ILE CA C 12 57.134 60.203 -3.069 1
1 50 . 2 1 1 A 12 12 ILE CB C 12 39.491 39.782 -0.291 1
1 54 . 2 1 1 A 12 12 ILE N N 12 114.043 121.894 -7.851 1
1 55 . 2 1 1 A 13 13 PHE H H 13 8.538 8.719 -0.181 1
1 56 . 2 1 1 A 13 13 PHE HA H 13 5.620 5.302 0.318 1
1 59 . 2 1 1 A 13 13 PHE CA C 13 52.438 56.483 -4.045 1
1 60 . 2 1 1 A 13 13 PHE CB C 13 39.253 42.890 -3.637 1
1 61 . 2 1 1 A 13 13 PHE N N 13 117.015 119.743 -2.728 1
1 62 . 2 1 1 A 14 14 ALA H H 14 9.238 9.423 -0.185 1
1 63 . 2 1 1 A 14 14 ALA HA H 14 5.311 5.676 -0.365 1
1 67 . 2 1 1 A 14 14 ALA CA C 14 47.183 50.225 -3.042 1
1 68 . 2 1 1 A 14 14 ALA CB C 14 17.811 23.408 -5.597 1
1 69 . 2 1 1 A 14 14 ALA N N 14 123.503 122.569 0.934 1
1 70 . 2 1 1 A 15 15 LYS H H 15 8.810 9.205 -0.395 1
1 71 . 2 1 1 A 15 15 LYS HA H 15 5.511 5.321 0.190 1
1 80 . 2 1 1 A 15 15 LYS CA C 15 51.718 54.627 -2.909 1
1 81 . 2 1 1 A 15 15 LYS CB C 15 33.635 35.626 -1.991 1
1 85 . 2 1 1 A 15 15 LYS N N 15 123.382 122.214 1.168 1
1 86 . 2 1 1 A 16 16 THR H H 16 8.830 8.574 0.256 1
1 87 . 2 1 1 A 16 16 THR HA H 16 5.212 4.922 0.290 1
1 92 . 2 1 1 A 16 16 THR CA C 16 57.614 61.053 -3.439 1
1 93 . 2 1 1 A 16 16 THR CB C 16 68.210 71.088 -2.878 1
1 95 . 2 1 1 A 16 16 THR N N 16 116.517 115.996 0.521 1
1 96 . 2 1 1 A 17 17 LEU H H 17 9.428 8.844 0.584 1
1 97 . 2 1 1 A 17 17 LEU HA H 17 4.286 4.143 0.143 1
1 107 . 2 1 1 A 17 17 LEU CA C 17 54.504 58.472 -3.968 1
1 108 . 2 1 1 A 17 17 LEU CB C 17 38.564 41.356 -2.792 1
1 112 . 2 1 1 A 17 17 LEU N N 17 121.786 123.405 -1.619 1
1 113 . 2 1 1 A 18 18 THR H H 18 7.546 7.904 -0.358 1
1 114 . 2 1 1 A 18 18 THR HA H 18 4.391 4.258 0.133 1
1 119 . 2 1 1 A 18 18 THR CA C 18 58.524 63.458 -4.934 1
1 120 . 2 1 1 A 18 18 THR CB C 18 66.166 70.416 -4.250 1
1 122 . 2 1 1 A 18 18 THR N N 18 105.598 108.961 -3.363 1
1 123 . 2 1 1 A 19 19 GLY H H 19 7.683 7.882 -0.199 1
1 124 . 2 1 1 A 19 19 GLY HA2 H 19 3.300 3.997 -0.697 1
1 125 . 2 1 1 A 19 19 GLY HA3 H 19 4.248 4.009 0.239 1
1 126 . 2 1 1 A 19 19 GLY CA C 19 42.947 45.863 -2.916 1
1 127 . 2 1 1 A 19 19 GLY N N 19 109.243 111.930 -2.687 1
1 128 . 2 1 1 A 20 20 LYS H H 20 7.375 7.823 -0.448 1
1 129 . 2 1 1 A 20 20 LYS HA H 20 4.331 4.581 -0.250 1
1 138 . 2 1 1 A 20 20 LYS CA C 20 53.829 55.269 -1.440 1
1 139 . 2 1 1 A 20 20 LYS CB C 20 30.385 33.937 -3.552 1
1 143 . 2 1 1 A 20 20 LYS N N 20 122.757 120.442 2.315 1
1 144 . 2 1 1 A 21 21 THR H H 21 8.637 8.727 -0.090 1
1 145 . 2 1 1 A 21 21 THR HA H 21 4.852 4.599 0.253 1
1 150 . 2 1 1 A 21 21 THR CA C 21 59.846 62.556 -2.710 1
1 151 . 2 1 1 A 21 21 THR CB C 21 67.140 69.154 -2.014 1
1 153 . 2 1 1 A 21 21 THR N N 21 121.524 123.255 -1.731 1
1 154 . 2 1 1 A 22 22 ILE H H 22 9.509 9.069 0.440 1
1 155 . 2 1 1 A 22 22 ILE HA H 22 4.349 4.833 -0.484 1
1 165 . 2 1 1 A 22 22 ILE CA C 22 57.634 60.040 -2.406 1
1 166 . 2 1 1 A 22 22 ILE CB C 22 38.334 42.469 -4.135 1
1 170 . 2 1 1 A 22 22 ILE N N 22 129.772 126.711 3.061 1
1 171 . 2 1 1 A 23 23 THR H H 23 8.838 8.704 0.134 1
1 172 . 2 1 1 A 23 23 THR HA H 23 4.653 4.768 -0.115 1
1 177 . 2 1 1 A 23 23 THR CA C 23 60.194 61.159 -0.965 1
1 178 . 2 1 1 A 23 23 THR CB C 23 66.577 70.135 -3.558 1
1 180 . 2 1 1 A 23 23 THR N N 23 124.070 124.085 -0.015 1
1 181 . 2 1 1 A 24 24 LEU H H 24 8.749 8.659 0.090 1
1 182 . 2 1 1 A 24 24 LEU HA H 24 4.619 4.876 -0.257 1
1 192 . 2 1 1 A 24 24 LEU CA C 24 50.257 53.080 -2.823 1
1 193 . 2 1 1 A 24 24 LEU CB C 24 42.932 45.466 -2.534 1
1 197 . 2 1 1 A 24 24 LEU N N 24 126.499 125.489 1.010 1
1 198 . 2 1 1 A 25 25 GLU H H 25 7.990 8.697 -0.707 1
1 199 . 2 1 1 A 25 25 GLU HA H 25 4.591 4.505 0.086 1
1 204 . 2 1 1 A 25 25 GLU CA C 25 52.845 56.004 -3.159 1
1 205 . 2 1 1 A 25 25 GLU CB C 25 27.210 29.122 -1.912 1
1 207 . 2 1 1 A 25 25 GLU N N 25 121.644 124.354 -2.710 1
1 208 . 2 1 1 A 26 26 VAL H H 26 8.657 8.351 0.306 1
1 209 . 2 1 1 A 26 26 VAL HA H 26 4.403 5.026 -0.623 1
1 217 . 2 1 1 A 26 26 VAL CA C 26 56.020 59.521 -3.501 1
1 218 . 2 1 1 A 26 26 VAL CB C 26 33.631 35.168 -1.537 1
1 221 . 2 1 1 A 26 26 VAL N N 26 116.647 120.539 -3.892 1
1 222 . 2 1 1 A 27 27 GLU H H 27 7.970 8.612 -0.642 1
1 223 . 2 1 1 A 27 27 GLU HA H 27 4.447 5.050 -0.603 1
1 228 . 2 1 1 A 27 27 GLU CA C 27 51.386 55.007 -3.621 1
1 229 . 2 1 1 A 27 27 GLU CB C 27 30.905 32.084 -1.179 1
1 231 . 2 1 1 A 27 27 GLU N N 27 115.496 121.462 -5.966 1
1 232 . 2 1 1 A 28 28 SER H H 28 9.192 8.785 0.407 1
1 233 . 2 1 1 A 28 28 SER HA H 28 4.108 3.956 0.152 1
1 236 . 2 1 1 A 28 28 SER CA C 28 59.909 61.392 -1.483 1
1 237 . 2 1 1 A 28 28 SER CB C 28 60.399 62.427 -2.028 1
1 238 . 2 1 1 A 28 28 SER N N 28 117.720 119.198 -1.478 1
1 239 . 2 1 1 A 29 29 SER H H 29 7.371 7.711 -0.340 1
1 240 . 2 1 1 A 29 29 SER HA H 29 4.327 4.487 -0.160 1
1 243 . 2 1 1 A 29 29 SER CA C 29 54.805 57.162 -2.357 1
1 244 . 2 1 1 A 29 29 SER CB C 29 60.775 64.198 -3.423 1
1 245 . 2 1 1 A 29 29 SER N N 29 108.936 112.086 -3.150 1
1 246 . 2 1 1 A 30 30 ASP H H 30 7.852 7.653 0.199 1
1 247 . 2 1 1 A 30 30 ASP HA H 30 4.591 4.536 0.055 1
1 250 . 2 1 1 A 30 30 ASP CA C 30 53.040 54.526 -1.486 1
1 251 . 2 1 1 A 30 30 ASP CB C 30 37.942 41.833 -3.891 1
1 252 . 2 1 1 A 30 30 ASP N N 30 123.735 123.658 0.077 1
1 253 . 2 1 1 A 31 31 THR H H 31 7.852 8.566 -0.714 1
1 254 . 2 1 1 A 31 31 THR HA H 31 4.918 4.893 0.025 1
1 259 . 2 1 1 A 31 31 THR CA C 31 56.929 60.144 -3.215 1
1 260 . 2 1 1 A 31 31 THR CB C 31 68.674 71.189 -2.515 1
1 262 . 2 1 1 A 31 31 THR N N 31 109.181 113.213 -4.032 1
1 263 . 2 1 1 A 32 32 ILE H H 32 8.582 9.037 -0.455 1
1 264 . 2 1 1 A 32 32 ILE HA H 32 3.624 3.760 -0.136 1
1 274 . 2 1 1 A 32 32 ILE CA C 32 59.474 65.596 -6.122 1
1 275 . 2 1 1 A 32 32 ILE CB C 32 31.561 37.614 -6.053 1
1 279 . 2 1 1 A 32 32 ILE N N 32 121.833 122.822 -0.989 1
1 280 . 2 1 1 A 33 33 ASP H H 33 9.255 7.871 1.384 1
1 281 . 2 1 1 A 33 33 ASP HA H 33 4.201 4.305 -0.104 1
1 284 . 2 1 1 A 33 33 ASP CA C 33 54.679 57.713 -3.034 1
1 285 . 2 1 1 A 33 33 ASP CB C 33 37.700 41.573 -3.873 1
1 286 . 2 1 1 A 33 33 ASP N N 33 119.823 121.094 -1.271 1
1 287 . 2 1 1 A 34 34 ASN H H 34 8.026 7.604 0.422 1
1 288 . 2 1 1 A 34 34 ASN HA H 34 4.409 4.455 -0.046 1
1 291 . 2 1 1 A 34 34 ASN CA C 34 53.324 56.749 -3.425 1
1 292 . 2 1 1 A 34 34 ASN CB C 34 35.782 38.737 -2.955 1
1 293 . 2 1 1 A 34 34 ASN N N 34 119.540 118.278 1.262 1
1 294 . 2 1 1 A 35 35 VAL H H 35 8.167 8.107 0.060 1
1 295 . 2 1 1 A 35 35 VAL HA H 35 3.249 3.469 -0.220 1
1 303 . 2 1 1 A 35 35 VAL CA C 35 65.308 67.315 -2.007 1
1 304 . 2 1 1 A 35 35 VAL CB C 35 27.965 31.447 -3.482 1
1 307 . 2 1 1 A 35 35 VAL N N 35 122.223 120.226 1.997 1
1 308 . 2 1 1 A 36 36 LYS H H 36 8.460 8.019 0.441 1
1 313 . 2 1 1 A 36 36 LYS CB C 36 30.753 32.295 -1.542 1
1 315 . 2 1 1 A 36 36 LYS N N 36 119.438 119.148 0.290 1
1 316 . 2 1 1 A 37 37 SER H H 37 8.196 7.930 0.266 1
1 317 . 2 1 1 A 37 37 SER HA H 37 4.130 4.062 0.068 1
1 320 . 2 1 1 A 37 37 SER CA C 37 58.528 61.701 -3.173 1
1 321 . 2 1 1 A 37 37 SER CB C 37 59.768 63.012 -3.244 1
1 322 . 2 1 1 A 37 37 SER N N 37 117.791 114.281 3.510 1
1 323 . 2 1 1 A 38 38 LYS H H 38 8.043 8.360 -0.317 1
1 324 . 2 1 1 A 38 38 LYS HA H 38 4.095 4.024 0.071 1
1 325 . 2 1 1 A 38 38 LYS CA C 38 57.377 58.922 -1.545 1
1 326 . 2 1 1 A 38 38 LYS N N 38 124.094 120.596 3.498 1
1 327 . 2 1 1 A 39 39 ILE H H 39 8.254 8.112 0.142 1
1 328 . 2 1 1 A 39 39 ILE HA H 39 3.439 3.701 -0.262 1
1 338 . 2 1 1 A 39 39 ILE CA C 39 63.977 64.836 -0.859 1
1 339 . 2 1 1 A 39 39 ILE CB C 39 33.935 37.516 -3.581 1
1 343 . 2 1 1 A 39 39 ILE N N 39 122.107 120.154 1.953 1
1 344 . 2 1 1 A 40 40 GLN H H 40 8.379 8.570 -0.191 1
1 345 . 2 1 1 A 40 40 GLN HA H 40 3.746 4.248 -0.502 1
1 350 . 2 1 1 A 40 40 GLN CA C 40 57.472 58.196 -0.724 1
1 351 . 2 1 1 A 40 40 GLN CB C 40 25.072 28.156 -3.084 1
1 353 . 2 1 1 A 40 40 GLN N N 40 123.725 119.695 4.030 1
1 354 . 2 1 1 A 41 41 ASP H H 41 8.210 7.861 0.349 1
1 355 . 2 1 1 A 41 41 ASP HA H 41 4.247 4.393 -0.146 1
1 358 . 2 1 1 A 41 41 ASP CA C 41 54.646 56.421 -1.775 1
1 359 . 2 1 1 A 41 41 ASP CB C 41 38.136 41.038 -2.902 1
1 360 . 2 1 1 A 41 41 ASP N N 41 120.564 120.487 0.077 1
1 361 . 2 1 1 A 42 42 LYS H H 42 7.381 8.243 -0.862 1
1 362 . 2 1 1 A 42 42 LYS HA H 42 4.246 4.313 -0.067 1
1 369 . 2 1 1 A 42 42 LYS CA C 42 55.579 57.875 -2.296 1
1 370 . 2 1 1 A 42 42 LYS CB C 42 31.406 33.498 -2.092 1
1 373 . 2 1 1 A 42 42 LYS N N 42 115.674 116.965 -1.291 1
1 374 . 2 1 1 A 43 43 GLU H H 43 8.537 8.490 0.047 1
1 375 . 2 1 1 A 43 43 GLU HA H 43 4.522 4.534 -0.012 1
1 380 . 2 1 1 A 43 43 GLU CA C 43 52.772 55.673 -2.901 1
1 381 . 2 1 1 A 43 43 GLU CB C 43 30.535 31.045 -0.510 1
1 383 . 2 1 1 A 43 43 GLU N N 43 114.355 116.116 -1.761 1
1 384 . 2 1 1 A 44 44 GLY H H 44 8.611 8.425 0.186 1
1 385 . 2 1 1 A 44 44 GLY HA2 H 44 4.067 3.967 0.100 1
1 386 . 2 1 1 A 44 44 GLY HA3 H 44 3.819 3.968 -0.149 1
1 387 . 2 1 1 A 44 44 GLY CA C 44 43.205 45.329 -2.124 1
1 388 . 2 1 1 A 44 44 GLY N N 44 109.406 108.312 1.094 1
1 389 . 2 1 1 A 45 45 ILE H H 45 6.092 8.077 -1.985 1
1 390 . 2 1 1 A 45 45 ILE HA H 45 4.324 4.082 0.242 1
1 400 . 2 1 1 A 45 45 ILE CA C 45 55.211 60.223 -5.012 1
1 401 . 2 1 1 A 45 45 ILE CB C 45 37.903 38.052 -0.149 1
1 405 . 2 1 1 A 45 45 ILE N N 45 120.791 122.477 -1.686 1
1 406 . 2 1 1 A 46 46 PRO HA H 46 4.547 4.606 -0.059 1
1 413 . 2 1 1 A 46 46 PRO CA C 46 58.971 61.988 -3.017 1
1 414 . 2 1 1 A 46 46 PRO CB C 46 29.142 32.244 -3.102 1
1 417 . 2 1 1 A 47 47 PRO HA H 47 4.062 4.206 -0.144 1
1 424 . 2 1 1 A 47 47 PRO CA C 47 63.476 65.790 -2.314 1
1 425 . 2 1 1 A 47 47 PRO CB C 47 30.113 31.800 -1.687 1
1 428 . 2 1 1 A 48 48 ASP H H 48 8.418 8.520 -0.102 1
1 429 . 2 1 1 A 48 48 ASP HA H 48 4.346 4.359 -0.013 1
1 432 . 2 1 1 A 48 48 ASP CA C 48 52.838 56.751 -3.913 1
1 433 . 2 1 1 A 48 48 ASP CB C 48 36.926 40.044 -3.118 1
1 434 . 2 1 1 A 48 48 ASP N N 48 113.462 116.950 -3.488 1
1 435 . 2 1 1 A 49 49 GLN H H 49 7.822 7.820 0.002 1
1 436 . 2 1 1 A 49 49 GLN HA H 49 4.283 4.153 0.130 1
1 439 . 2 1 1 A 49 49 GLN CA C 49 52.770 58.017 -5.247 1
1 441 . 2 1 1 A 49 49 GLN N N 49 117.377 117.446 -0.069 1
1 442 . 2 1 1 A 50 50 GLN H H 50 7.451 7.625 -0.174 1
1 443 . 2 1 1 A 50 50 GLN HA H 50 4.260 4.944 -0.684 1
1 448 . 2 1 1 A 50 50 GLN CA C 50 53.725 54.744 -1.019 1
1 449 . 2 1 1 A 50 50 GLN CB C 50 29.142 31.142 -2.000 1
1 451 . 2 1 1 A 50 50 GLN N N 50 117.526 117.255 0.271 1
1 452 . 2 1 1 A 51 51 ARG H H 51 8.534 8.481 0.053 1
1 453 . 2 1 1 A 51 51 ARG HA H 51 4.486 5.142 -0.656 1
1 460 . 2 1 1 A 51 51 ARG CA C 51 52.492 54.451 -1.959 1
1 461 . 2 1 1 A 51 51 ARG CB C 51 29.096 33.881 -4.785 1
1 464 . 2 1 1 A 51 51 ARG N N 51 121.655 121.465 0.190 1
1 465 . 2 1 1 A 52 52 LEU H H 52 8.683 9.048 -0.365 1
1 466 . 2 1 1 A 52 52 LEU HA H 52 5.255 5.065 0.190 1
1 476 . 2 1 1 A 52 52 LEU CA C 52 50.618 53.781 -3.163 1
1 477 . 2 1 1 A 52 52 LEU CB C 52 43.007 43.150 -0.143 1
1 481 . 2 1 1 A 52 52 LEU N N 52 122.929 123.680 -0.751 1
1 482 . 2 1 1 A 53 53 ILE H H 53 9.286 9.114 0.172 1
1 483 . 2 1 1 A 53 53 ILE HA H 53 5.096 5.087 0.009 1
1 492 . 2 1 1 A 53 53 ILE CA C 53 56.795 60.467 -3.672 1
1 496 . 2 1 1 A 53 53 ILE N N 53 124.718 124.854 -0.136 1
1 497 . 2 1 1 A 54 54 TRP H H 54 8.871 9.384 -0.513 1
1 499 . 2 1 1 A 54 54 TRP N N 54 127.412 128.629 -1.217 1
1 501 . 2 1 1 A 55 55 ALA H H 55 8.401 8.495 -0.094 1
1 502 . 2 1 1 A 55 55 ALA HA H 55 3.183 3.595 -0.412 1
1 506 . 2 1 1 A 55 55 ALA CA C 55 49.712 52.859 -3.147 1
1 507 . 2 1 1 A 55 55 ALA CB C 55 13.252 17.434 -4.182 1
1 508 . 2 1 1 A 55 55 ALA N N 55 128.894 130.565 -1.671 1
1 509 . 2 1 1 A 56 56 GLY H H 56 8.248 8.471 -0.223 1
1 510 . 2 1 1 A 56 56 GLY HA2 H 56 3.968 3.777 0.191 1
1 511 . 2 1 1 A 56 56 GLY HA3 H 56 3.916 3.778 0.138 1
1 512 . 2 1 1 A 56 56 GLY CA C 56 43.142 45.631 -2.489 1
1 513 . 2 1 1 A 56 56 GLY N N 56 101.499 102.611 -1.112 1
1 514 . 2 1 1 A 57 57 LYS H H 57 8.028 7.837 0.191 1
1 515 . 2 1 1 A 57 57 LYS HA H 57 4.609 4.708 -0.099 1
1 522 . 2 1 1 A 57 57 LYS CA C 57 51.928 54.415 -2.487 1
1 523 . 2 1 1 A 57 57 LYS CB C 57 32.613 34.959 -2.346 1
1 526 . 2 1 1 A 57 57 LYS N N 57 118.995 120.533 -1.538 1
1 527 . 2 1 1 A 58 58 GLN H H 58 8.607 8.606 0.001 1
1 528 . 2 1 1 A 58 58 GLN HA H 58 4.617 4.628 -0.011 1
1 533 . 2 1 1 A 58 58 GLN CA C 58 53.261 55.683 -2.422 1
1 534 . 2 1 1 A 58 58 GLN CB C 58 26.613 29.452 -2.839 1
1 536 . 2 1 1 A 58 58 GLN N N 58 119.825 123.398 -3.573 1
1 537 . 2 1 1 A 59 59 LEU H H 59 8.653 9.505 -0.852 1
1 538 . 2 1 1 A 59 59 LEU HA H 59 4.138 4.327 -0.189 1
1 548 . 2 1 1 A 59 59 LEU CA C 59 51.991 54.433 -2.442 1
1 549 . 2 1 1 A 59 59 LEU CB C 59 39.006 42.323 -3.317 1
1 553 . 2 1 1 A 59 59 LEU N N 59 125.484 126.914 -1.430 1
1 554 . 2 1 1 A 60 60 GLU H H 60 8.461 8.961 -0.500 1
1 555 . 2 1 1 A 60 60 GLU HA H 60 4.371 4.455 -0.084 1
1 559 . 2 1 1 A 60 60 GLU CA C 60 53.436 55.616 -2.180 1
1 560 . 2 1 1 A 60 60 GLU CB C 60 29.057 30.973 -1.916 1
1 562 . 2 1 1 A 60 60 GLU N N 60 123.237 121.928 1.309 1
1 563 . 2 1 1 A 61 61 ASP H H 61 8.076 8.886 -0.810 1
1 564 . 2 1 1 A 61 61 ASP HA H 61 4.265 4.333 -0.068 1
1 567 . 2 1 1 A 61 61 ASP CA C 61 54.398 56.231 -1.833 1
1 568 . 2 1 1 A 61 61 ASP CB C 61 38.340 40.076 -1.736 1
1 569 . 2 1 1 A 61 61 ASP N N 61 120.701 123.302 -2.601 1
1 570 . 2 1 1 A 62 62 GLY HA2 H 62 4.104 3.971 0.133 1
1 571 . 2 1 1 A 62 62 GLY HA3 H 62 3.832 3.972 -0.140 1
1 572 . 2 1 1 A 62 62 GLY CA C 62 42.576 45.487 -2.911 1
1 573 . 2 1 1 A 63 63 ARG H H 63 7.319 8.001 -0.682 1
1 574 . 2 1 1 A 63 63 ARG HA H 63 4.595 4.459 0.136 1
1 579 . 2 1 1 A 63 63 ARG CA C 63 51.971 55.566 -3.595 1
1 582 . 2 1 1 A 63 63 ARG N N 63 119.206 120.456 -1.250 1
1 583 . 2 1 1 A 64 64 THR H H 64 8.735 8.401 0.334 1
1 584 . 2 1 1 A 64 64 THR HA H 64 5.208 4.935 0.273 1
1 589 . 2 1 1 A 64 64 THR CA C 64 57.126 59.510 -2.384 1
1 590 . 2 1 1 A 64 64 THR CB C 64 69.885 71.839 -1.954 1
1 592 . 2 1 1 A 64 64 THR N N 64 108.713 111.063 -2.350 1
1 593 . 2 1 1 A 65 65 LEU H H 65 8.241 9.383 -1.142 1
1 594 . 2 1 1 A 65 65 LEU HA H 65 4.003 3.953 0.050 1
1 604 . 2 1 1 A 65 65 LEU CA C 65 56.409 57.813 -1.404 1
1 605 . 2 1 1 A 65 65 LEU CB C 65 37.179 41.750 -4.571 1
1 609 . 2 1 1 A 65 65 LEU N N 65 118.111 122.333 -4.222 1
1 610 . 2 1 1 A 66 66 SER H H 66 8.296 8.130 0.166 1
1 611 . 2 1 1 A 66 66 SER HA H 66 4.201 4.276 -0.075 1
1 614 . 2 1 1 A 66 66 SER CA C 66 58.454 60.141 -1.687 1
1 615 . 2 1 1 A 66 66 SER CB C 66 59.969 62.888 -2.919 1
1 616 . 2 1 1 A 66 66 SER N N 66 113.148 113.260 -0.112 1
1 617 . 2 1 1 A 67 67 ASP H H 67 7.984 8.279 -0.295 1
1 618 . 2 1 1 A 67 67 ASP HA H 67 4.187 4.336 -0.149 1
1 621 . 2 1 1 A 67 67 ASP CA C 67 54.744 57.465 -2.721 1
1 622 . 2 1 1 A 67 67 ASP CB C 67 37.794 41.286 -3.492 1
1 623 . 2 1 1 A 67 67 ASP N N 67 124.130 123.613 0.517 1
1 624 . 2 1 1 A 68 68 TYR H H 68 7.177 7.799 -0.622 1
1 625 . 2 1 1 A 68 68 TYR N N 68 115.334 116.341 -1.007 1
1 626 . 2 1 1 A 69 69 ASN H H 69 8.111 8.154 -0.043 1
1 627 . 2 1 1 A 69 69 ASN HA H 69 4.253 4.400 -0.147 1
1 630 . 2 1 1 A 69 69 ASN CA C 69 51.386 54.173 -2.787 1
1 631 . 2 1 1 A 69 69 ASN CB C 69 34.867 37.804 -2.937 1
1 632 . 2 1 1 A 69 69 ASN N N 69 116.867 116.667 0.200 1
1 633 . 2 1 1 A 70 70 ILE H H 70 7.460 7.862 -0.402 1
1 634 . 2 1 1 A 70 70 ILE HA H 70 3.210 3.662 -0.452 1
1 644 . 2 1 1 A 70 70 ILE CA C 70 60.157 64.025 -3.868 1
1 645 . 2 1 1 A 70 70 ILE CB C 70 34.754 37.879 -3.125 1
1 649 . 2 1 1 A 70 70 ILE N N 70 119.821 117.976 1.845 1
1 650 . 2 1 1 A 71 71 GLN H H 71 7.368 7.846 -0.478 1
1 651 . 2 1 1 A 71 71 GLN HA H 71 4.099 3.985 0.114 1
1 656 . 2 1 1 A 71 71 GLN CA C 71 50.906 57.756 -6.850 1
1 657 . 2 1 1 A 71 71 GLN CB C 71 28.793 27.205 1.588 1
1 659 . 2 1 1 A 71 71 GLN N N 71 124.287 119.014 5.273 1
1 660 . 2 1 1 A 72 72 ARG H H 72 7.583 8.683 -1.100 1
1 661 . 2 1 1 A 72 72 ARG HA H 72 3.907 4.436 -0.529 1
1 668 . 2 1 1 A 72 72 ARG CA C 72 54.527 58.306 -3.779 1
1 669 . 2 1 1 A 72 72 ARG CB C 72 27.470 31.324 -3.854 1
1 672 . 2 1 1 A 72 72 ARG N N 72 119.007 123.302 -4.295 1
1 673 . 2 1 1 A 73 73 GLU H H 73 9.262 8.355 0.907 1
1 674 . 2 1 1 A 73 73 GLU HA H 73 3.586 4.430 -0.844 1
1 679 . 2 1 1 A 73 73 GLU CA C 73 55.703 56.618 -0.915 1
1 680 . 2 1 1 A 73 73 GLU CB C 73 23.669 28.698 -5.029 1
1 682 . 2 1 1 A 73 73 GLU N N 73 115.180 117.197 -2.017 1
1 683 . 2 1 1 A 74 74 SER H H 74 7.551 8.291 -0.740 1
1 684 . 2 1 1 A 74 74 SER HA H 74 4.613 5.146 -0.533 1
1 687 . 2 1 1 A 74 74 SER CA C 74 58.305 56.752 1.553 1
1 688 . 2 1 1 A 74 74 SER CB C 74 62.156 65.597 -3.441 1
1 689 . 2 1 1 A 74 74 SER N N 74 115.104 116.685 -1.581 1
1 690 . 2 1 1 A 75 75 THR H H 75 8.785 8.841 -0.056 1
1 691 . 2 1 1 A 75 75 THR HA H 75 5.014 4.913 0.101 1
1 696 . 2 1 1 A 75 75 THR CA C 75 59.835 62.330 -2.495 1
1 697 . 2 1 1 A 75 75 THR CB C 75 67.258 69.290 -2.032 1
1 699 . 2 1 1 A 75 75 THR N N 75 118.401 119.654 -1.253 1
1 700 . 2 1 1 A 76 76 LEU H H 76 9.447 10.185 -0.738 1
1 701 . 2 1 1 A 76 76 LEU HA H 76 4.930 4.815 0.115 1
1 711 . 2 1 1 A 76 76 LEU CA C 76 51.107 54.207 -3.100 1
1 712 . 2 1 1 A 76 76 LEU CB C 76 40.841 41.339 -0.498 1
1 716 . 2 1 1 A 76 76 LEU N N 76 127.905 128.435 -0.530 1
1 717 . 2 1 1 A 77 77 HIS HA H 77 4.976 5.103 -0.127 1
1 720 . 2 1 1 A 77 77 HIS CA C 77 53.776 57.251 -3.475 1
1 721 . 2 1 1 A 77 77 HIS CB C 77 28.438 30.005 -1.567 1
1 722 . 2 1 1 A 78 78 LEU H H 78 8.450 9.380 -0.930 1
1 723 . 2 1 1 A 78 78 LEU HA H 78 5.085 5.369 -0.284 1
1 733 . 2 1 1 A 78 78 LEU CA C 78 50.896 53.487 -2.591 1
1 734 . 2 1 1 A 78 78 LEU CB C 78 41.916 46.210 -4.294 1
1 738 . 2 1 1 A 78 78 LEU N N 78 126.178 125.812 0.366 1
1 739 . 2 1 1 A 79 79 VAL H H 79 9.093 8.863 0.230 1
1 740 . 2 1 1 A 79 79 VAL HA H 79 4.053 4.882 -0.829 1
1 748 . 2 1 1 A 79 79 VAL CA C 79 59.054 60.009 -0.955 1
1 749 . 2 1 1 A 79 79 VAL CB C 79 32.115 35.112 -2.997 1
1 752 . 2 1 1 A 79 79 VAL N N 79 128.372 119.692 8.680 1
1 753 . 2 1 1 A 80 80 LEU H H 80 8.000 8.923 -0.923 1
1 754 . 2 1 1 A 80 80 LEU HA H 80 5.105 4.597 0.508 1
1 764 . 2 1 1 A 80 80 LEU CA C 80 50.556 54.185 -3.629 1
1 765 . 2 1 1 A 80 80 LEU CB C 80 39.597 41.966 -2.369 1
1 769 . 2 1 1 A 80 80 LEU N N 80 126.145 127.211 -1.066 1
1 770 . 2 1 1 A 81 81 ARG H H 81 8.470 8.727 -0.257 1
1 771 . 2 1 1 A 81 81 ARG HA H 81 4.197 4.487 -0.290 1
1 778 . 2 1 1 A 81 81 ARG CA C 81 53.133 55.757 -2.624 1
1 779 . 2 1 1 A 81 81 ARG CB C 81 28.413 31.472 -3.059 1
1 782 . 2 1 1 A 81 81 ARG N N 81 121.625 123.190 -1.565 1
1 783 . 2 1 1 A 82 82 LEU H H 82 8.454 8.100 0.354 1
1 784 . 2 1 1 A 82 82 LEU HA H 82 4.339 4.314 0.025 1
1 794 . 2 1 1 A 82 82 LEU CA C 82 52.081 54.538 -2.457 1
1 795 . 2 1 1 A 82 82 LEU CB C 82 39.810 41.377 -1.567 1
1 799 . 2 1 1 A 82 82 LEU N N 82 123.832 122.572 1.260 1
1 800 . 2 1 1 A 83 83 ARG H H 83 8.404 8.156 0.248 1
1 801 . 2 1 1 A 83 83 ARG HA H 83 4.308 4.202 0.106 1
1 808 . 2 1 1 A 83 83 ARG CA C 83 53.258 55.543 -2.285 1
1 809 . 2 1 1 A 83 83 ARG CB C 83 28.160 30.319 -2.159 1
1 812 . 2 1 1 A 83 83 ARG N N 83 121.447 125.228 -3.781 1
1 813 . 2 1 1 A 84 84 GLY H H 84 8.410 9.072 -0.662 1
1 814 . 2 1 1 A 84 84 GLY HA2 H 84 3.929 3.947 -0.018 1
1 815 . 2 1 1 A 84 84 GLY HA3 H 84 3.929 3.948 -0.019 1
1 816 . 2 1 1 A 84 84 GLY CA C 84 42.751 46.686 -3.935 1
1 817 . 2 1 1 A 84 84 GLY N N 84 110.030 111.336 -1.306 1
1 818 . 2 1 1 A 85 85 GLY H H 85 8.295 7.813 0.482 1
1 819 . 2 1 1 A 85 85 GLY HA2 H 85 3.950 4.198 -0.248 1
1 820 . 2 1 1 A 85 85 GLY HA3 H 85 3.950 4.198 -0.248 1
1 821 . 2 1 1 A 85 85 GLY CA C 85 42.831 46.308 -3.477 1
1 822 . 2 1 1 A 85 85 GLY N N 85 108.838 106.555 2.283 1
1 823 . 2 1 1 A 86 86 SER H H 86 8.292 8.389 -0.097 1
1 824 . 2 1 1 A 86 86 SER HA H 86 4.405 4.722 -0.317 1
1 827 . 2 1 1 A 86 86 SER CA C 86 55.965 57.830 -1.865 1
1 828 . 2 1 1 A 86 86 SER CB C 86 61.232 61.351 -0.119 1
1 829 . 2 1 1 A 86 86 SER N N 86 116.028 120.542 -4.514 1
1 830 . 2 1 1 A 87 87 MET H H 87 8.470 8.068 0.402 1
1 831 . 2 1 1 A 87 87 MET HA H 87 4.447 4.380 0.067 1
1 836 . 2 1 1 A 87 87 MET CA C 87 53.281 56.227 -2.946 1
1 837 . 2 1 1 A 87 87 MET CB C 87 29.788 33.652 -3.864 1
1 839 . 2 1 1 A 87 87 MET N N 87 121.625 124.212 -2.587 1
1 840 . 2 1 1 A 88 88 GLY H H 88 8.320 8.337 -0.017 1
1 841 . 2 1 1 A 88 88 GLY HA2 H 88 3.919 3.930 -0.011 1
1 842 . 2 1 1 A 88 88 GLY HA3 H 88 3.896 3.932 -0.036 1
1 843 . 2 1 1 A 88 88 GLY CA C 88 43.060 45.548 -2.488 1
1 844 . 2 1 1 A 88 88 GLY N N 88 109.625 108.858 0.767 1
1 845 . 2 1 1 A 89 89 GLY H H 89 8.256 8.627 -0.371 1
1 846 . 2 1 1 A 89 89 GLY HA2 H 89 3.940 3.933 0.007 1
1 847 . 2 1 1 A 89 89 GLY HA3 H 89 3.910 3.933 -0.023 1
1 848 . 2 1 1 A 89 89 GLY CA C 89 42.678 45.599 -2.921 1
1 849 . 2 1 1 A 89 89 GLY N N 89 108.982 108.672 0.310 1
1 850 . 2 1 1 A 90 90 ALA H H 90 8.203 8.104 0.099 1
1 851 . 2 1 1 A 90 90 ALA HA H 90 4.255 4.135 0.120 1
1 855 . 2 1 1 A 90 90 ALA CA C 90 50.763 54.564 -3.801 1
1 856 . 2 1 1 A 90 90 ALA CB C 90 16.364 19.136 -2.772 1
1 857 . 2 1 1 A 90 90 ALA N N 90 124.065 123.335 0.730 1
1 858 . 2 1 1 A 91 91 ALA H H 91 8.273 7.833 0.440 1
1 859 . 2 1 1 A 91 91 ALA HA H 91 4.204 4.389 -0.185 1
1 863 . 2 1 1 A 91 91 ALA CA C 91 51.080 51.801 -0.721 1
1 864 . 2 1 1 A 91 91 ALA CB C 91 16.036 18.321 -2.285 1
1 865 . 2 1 1 A 91 91 ALA N N 91 121.985 119.473 2.512 1
1 866 . 2 1 1 A 92 92 ASP H H 92 8.022 8.686 -0.664 1
1 867 . 2 1 1 A 92 92 ASP HA H 92 4.455 4.663 -0.208 1
1 870 . 2 1 1 A 92 92 ASP CA C 92 52.664 55.877 -3.213 1
1 871 . 2 1 1 A 92 92 ASP CB C 92 37.925 40.651 -2.726 1
1 872 . 2 1 1 A 92 92 ASP N N 92 118.621 124.377 -5.756 1
1 873 . 2 1 1 A 93 93 GLU H H 93 8.282 8.141 0.141 1
1 874 . 2 1 1 A 93 93 GLU HA H 93 3.912 4.691 -0.779 1
1 879 . 2 1 1 A 93 93 GLU CA C 93 56.947 57.808 -0.861 1
1 880 . 2 1 1 A 93 93 GLU CB C 93 27.413 32.825 -5.412 1
1 882 . 2 1 1 A 93 93 GLU N N 93 122.247 117.846 4.401 1
1 883 . 2 1 1 A 94 94 GLU H H 94 8.194 8.182 0.012 1
1 884 . 2 1 1 A 94 94 GLU HA H 94 3.940 4.488 -0.548 1
1 889 . 2 1 1 A 94 94 GLU CA C 94 56.681 57.394 -0.713 1
1 890 . 2 1 1 A 94 94 GLU CB C 94 26.127 30.947 -4.820 1
1 892 . 2 1 1 A 94 94 GLU N N 94 118.024 117.256 0.768 1
1 893 . 2 1 1 A 95 95 GLU H H 95 7.816 8.230 -0.414 1
1 894 . 2 1 1 A 95 95 GLU HA H 95 4.121 4.161 -0.040 1
1 898 . 2 1 1 A 95 95 GLU CA C 95 56.162 58.692 -2.530 1
1 899 . 2 1 1 A 95 95 GLU CB C 95 26.403 28.188 -1.785 1
1 901 . 2 1 1 A 95 95 GLU N N 95 120.028 119.377 0.651 1
1 902 . 2 1 1 A 96 96 LEU H H 96 7.637 7.775 -0.138 1
1 903 . 2 1 1 A 96 96 LEU HA H 96 3.988 4.109 -0.121 1
1 913 . 2 1 1 A 96 96 LEU CA C 96 55.303 57.169 -1.866 1
1 914 . 2 1 1 A 96 96 LEU CB C 96 39.038 41.451 -2.413 1
1 918 . 2 1 1 A 96 96 LEU N N 96 119.866 118.062 1.804 1
1 919 . 2 1 1 A 97 97 ILE H H 97 8.044 7.654 0.390 1
1 920 . 2 1 1 A 97 97 ILE HA H 97 3.478 3.988 -0.510 1
1 930 . 2 1 1 A 97 97 ILE CA C 97 62.054 63.648 -1.594 1
1 931 . 2 1 1 A 97 97 ILE CB C 97 34.541 38.212 -3.671 1
1 935 . 2 1 1 A 97 97 ILE N N 97 119.088 119.419 -0.331 1
1 936 . 2 1 1 A 98 98 ARG H H 98 7.991 8.352 -0.361 1
1 937 . 2 1 1 A 98 98 ARG HA H 98 3.793 4.023 -0.230 1
1 944 . 2 1 1 A 98 98 ARG CA C 98 57.509 58.842 -1.333 1
1 945 . 2 1 1 A 98 98 ARG CB C 98 27.191 29.867 -2.676 1
1 948 . 2 1 1 A 98 98 ARG N N 98 119.225 121.143 -1.918 1
1 949 . 2 1 1 A 99 99 LYS H H 99 8.101 7.866 0.235 1
1 950 . 2 1 1 A 99 99 LYS HA H 99 3.968 4.076 -0.108 1
1 959 . 2 1 1 A 99 99 LYS CA C 99 56.455 59.128 -2.673 1
1 960 . 2 1 1 A 99 99 LYS CB C 99 29.531 32.051 -2.520 1
1 964 . 2 1 1 A 99 99 LYS N N 99 119.464 118.588 0.876 1
1 965 . 2 1 1 A 100 100 ALA H H 100 8.167 7.894 0.273 1
1 966 . 2 1 1 A 100 100 ALA HA H 100 3.789 4.079 -0.290 1
1 970 . 2 1 1 A 100 100 ALA CA C 100 52.451 54.674 -2.223 1
1 971 . 2 1 1 A 100 100 ALA CB C 100 16.259 18.234 -1.975 1
1 972 . 2 1 1 A 100 100 ALA N N 100 122.398 121.118 1.280 1
1 973 . 2 1 1 A 101 101 ILE H H 101 8.777 7.999 0.778 1
1 974 . 2 1 1 A 101 101 ILE HA H 101 3.191 3.566 -0.375 1
1 984 . 2 1 1 A 101 101 ILE CA C 101 62.910 65.190 -2.280 1
1 985 . 2 1 1 A 101 101 ILE CB C 101 34.544 37.706 -3.162 1
1 989 . 2 1 1 A 101 101 ILE N N 101 120.431 118.915 1.516 1
1 990 . 2 1 1 A 102 102 GLU H H 102 7.890 7.656 0.234 1
1 991 . 2 1 1 A 102 102 GLU HA H 102 3.848 4.130 -0.282 1
1 996 . 2 1 1 A 102 102 GLU CA C 102 57.079 58.137 -1.058 1
1 997 . 2 1 1 A 102 102 GLU CB C 102 26.769 29.640 -2.871 1
1 999 . 2 1 1 A 102 102 GLU N N 102 120.248 121.259 -1.011 1
1 1000 . 2 1 1 A 103 103 LEU H H 103 8.194 7.841 0.353 1
1 1001 . 2 1 1 A 103 103 LEU HA H 103 3.912 4.188 -0.276 1
1 1011 . 2 1 1 A 103 103 LEU CA C 103 55.078 57.225 -2.147 1
1 1012 . 2 1 1 A 103 103 LEU CB C 103 38.963 41.867 -2.904 1
1 1016 . 2 1 1 A 103 103 LEU N N 103 120.341 120.178 0.163 1
1 1017 . 2 1 1 A 104 104 SER H H 104 8.268 7.850 0.418 1
1 1018 . 2 1 1 A 104 104 SER HA H 104 4.120 4.460 -0.340 1
1 1021 . 2 1 1 A 104 104 SER CA C 104 58.301 59.134 -0.833 1
1 1022 . 2 1 1 A 104 104 SER CB C 104 60.193 64.085 -3.892 1
1 1023 . 2 1 1 A 104 104 SER N N 104 115.150 114.142 1.008 1
1 1024 . 2 1 1 A 105 105 LEU H H 105 7.501 7.432 0.069 1
1 1025 . 2 1 1 A 105 105 LEU HA H 105 4.041 3.903 0.138 1
1 1035 . 2 1 1 A 105 105 LEU CA C 105 53.995 56.758 -2.763 1
1 1036 . 2 1 1 A 105 105 LEU CB C 105 39.597 41.933 -2.336 1
1 1040 . 2 1 1 A 105 105 LEU N N 105 124.223 120.043 4.180 1
1 1041 . 2 1 1 A 106 106 LYS H H 106 7.542 8.071 -0.529 1
1 1042 . 2 1 1 A 106 106 LYS HA H 106 4.090 4.069 0.021 1
1 1050 . 2 1 1 A 106 106 LYS CA C 106 55.495 58.880 -3.385 1
1 1051 . 2 1 1 A 106 106 LYS CB C 106 29.941 32.773 -2.832 1
1 1055 . 2 1 1 A 106 106 LYS N N 106 120.328 119.029 1.299 1
1 1056 . 2 1 1 A 107 107 GLU H H 107 7.884 8.035 -0.151 1
1 1057 . 2 1 1 A 107 107 GLU HA H 107 4.210 4.049 0.161 1
1 1060 . 2 1 1 A 107 107 GLU CA C 107 54.509 59.396 -4.887 1
1 1061 . 2 1 1 A 107 107 GLU CB C 107 27.239 29.076 -1.837 1
1 1062 . 2 1 1 A 107 107 GLU N N 107 118.621 120.006 -1.385 1
1 1063 . 2 1 1 A 108 108 SER H H 108 7.923 8.051 -0.128 1
1 1064 . 2 1 1 A 108 108 SER HA H 108 4.385 4.116 0.269 1
1 1067 . 2 1 1 A 108 108 SER CA C 108 56.442 61.859 -5.417 1
1 1068 . 2 1 1 A 108 108 SER CB C 108 60.953 62.747 -1.794 1
1 1069 . 2 1 1 A 108 108 SER N N 108 115.670 117.541 -1.871 1
1 1070 . 2 1 1 A 109 109 ARG H H 109 8.068 7.735 0.333 1
1 1071 . 2 1 1 A 109 109 ARG HA H 109 4.307 3.994 0.313 1
1 1078 . 2 1 1 A 109 109 ARG CA C 109 53.732 59.539 -5.807 1
1 1079 . 2 1 1 A 109 109 ARG CB C 109 27.968 29.687 -1.719 1
1 1082 . 2 1 1 A 109 109 ARG N N 109 122.313 121.089 1.224 1
1 1083 . 2 1 1 A 110 110 ASN H H 110 8.292 7.626 0.666 1
1 1084 . 2 1 1 A 110 110 ASN HA H 110 4.720 4.477 0.243 1
1 1087 . 2 1 1 A 110 110 ASN CA C 110 50.750 56.144 -5.394 1
1 1088 . 2 1 1 A 110 110 ASN CB C 110 36.197 37.683 -1.486 1
1 1089 . 2 1 1 A 110 110 ASN N N 110 119.304 118.506 0.798 1
1 1090 . 2 1 1 A 111 111 SER H H 111 8.244 8.237 0.007 1
1 1091 . 2 1 1 A 111 111 SER HA H 111 4.423 4.223 0.200 1
1 1094 . 2 1 1 A 111 111 SER CA C 111 55.990 62.647 -6.657 1
1 1095 . 2 1 1 A 111 111 SER CB C 111 61.027 62.326 -1.299 1
1 1096 . 2 1 1 A 111 111 SER N N 111 116.119 116.409 -0.290 1
1 1097 . 2 1 1 A 112 112 GLY H H 112 8.327 8.344 -0.017 1
1 1098 . 2 1 1 A 112 112 GLY HA2 H 112 3.944 3.995 -0.051 1
1 1099 . 2 1 1 A 112 112 GLY HA3 H 112 3.912 4.009 -0.097 1
1 1100 . 2 1 1 A 112 112 GLY CA C 112 42.733 45.423 -2.690 1
1 1101 . 2 1 1 A 112 112 GLY N N 112 110.442 108.504 1.938 1
1 1102 . 2 1 1 A 113 113 GLY H H 113 8.097 8.318 -0.221 1
1 1103 . 2 1 1 A 113 113 GLY HA2 H 113 3.831 3.751 0.080 1
1 1104 . 2 1 1 A 113 113 GLY HA3 H 113 3.785 3.770 0.015 1
1 1105 . 2 1 1 A 113 113 GLY CA C 113 42.435 47.147 -4.712 1
1 1106 . 2 1 1 A 113 113 GLY N N 113 108.745 110.064 -1.319 1
1 2 . 3 1 1 A 3 3 HIS CB C 3 33.709 31.055 2.654 1
1 3 . 3 1 1 A 7 7 HIS H H 7 8.731 8.233 0.498 1
1 4 . 3 1 1 A 7 7 HIS HA H 7 4.564 4.742 -0.178 1
1 7 . 3 1 1 A 7 7 HIS CA C 7 53.649 55.547 -1.898 1
1 8 . 3 1 1 A 7 7 HIS CB C 7 26.268 32.077 -5.809 1
1 9 . 3 1 1 A 7 7 HIS N N 7 121.126 112.202 8.924 1
1 10 . 3 1 1 A 8 8 GLY H H 8 8.540 7.800 0.740 1
1 11 . 3 1 1 A 8 8 GLY HA2 H 8 3.973 3.685 0.288 1
1 12 . 3 1 1 A 8 8 GLY HA3 H 8 3.811 3.910 -0.099 1
1 13 . 3 1 1 A 8 8 GLY CA C 8 42.618 44.479 -1.861 1
1 14 . 3 1 1 A 8 8 GLY N N 8 110.662 109.645 1.017 1
1 15 . 3 1 1 A 9 9 GLU H H 9 8.239 7.819 0.420 1
1 16 . 3 1 1 A 9 9 GLU HA H 9 4.568 4.235 0.333 1
1 18 . 3 1 1 A 9 9 GLU CA C 9 53.605 55.756 -2.151 1
1 19 . 3 1 1 A 9 9 GLU CB C 9 28.019 31.505 -3.486 1
1 20 . 3 1 1 A 9 9 GLU N N 9 121.669 120.835 0.834 1
1 21 . 3 1 1 A 10 10 PHE H H 10 8.785 7.043 1.742 1
1 22 . 3 1 1 A 10 10 PHE HA H 10 4.850 4.939 -0.089 1
1 25 . 3 1 1 A 10 10 PHE CA C 10 52.630 56.051 -3.421 1
1 26 . 3 1 1 A 10 10 PHE CB C 10 37.906 40.910 -3.004 1
1 27 . 3 1 1 A 10 10 PHE N N 10 118.401 117.416 0.985 1
1 28 . 3 1 1 A 11 11 GLN H H 11 8.552 9.240 -0.688 1
1 29 . 3 1 1 A 11 11 GLN HA H 11 5.425 5.442 -0.017 1
1 34 . 3 1 1 A 11 11 GLN CA C 11 51.663 54.059 -2.396 1
1 35 . 3 1 1 A 11 11 GLN CB C 11 28.427 30.879 -2.452 1
1 37 . 3 1 1 A 11 11 GLN N N 11 117.519 121.158 -3.639 1
1 38 . 3 1 1 A 12 12 ILE H H 12 8.239 8.366 -0.127 1
1 39 . 3 1 1 A 12 12 ILE HA H 12 4.103 4.897 -0.794 1
1 49 . 3 1 1 A 12 12 ILE CA C 12 57.134 59.464 -2.330 1
1 50 . 3 1 1 A 12 12 ILE CB C 12 39.491 39.546 -0.055 1
1 54 . 3 1 1 A 12 12 ILE N N 12 114.043 120.665 -6.622 1
1 55 . 3 1 1 A 13 13 PHE H H 13 8.538 8.732 -0.194 1
1 56 . 3 1 1 A 13 13 PHE HA H 13 5.620 5.408 0.212 1
1 59 . 3 1 1 A 13 13 PHE CA C 13 52.438 56.407 -3.969 1
1 60 . 3 1 1 A 13 13 PHE CB C 13 39.253 42.733 -3.480 1
1 61 . 3 1 1 A 13 13 PHE N N 13 117.015 119.574 -2.559 1
1 62 . 3 1 1 A 14 14 ALA H H 14 9.238 9.495 -0.257 1
1 63 . 3 1 1 A 14 14 ALA HA H 14 5.311 5.671 -0.360 1
1 67 . 3 1 1 A 14 14 ALA CA C 14 47.183 49.951 -2.768 1
1 68 . 3 1 1 A 14 14 ALA CB C 14 17.811 22.510 -4.699 1
1 69 . 3 1 1 A 14 14 ALA N N 14 123.503 124.653 -1.150 1
1 70 . 3 1 1 A 15 15 LYS H H 15 8.810 9.349 -0.539 1
1 71 . 3 1 1 A 15 15 LYS HA H 15 5.511 5.359 0.152 1
1 80 . 3 1 1 A 15 15 LYS CA C 15 51.718 54.526 -2.808 1
1 81 . 3 1 1 A 15 15 LYS CB C 15 33.635 35.570 -1.935 1
1 85 . 3 1 1 A 15 15 LYS N N 15 123.382 122.832 0.550 1
1 86 . 3 1 1 A 16 16 THR H H 16 8.830 8.493 0.337 1
1 87 . 3 1 1 A 16 16 THR HA H 16 5.212 4.835 0.377 1
1 92 . 3 1 1 A 16 16 THR CA C 16 57.614 60.910 -3.296 1
1 93 . 3 1 1 A 16 16 THR CB C 16 68.210 71.014 -2.804 1
1 95 . 3 1 1 A 16 16 THR N N 16 116.517 116.438 0.079 1
1 96 . 3 1 1 A 17 17 LEU H H 17 9.428 8.733 0.695 1
1 97 . 3 1 1 A 17 17 LEU HA H 17 4.286 4.244 0.042 1
1 107 . 3 1 1 A 17 17 LEU CA C 17 54.504 57.366 -2.862 1
1 108 . 3 1 1 A 17 17 LEU CB C 17 38.564 42.031 -3.467 1
1 112 . 3 1 1 A 17 17 LEU N N 17 121.786 123.364 -1.578 1
1 113 . 3 1 1 A 18 18 THR H H 18 7.546 7.714 -0.168 1
1 114 . 3 1 1 A 18 18 THR HA H 18 4.391 4.389 0.002 1
1 119 . 3 1 1 A 18 18 THR CA C 18 58.524 62.616 -4.092 1
1 120 . 3 1 1 A 18 18 THR CB C 18 66.166 70.578 -4.412 1
1 122 . 3 1 1 A 18 18 THR N N 18 105.598 107.573 -1.975 1
1 123 . 3 1 1 A 19 19 GLY H H 19 7.683 8.012 -0.329 1
1 124 . 3 1 1 A 19 19 GLY HA2 H 19 3.300 3.981 -0.681 1
1 125 . 3 1 1 A 19 19 GLY HA3 H 19 4.248 3.995 0.253 1
1 126 . 3 1 1 A 19 19 GLY CA C 19 42.947 46.035 -3.088 1
1 127 . 3 1 1 A 19 19 GLY N N 19 109.243 112.217 -2.974 1
1 128 . 3 1 1 A 20 20 LYS H H 20 7.375 7.559 -0.184 1
1 129 . 3 1 1 A 20 20 LYS HA H 20 4.331 4.705 -0.374 1
1 138 . 3 1 1 A 20 20 LYS CA C 20 53.829 55.028 -1.199 1
1 139 . 3 1 1 A 20 20 LYS CB C 20 30.385 34.479 -4.094 1
1 143 . 3 1 1 A 20 20 LYS N N 20 122.757 120.471 2.286 1
1 144 . 3 1 1 A 21 21 THR H H 21 8.637 8.888 -0.251 1
1 145 . 3 1 1 A 21 21 THR HA H 21 4.852 4.741 0.111 1
1 150 . 3 1 1 A 21 21 THR CA C 21 59.846 62.779 -2.933 1
1 151 . 3 1 1 A 21 21 THR CB C 21 67.140 69.393 -2.253 1
1 153 . 3 1 1 A 21 21 THR N N 21 121.524 123.402 -1.878 1
1 154 . 3 1 1 A 22 22 ILE H H 22 9.509 9.166 0.343 1
1 155 . 3 1 1 A 22 22 ILE HA H 22 4.349 4.906 -0.557 1
1 165 . 3 1 1 A 22 22 ILE CA C 22 57.634 60.064 -2.430 1
1 166 . 3 1 1 A 22 22 ILE CB C 22 38.334 41.685 -3.351 1
1 170 . 3 1 1 A 22 22 ILE N N 22 129.772 127.872 1.900 1
1 171 . 3 1 1 A 23 23 THR H H 23 8.838 8.864 -0.026 1
1 172 . 3 1 1 A 23 23 THR HA H 23 4.653 4.604 0.049 1
1 177 . 3 1 1 A 23 23 THR CA C 23 60.194 61.653 -1.459 1
1 178 . 3 1 1 A 23 23 THR CB C 23 66.577 69.660 -3.083 1
1 180 . 3 1 1 A 23 23 THR N N 23 124.070 123.785 0.285 1
1 181 . 3 1 1 A 24 24 LEU H H 24 8.749 8.355 0.394 1
1 182 . 3 1 1 A 24 24 LEU HA H 24 4.619 4.832 -0.213 1
1 192 . 3 1 1 A 24 24 LEU CA C 24 50.257 53.288 -3.031 1
1 193 . 3 1 1 A 24 24 LEU CB C 24 42.932 46.125 -3.193 1
1 197 . 3 1 1 A 24 24 LEU N N 24 126.499 126.509 -0.010 1
1 198 . 3 1 1 A 25 25 GLU H H 25 7.990 8.609 -0.619 1
1 199 . 3 1 1 A 25 25 GLU HA H 25 4.591 4.606 -0.015 1
1 204 . 3 1 1 A 25 25 GLU CA C 25 52.845 56.208 -3.363 1
1 205 . 3 1 1 A 25 25 GLU CB C 25 27.210 29.435 -2.225 1
1 207 . 3 1 1 A 25 25 GLU N N 25 121.644 124.303 -2.659 1
1 208 . 3 1 1 A 26 26 VAL H H 26 8.657 8.421 0.236 1
1 209 . 3 1 1 A 26 26 VAL HA H 26 4.403 5.121 -0.718 1
1 217 . 3 1 1 A 26 26 VAL CA C 26 56.020 59.076 -3.056 1
1 218 . 3 1 1 A 26 26 VAL CB C 26 33.631 36.005 -2.374 1
1 221 . 3 1 1 A 26 26 VAL N N 26 116.647 117.666 -1.019 1
1 222 . 3 1 1 A 27 27 GLU H H 27 7.970 8.443 -0.473 1
1 223 . 3 1 1 A 27 27 GLU HA H 27 4.447 4.365 0.082 1
1 228 . 3 1 1 A 27 27 GLU CA C 27 51.386 54.587 -3.201 1
1 229 . 3 1 1 A 27 27 GLU CB C 27 30.905 31.877 -0.972 1
1 231 . 3 1 1 A 27 27 GLU N N 27 115.496 121.095 -5.599 1
1 232 . 3 1 1 A 28 28 SER H H 28 9.192 8.679 0.513 1
1 233 . 3 1 1 A 28 28 SER HA H 28 4.108 4.176 -0.068 1
1 236 . 3 1 1 A 28 28 SER CA C 28 59.909 60.559 -0.650 1
1 237 . 3 1 1 A 28 28 SER CB C 28 60.399 62.904 -2.505 1
1 238 . 3 1 1 A 28 28 SER N N 28 117.720 118.606 -0.886 1
1 239 . 3 1 1 A 29 29 SER H H 29 7.371 7.698 -0.327 1
1 240 . 3 1 1 A 29 29 SER HA H 29 4.327 4.478 -0.151 1
1 243 . 3 1 1 A 29 29 SER CA C 29 54.805 57.308 -2.503 1
1 244 . 3 1 1 A 29 29 SER CB C 29 60.775 64.548 -3.773 1
1 245 . 3 1 1 A 29 29 SER N N 29 108.936 112.393 -3.457 1
1 246 . 3 1 1 A 30 30 ASP H H 30 7.852 7.395 0.457 1
1 247 . 3 1 1 A 30 30 ASP HA H 30 4.591 4.475 0.116 1
1 250 . 3 1 1 A 30 30 ASP CA C 30 53.040 55.037 -1.997 1
1 251 . 3 1 1 A 30 30 ASP CB C 30 37.942 41.138 -3.196 1
1 252 . 3 1 1 A 30 30 ASP N N 30 123.735 124.129 -0.394 1
1 253 . 3 1 1 A 31 31 THR H H 31 7.852 8.427 -0.575 1
1 254 . 3 1 1 A 31 31 THR HA H 31 4.918 4.412 0.506 1
1 259 . 3 1 1 A 31 31 THR CA C 31 56.929 61.936 -5.007 1
1 260 . 3 1 1 A 31 31 THR CB C 31 68.674 70.452 -1.778 1
1 262 . 3 1 1 A 31 31 THR N N 31 109.181 116.543 -7.362 1
1 263 . 3 1 1 A 32 32 ILE H H 32 8.582 8.905 -0.323 1
1 264 . 3 1 1 A 32 32 ILE HA H 32 3.624 3.774 -0.150 1
1 274 . 3 1 1 A 32 32 ILE CA C 32 59.474 65.158 -5.684 1
1 275 . 3 1 1 A 32 32 ILE CB C 32 31.561 37.485 -5.924 1
1 279 . 3 1 1 A 32 32 ILE N N 32 121.833 122.916 -1.083 1
1 280 . 3 1 1 A 33 33 ASP H H 33 9.255 8.121 1.134 1
1 281 . 3 1 1 A 33 33 ASP HA H 33 4.201 4.307 -0.106 1
1 284 . 3 1 1 A 33 33 ASP CA C 33 54.679 57.888 -3.209 1
1 285 . 3 1 1 A 33 33 ASP CB C 33 37.700 41.488 -3.788 1
1 286 . 3 1 1 A 33 33 ASP N N 33 119.823 120.606 -0.783 1
1 287 . 3 1 1 A 34 34 ASN H H 34 8.026 7.677 0.349 1
1 288 . 3 1 1 A 34 34 ASN HA H 34 4.409 4.487 -0.078 1
1 291 . 3 1 1 A 34 34 ASN CA C 34 53.324 56.218 -2.894 1
1 292 . 3 1 1 A 34 34 ASN CB C 34 35.782 38.029 -2.247 1
1 293 . 3 1 1 A 34 34 ASN N N 34 119.540 117.040 2.500 1
1 294 . 3 1 1 A 35 35 VAL H H 35 8.167 8.059 0.108 1
1 295 . 3 1 1 A 35 35 VAL HA H 35 3.249 3.458 -0.209 1
1 303 . 3 1 1 A 35 35 VAL CA C 35 65.308 67.343 -2.035 1
1 304 . 3 1 1 A 35 35 VAL CB C 35 27.965 31.497 -3.532 1
1 307 . 3 1 1 A 35 35 VAL N N 35 122.223 120.607 1.616 1
1 308 . 3 1 1 A 36 36 LYS H H 36 8.460 8.450 0.010 1
1 313 . 3 1 1 A 36 36 LYS CB C 36 30.753 32.246 -1.493 1
1 315 . 3 1 1 A 36 36 LYS N N 36 119.438 119.298 0.140 1
1 316 . 3 1 1 A 37 37 SER H H 37 8.196 8.179 0.017 1
1 317 . 3 1 1 A 37 37 SER HA H 37 4.130 4.062 0.068 1
1 320 . 3 1 1 A 37 37 SER CA C 37 58.528 61.724 -3.196 1
1 321 . 3 1 1 A 37 37 SER CB C 37 59.768 63.012 -3.244 1
1 322 . 3 1 1 A 37 37 SER N N 37 117.791 114.263 3.528 1
1 323 . 3 1 1 A 38 38 LYS H H 38 8.043 8.309 -0.266 1
1 324 . 3 1 1 A 38 38 LYS HA H 38 4.095 3.970 0.125 1
1 325 . 3 1 1 A 38 38 LYS CA C 38 57.377 59.230 -1.853 1
1 326 . 3 1 1 A 38 38 LYS N N 38 124.094 121.179 2.915 1
1 327 . 3 1 1 A 39 39 ILE H H 39 8.254 8.223 0.031 1
1 328 . 3 1 1 A 39 39 ILE HA H 39 3.439 3.802 -0.363 1
1 338 . 3 1 1 A 39 39 ILE CA C 39 63.977 64.553 -0.576 1
1 339 . 3 1 1 A 39 39 ILE CB C 39 33.935 37.329 -3.394 1
1 343 . 3 1 1 A 39 39 ILE N N 39 122.107 120.753 1.354 1
1 344 . 3 1 1 A 40 40 GLN H H 40 8.379 8.471 -0.092 1
1 345 . 3 1 1 A 40 40 GLN HA H 40 3.746 4.173 -0.427 1
1 350 . 3 1 1 A 40 40 GLN CA C 40 57.472 58.230 -0.758 1
1 351 . 3 1 1 A 40 40 GLN CB C 40 25.072 27.784 -2.712 1
1 353 . 3 1 1 A 40 40 GLN N N 40 123.725 119.498 4.227 1
1 354 . 3 1 1 A 41 41 ASP H H 41 8.210 7.918 0.292 1
1 355 . 3 1 1 A 41 41 ASP HA H 41 4.247 4.401 -0.154 1
1 358 . 3 1 1 A 41 41 ASP CA C 41 54.646 56.671 -2.025 1
1 359 . 3 1 1 A 41 41 ASP CB C 41 38.136 40.915 -2.779 1
1 360 . 3 1 1 A 41 41 ASP N N 41 120.564 120.655 -0.091 1
1 361 . 3 1 1 A 42 42 LYS H H 42 7.381 8.039 -0.658 1
1 362 . 3 1 1 A 42 42 LYS HA H 42 4.246 4.330 -0.084 1
1 369 . 3 1 1 A 42 42 LYS CA C 42 55.579 57.682 -2.103 1
1 370 . 3 1 1 A 42 42 LYS CB C 42 31.406 33.502 -2.096 1
1 373 . 3 1 1 A 42 42 LYS N N 42 115.674 116.488 -0.814 1
1 374 . 3 1 1 A 43 43 GLU H H 43 8.537 8.722 -0.185 1
1 375 . 3 1 1 A 43 43 GLU HA H 43 4.522 4.527 -0.005 1
1 380 . 3 1 1 A 43 43 GLU CA C 43 52.772 55.712 -2.940 1
1 381 . 3 1 1 A 43 43 GLU CB C 43 30.535 30.930 -0.395 1
1 383 . 3 1 1 A 43 43 GLU N N 43 114.355 116.170 -1.815 1
1 384 . 3 1 1 A 44 44 GLY H H 44 8.611 8.479 0.132 1
1 385 . 3 1 1 A 44 44 GLY HA2 H 44 4.067 3.972 0.095 1
1 386 . 3 1 1 A 44 44 GLY HA3 H 44 3.819 3.973 -0.154 1
1 387 . 3 1 1 A 44 44 GLY CA C 44 43.205 45.622 -2.417 1
1 388 . 3 1 1 A 44 44 GLY N N 44 109.406 108.621 0.785 1
1 389 . 3 1 1 A 45 45 ILE H H 45 6.092 8.246 -2.154 1
1 390 . 3 1 1 A 45 45 ILE HA H 45 4.324 4.112 0.212 1
1 400 . 3 1 1 A 45 45 ILE CA C 45 55.211 60.225 -5.014 1
1 401 . 3 1 1 A 45 45 ILE CB C 45 37.903 38.291 -0.388 1
1 405 . 3 1 1 A 45 45 ILE N N 45 120.791 122.459 -1.668 1
1 406 . 3 1 1 A 46 46 PRO HA H 46 4.547 4.573 -0.026 1
1 413 . 3 1 1 A 46 46 PRO CA C 46 58.971 61.945 -2.974 1
1 414 . 3 1 1 A 46 46 PRO CB C 46 29.142 32.346 -3.204 1
1 417 . 3 1 1 A 47 47 PRO HA H 47 4.062 4.115 -0.053 1
1 424 . 3 1 1 A 47 47 PRO CA C 47 63.476 66.085 -2.609 1
1 425 . 3 1 1 A 47 47 PRO CB C 47 30.113 32.368 -2.255 1
1 428 . 3 1 1 A 48 48 ASP H H 48 8.418 8.562 -0.144 1
1 429 . 3 1 1 A 48 48 ASP HA H 48 4.346 4.455 -0.109 1
1 432 . 3 1 1 A 48 48 ASP CA C 48 52.838 55.747 -2.909 1
1 433 . 3 1 1 A 48 48 ASP CB C 48 36.926 40.028 -3.102 1
1 434 . 3 1 1 A 48 48 ASP N N 48 113.462 115.379 -1.917 1
1 435 . 3 1 1 A 49 49 GLN H H 49 7.822 8.252 -0.430 1
1 436 . 3 1 1 A 49 49 GLN HA H 49 4.283 4.406 -0.123 1
1 439 . 3 1 1 A 49 49 GLN CA C 49 52.770 57.003 -4.233 1
1 441 . 3 1 1 A 49 49 GLN N N 49 117.377 119.186 -1.809 1
1 442 . 3 1 1 A 50 50 GLN H H 50 7.451 7.261 0.190 1
1 443 . 3 1 1 A 50 50 GLN HA H 50 4.260 5.161 -0.901 1
1 448 . 3 1 1 A 50 50 GLN CA C 50 53.725 54.406 -0.681 1
1 449 . 3 1 1 A 50 50 GLN CB C 50 29.142 31.309 -2.167 1
1 451 . 3 1 1 A 50 50 GLN N N 50 117.526 116.872 0.654 1
1 452 . 3 1 1 A 51 51 ARG H H 51 8.534 8.889 -0.355 1
1 453 . 3 1 1 A 51 51 ARG HA H 51 4.486 5.197 -0.711 1
1 460 . 3 1 1 A 51 51 ARG CA C 51 52.492 54.334 -1.842 1
1 461 . 3 1 1 A 51 51 ARG CB C 51 29.096 34.083 -4.987 1
1 464 . 3 1 1 A 51 51 ARG N N 51 121.655 120.348 1.307 1
1 465 . 3 1 1 A 52 52 LEU H H 52 8.683 8.912 -0.229 1
1 466 . 3 1 1 A 52 52 LEU HA H 52 5.255 4.995 0.260 1
1 476 . 3 1 1 A 52 52 LEU CA C 52 50.618 53.785 -3.167 1
1 477 . 3 1 1 A 52 52 LEU CB C 52 43.007 43.269 -0.262 1
1 481 . 3 1 1 A 52 52 LEU N N 52 122.929 122.022 0.907 1
1 482 . 3 1 1 A 53 53 ILE H H 53 9.286 8.959 0.327 1
1 483 . 3 1 1 A 53 53 ILE HA H 53 5.096 4.981 0.115 1
1 492 . 3 1 1 A 53 53 ILE CA C 53 56.795 60.445 -3.650 1
1 496 . 3 1 1 A 53 53 ILE N N 53 124.718 125.575 -0.857 1
1 497 . 3 1 1 A 54 54 TRP H H 54 8.871 9.074 -0.203 1
1 499 . 3 1 1 A 54 54 TRP N N 54 127.412 128.128 -0.716 1
1 501 . 3 1 1 A 55 55 ALA H H 55 8.401 8.376 0.025 1
1 502 . 3 1 1 A 55 55 ALA HA H 55 3.183 3.621 -0.438 1
1 506 . 3 1 1 A 55 55 ALA CA C 55 49.712 52.892 -3.180 1
1 507 . 3 1 1 A 55 55 ALA CB C 55 13.252 17.708 -4.456 1
1 508 . 3 1 1 A 55 55 ALA N N 55 128.894 130.261 -1.367 1
1 509 . 3 1 1 A 56 56 GLY H H 56 8.248 8.436 -0.188 1
1 510 . 3 1 1 A 56 56 GLY HA2 H 56 3.968 3.779 0.189 1
1 511 . 3 1 1 A 56 56 GLY HA3 H 56 3.916 3.795 0.121 1
1 512 . 3 1 1 A 56 56 GLY CA C 56 43.142 45.538 -2.396 1
1 513 . 3 1 1 A 56 56 GLY N N 56 101.499 102.620 -1.121 1
1 514 . 3 1 1 A 57 57 LYS H H 57 8.028 7.884 0.144 1
1 515 . 3 1 1 A 57 57 LYS HA H 57 4.609 4.705 -0.096 1
1 522 . 3 1 1 A 57 57 LYS CA C 57 51.928 54.467 -2.539 1
1 523 . 3 1 1 A 57 57 LYS CB C 57 32.613 34.922 -2.309 1
1 526 . 3 1 1 A 57 57 LYS N N 57 118.995 120.837 -1.842 1
1 527 . 3 1 1 A 58 58 GLN H H 58 8.607 8.665 -0.058 1
1 528 . 3 1 1 A 58 58 GLN HA H 58 4.617 4.714 -0.097 1
1 533 . 3 1 1 A 58 58 GLN CA C 58 53.261 55.661 -2.400 1
1 534 . 3 1 1 A 58 58 GLN CB C 58 26.613 29.516 -2.903 1
1 536 . 3 1 1 A 58 58 GLN N N 58 119.825 123.537 -3.712 1
1 537 . 3 1 1 A 59 59 LEU H H 59 8.653 9.610 -0.957 1
1 538 . 3 1 1 A 59 59 LEU HA H 59 4.138 4.923 -0.785 1
1 548 . 3 1 1 A 59 59 LEU CA C 59 51.991 53.635 -1.644 1
1 549 . 3 1 1 A 59 59 LEU CB C 59 39.006 43.717 -4.711 1
1 553 . 3 1 1 A 59 59 LEU N N 59 125.484 127.675 -2.191 1
1 554 . 3 1 1 A 60 60 GLU H H 60 8.461 8.697 -0.236 1
1 555 . 3 1 1 A 60 60 GLU HA H 60 4.371 4.720 -0.349 1
1 559 . 3 1 1 A 60 60 GLU CA C 60 53.436 54.211 -0.775 1
1 560 . 3 1 1 A 60 60 GLU CB C 60 29.057 32.283 -3.226 1
1 562 . 3 1 1 A 60 60 GLU N N 60 123.237 121.332 1.905 1
1 563 . 3 1 1 A 61 61 ASP H H 61 8.076 9.120 -1.044 1
1 564 . 3 1 1 A 61 61 ASP HA H 61 4.265 4.359 -0.094 1
1 567 . 3 1 1 A 61 61 ASP CA C 61 54.398 56.704 -2.306 1
1 568 . 3 1 1 A 61 61 ASP CB C 61 38.340 39.932 -1.592 1
1 569 . 3 1 1 A 61 61 ASP N N 61 120.701 121.692 -0.991 1
1 570 . 3 1 1 A 62 62 GLY HA2 H 62 4.104 3.981 0.123 1
1 571 . 3 1 1 A 62 62 GLY HA3 H 62 3.832 3.985 -0.153 1
1 572 . 3 1 1 A 62 62 GLY CA C 62 42.576 46.292 -3.716 1
1 573 . 3 1 1 A 63 63 ARG H H 63 7.319 8.055 -0.736 1
1 574 . 3 1 1 A 63 63 ARG HA H 63 4.595 4.579 0.016 1
1 579 . 3 1 1 A 63 63 ARG CA C 63 51.971 55.687 -3.716 1
1 582 . 3 1 1 A 63 63 ARG N N 63 119.206 121.175 -1.969 1
1 583 . 3 1 1 A 64 64 THR H H 64 8.735 8.571 0.164 1
1 584 . 3 1 1 A 64 64 THR HA H 64 5.208 4.994 0.214 1
1 589 . 3 1 1 A 64 64 THR CA C 64 57.126 59.508 -2.382 1
1 590 . 3 1 1 A 64 64 THR CB C 64 69.885 71.821 -1.936 1
1 592 . 3 1 1 A 64 64 THR N N 64 108.713 116.449 -7.736 1
1 593 . 3 1 1 A 65 65 LEU H H 65 8.241 8.579 -0.338 1
1 594 . 3 1 1 A 65 65 LEU HA H 65 4.003 3.953 0.050 1
1 604 . 3 1 1 A 65 65 LEU CA C 65 56.409 58.127 -1.718 1
1 605 . 3 1 1 A 65 65 LEU CB C 65 37.179 41.233 -4.054 1
1 609 . 3 1 1 A 65 65 LEU N N 65 118.111 122.605 -4.494 1
1 610 . 3 1 1 A 66 66 SER H H 66 8.296 8.030 0.266 1
1 611 . 3 1 1 A 66 66 SER HA H 66 4.201 4.285 -0.084 1
1 614 . 3 1 1 A 66 66 SER CA C 66 58.454 60.668 -2.214 1
1 615 . 3 1 1 A 66 66 SER CB C 66 59.969 62.935 -2.966 1
1 616 . 3 1 1 A 66 66 SER N N 66 113.148 114.133 -0.985 1
1 617 . 3 1 1 A 67 67 ASP H H 67 7.984 8.375 -0.391 1
1 618 . 3 1 1 A 67 67 ASP HA H 67 4.187 4.254 -0.067 1
1 621 . 3 1 1 A 67 67 ASP CA C 67 54.744 57.142 -2.398 1
1 622 . 3 1 1 A 67 67 ASP CB C 67 37.794 41.370 -3.576 1
1 623 . 3 1 1 A 67 67 ASP N N 67 124.130 121.438 2.692 1
1 624 . 3 1 1 A 68 68 TYR H H 68 7.177 7.316 -0.139 1
1 625 . 3 1 1 A 68 68 TYR N N 68 115.334 113.970 1.364 1
1 626 . 3 1 1 A 69 69 ASN H H 69 8.111 7.815 0.296 1
1 627 . 3 1 1 A 69 69 ASN HA H 69 4.253 4.329 -0.076 1
1 630 . 3 1 1 A 69 69 ASN CA C 69 51.386 53.924 -2.538 1
1 631 . 3 1 1 A 69 69 ASN CB C 69 34.867 36.986 -2.119 1
1 632 . 3 1 1 A 69 69 ASN N N 69 116.867 117.824 -0.957 1
1 633 . 3 1 1 A 70 70 ILE H H 70 7.460 7.549 -0.089 1
1 634 . 3 1 1 A 70 70 ILE HA H 70 3.210 4.132 -0.922 1
1 644 . 3 1 1 A 70 70 ILE CA C 70 60.157 60.091 0.066 1
1 645 . 3 1 1 A 70 70 ILE CB C 70 34.754 38.737 -3.983 1
1 649 . 3 1 1 A 70 70 ILE N N 70 119.821 118.929 0.892 1
1 650 . 3 1 1 A 71 71 GLN H H 71 7.368 8.576 -1.208 1
1 651 . 3 1 1 A 71 71 GLN HA H 71 4.099 4.649 -0.550 1
1 656 . 3 1 1 A 71 71 GLN CA C 71 50.906 53.819 -2.913 1
1 657 . 3 1 1 A 71 71 GLN CB C 71 28.793 31.262 -2.469 1
1 659 . 3 1 1 A 71 71 GLN N N 71 124.287 125.411 -1.124 1
1 660 . 3 1 1 A 72 72 ARG H H 72 7.583 9.095 -1.512 1
1 661 . 3 1 1 A 72 72 ARG HA H 72 3.907 4.156 -0.249 1
1 668 . 3 1 1 A 72 72 ARG CA C 72 54.527 59.274 -4.747 1
1 669 . 3 1 1 A 72 72 ARG CB C 72 27.470 30.083 -2.613 1
1 672 . 3 1 1 A 72 72 ARG N N 72 119.007 121.594 -2.587 1
1 673 . 3 1 1 A 73 73 GLU H H 73 9.262 8.478 0.784 1
1 674 . 3 1 1 A 73 73 GLU HA H 73 3.586 4.404 -0.818 1
1 679 . 3 1 1 A 73 73 GLU CA C 73 55.703 56.650 -0.947 1
1 680 . 3 1 1 A 73 73 GLU CB C 73 23.669 29.250 -5.581 1
1 682 . 3 1 1 A 73 73 GLU N N 73 115.180 117.117 -1.937 1
1 683 . 3 1 1 A 74 74 SER H H 74 7.551 8.135 -0.584 1
1 684 . 3 1 1 A 74 74 SER HA H 74 4.613 5.295 -0.682 1
1 687 . 3 1 1 A 74 74 SER CA C 74 58.305 55.925 2.380 1
1 688 . 3 1 1 A 74 74 SER CB C 74 62.156 66.437 -4.281 1
1 689 . 3 1 1 A 74 74 SER N N 74 115.104 114.103 1.001 1
1 690 . 3 1 1 A 75 75 THR H H 75 8.785 8.952 -0.167 1
1 691 . 3 1 1 A 75 75 THR HA H 75 5.014 4.993 0.021 1
1 696 . 3 1 1 A 75 75 THR CA C 75 59.835 62.151 -2.316 1
1 697 . 3 1 1 A 75 75 THR CB C 75 67.258 69.405 -2.147 1
1 699 . 3 1 1 A 75 75 THR N N 75 118.401 116.748 1.653 1
1 700 . 3 1 1 A 76 76 LEU H H 76 9.447 10.025 -0.578 1
1 701 . 3 1 1 A 76 76 LEU HA H 76 4.930 5.059 -0.129 1
1 711 . 3 1 1 A 76 76 LEU CA C 76 51.107 54.152 -3.045 1
1 712 . 3 1 1 A 76 76 LEU CB C 76 40.841 43.735 -2.894 1
1 716 . 3 1 1 A 76 76 LEU N N 76 127.905 128.186 -0.281 1
1 717 . 3 1 1 A 77 77 HIS HA H 77 4.976 5.084 -0.108 1
1 720 . 3 1 1 A 77 77 HIS CA C 77 53.776 54.453 -0.677 1
1 721 . 3 1 1 A 77 77 HIS CB C 77 28.438 31.232 -2.794 1
1 722 . 3 1 1 A 78 78 LEU H H 78 8.450 8.979 -0.529 1
1 723 . 3 1 1 A 78 78 LEU HA H 78 5.085 5.002 0.083 1
1 733 . 3 1 1 A 78 78 LEU CA C 78 50.896 53.746 -2.850 1
1 734 . 3 1 1 A 78 78 LEU CB C 78 41.916 44.873 -2.957 1
1 738 . 3 1 1 A 78 78 LEU N N 78 126.178 128.374 -2.196 1
1 739 . 3 1 1 A 79 79 VAL H H 79 9.093 9.607 -0.514 1
1 740 . 3 1 1 A 79 79 VAL HA H 79 4.053 4.666 -0.613 1
1 748 . 3 1 1 A 79 79 VAL CA C 79 59.054 61.009 -1.955 1
1 749 . 3 1 1 A 79 79 VAL CB C 79 32.115 34.065 -1.950 1
1 752 . 3 1 1 A 79 79 VAL N N 79 128.372 125.724 2.648 1
1 753 . 3 1 1 A 80 80 LEU H H 80 8.000 8.806 -0.806 1
1 754 . 3 1 1 A 80 80 LEU HA H 80 5.105 4.977 0.128 1
1 764 . 3 1 1 A 80 80 LEU CA C 80 50.556 53.424 -2.868 1
1 765 . 3 1 1 A 80 80 LEU CB C 80 39.597 44.817 -5.220 1
1 769 . 3 1 1 A 80 80 LEU N N 80 126.145 128.586 -2.441 1
1 770 . 3 1 1 A 81 81 ARG H H 81 8.470 8.633 -0.163 1
1 771 . 3 1 1 A 81 81 ARG HA H 81 4.197 4.413 -0.216 1
1 778 . 3 1 1 A 81 81 ARG CA C 81 53.133 56.490 -3.357 1
1 779 . 3 1 1 A 81 81 ARG CB C 81 28.413 31.518 -3.105 1
1 782 . 3 1 1 A 81 81 ARG N N 81 121.625 126.910 -5.285 1
1 783 . 3 1 1 A 82 82 LEU H H 82 8.454 8.456 -0.002 1
1 784 . 3 1 1 A 82 82 LEU HA H 82 4.339 4.885 -0.546 1
1 794 . 3 1 1 A 82 82 LEU CA C 82 52.081 53.723 -1.642 1
1 795 . 3 1 1 A 82 82 LEU CB C 82 39.810 43.587 -3.777 1
1 799 . 3 1 1 A 82 82 LEU N N 82 123.832 121.786 2.046 1
1 800 . 3 1 1 A 83 83 ARG H H 83 8.404 8.932 -0.528 1
1 801 . 3 1 1 A 83 83 ARG HA H 83 4.308 4.143 0.165 1
1 808 . 3 1 1 A 83 83 ARG CA C 83 53.258 57.503 -4.245 1
1 809 . 3 1 1 A 83 83 ARG CB C 83 28.160 31.182 -3.022 1
1 812 . 3 1 1 A 83 83 ARG N N 83 121.447 127.518 -6.071 1
1 813 . 3 1 1 A 84 84 GLY H H 84 8.410 7.514 0.896 1
1 814 . 3 1 1 A 84 84 GLY HA2 H 84 3.929 4.089 -0.160 1
1 815 . 3 1 1 A 84 84 GLY HA3 H 84 3.929 4.089 -0.160 1
1 816 . 3 1 1 A 84 84 GLY CA C 84 42.751 45.354 -2.603 1
1 817 . 3 1 1 A 84 84 GLY N N 84 110.030 106.723 3.307 1
1 818 . 3 1 1 A 85 85 GLY H H 85 8.295 8.093 0.202 1
1 819 . 3 1 1 A 85 85 GLY HA2 H 85 3.950 4.185 -0.235 1
1 820 . 3 1 1 A 85 85 GLY HA3 H 85 3.950 4.186 -0.236 1
1 821 . 3 1 1 A 85 85 GLY CA C 85 42.831 45.741 -2.910 1
1 822 . 3 1 1 A 85 85 GLY N N 85 108.838 111.294 -2.456 1
1 823 . 3 1 1 A 86 86 SER H H 86 8.292 8.846 -0.554 1
1 824 . 3 1 1 A 86 86 SER HA H 86 4.405 4.216 0.189 1
1 827 . 3 1 1 A 86 86 SER CA C 86 55.965 59.026 -3.061 1
1 828 . 3 1 1 A 86 86 SER CB C 86 61.232 60.967 0.265 1
1 829 . 3 1 1 A 86 86 SER N N 86 116.028 120.999 -4.971 1
1 830 . 3 1 1 A 87 87 MET H H 87 8.470 8.155 0.315 1
1 831 . 3 1 1 A 87 87 MET HA H 87 4.447 4.245 0.202 1
1 836 . 3 1 1 A 87 87 MET CA C 87 53.281 57.579 -4.298 1
1 837 . 3 1 1 A 87 87 MET CB C 87 29.788 32.583 -2.795 1
1 839 . 3 1 1 A 87 87 MET N N 87 121.625 120.349 1.276 1
1 840 . 3 1 1 A 88 88 GLY H H 88 8.320 7.949 0.371 1
1 841 . 3 1 1 A 88 88 GLY HA2 H 88 3.919 3.678 0.241 1
1 842 . 3 1 1 A 88 88 GLY HA3 H 88 3.896 3.678 0.218 1
1 843 . 3 1 1 A 88 88 GLY CA C 88 43.060 46.535 -3.475 1
1 844 . 3 1 1 A 88 88 GLY N N 88 109.625 108.042 1.583 1
1 845 . 3 1 1 A 89 89 GLY H H 89 8.256 8.368 -0.112 1
1 846 . 3 1 1 A 89 89 GLY HA2 H 89 3.940 4.235 -0.295 1
1 847 . 3 1 1 A 89 89 GLY HA3 H 89 3.910 4.236 -0.326 1
1 848 . 3 1 1 A 89 89 GLY CA C 89 42.678 46.061 -3.383 1
1 849 . 3 1 1 A 89 89 GLY N N 89 108.982 110.903 -1.921 1
1 850 . 3 1 1 A 90 90 ALA H H 90 8.203 8.642 -0.439 1
1 851 . 3 1 1 A 90 90 ALA HA H 90 4.255 4.199 0.056 1
1 855 . 3 1 1 A 90 90 ALA CA C 90 50.763 54.505 -3.742 1
1 856 . 3 1 1 A 90 90 ALA CB C 90 16.364 19.165 -2.801 1
1 857 . 3 1 1 A 90 90 ALA N N 90 124.065 122.391 1.674 1
1 858 . 3 1 1 A 91 91 ALA H H 91 8.273 7.769 0.504 1
1 859 . 3 1 1 A 91 91 ALA HA H 91 4.204 4.546 -0.342 1
1 863 . 3 1 1 A 91 91 ALA CA C 91 51.080 50.910 0.170 1
1 864 . 3 1 1 A 91 91 ALA CB C 91 16.036 19.122 -3.086 1
1 865 . 3 1 1 A 91 91 ALA N N 91 121.985 120.111 1.874 1
1 866 . 3 1 1 A 92 92 ASP H H 92 8.022 8.650 -0.628 1
1 867 . 3 1 1 A 92 92 ASP HA H 92 4.455 4.696 -0.241 1
1 870 . 3 1 1 A 92 92 ASP CA C 92 52.664 54.647 -1.983 1
1 871 . 3 1 1 A 92 92 ASP CB C 92 37.925 41.146 -3.221 1
1 872 . 3 1 1 A 92 92 ASP N N 92 118.621 124.154 -5.533 1
1 873 . 3 1 1 A 93 93 GLU H H 93 8.282 8.180 0.102 1
1 874 . 3 1 1 A 93 93 GLU HA H 93 3.912 4.666 -0.754 1
1 879 . 3 1 1 A 93 93 GLU CA C 93 56.947 57.702 -0.755 1
1 880 . 3 1 1 A 93 93 GLU CB C 93 27.413 32.404 -4.991 1
1 882 . 3 1 1 A 93 93 GLU N N 93 122.247 119.386 2.861 1
1 883 . 3 1 1 A 94 94 GLU H H 94 8.194 8.272 -0.078 1
1 884 . 3 1 1 A 94 94 GLU HA H 94 3.940 4.528 -0.588 1
1 889 . 3 1 1 A 94 94 GLU CA C 94 56.681 57.879 -1.198 1
1 890 . 3 1 1 A 94 94 GLU CB C 94 26.127 31.308 -5.181 1
1 892 . 3 1 1 A 94 94 GLU N N 94 118.024 119.224 -1.200 1
1 893 . 3 1 1 A 95 95 GLU H H 95 7.816 8.245 -0.429 1
1 894 . 3 1 1 A 95 95 GLU HA H 95 4.121 4.157 -0.036 1
1 898 . 3 1 1 A 95 95 GLU CA C 95 56.162 58.675 -2.513 1
1 899 . 3 1 1 A 95 95 GLU CB C 95 26.403 28.220 -1.817 1
1 901 . 3 1 1 A 95 95 GLU N N 95 120.028 117.656 2.372 1
1 902 . 3 1 1 A 96 96 LEU H H 96 7.637 7.760 -0.123 1
1 903 . 3 1 1 A 96 96 LEU HA H 96 3.988 4.115 -0.127 1
1 913 . 3 1 1 A 96 96 LEU CA C 96 55.303 57.144 -1.841 1
1 914 . 3 1 1 A 96 96 LEU CB C 96 39.038 41.343 -2.305 1
1 918 . 3 1 1 A 96 96 LEU N N 96 119.866 118.213 1.653 1
1 919 . 3 1 1 A 97 97 ILE H H 97 8.044 7.822 0.222 1
1 920 . 3 1 1 A 97 97 ILE HA H 97 3.478 3.991 -0.513 1
1 930 . 3 1 1 A 97 97 ILE CA C 97 62.054 63.655 -1.601 1
1 931 . 3 1 1 A 97 97 ILE CB C 97 34.541 38.078 -3.537 1
1 935 . 3 1 1 A 97 97 ILE N N 97 119.088 119.357 -0.269 1
1 936 . 3 1 1 A 98 98 ARG H H 98 7.991 8.355 -0.364 1
1 937 . 3 1 1 A 98 98 ARG HA H 98 3.793 4.034 -0.241 1
1 944 . 3 1 1 A 98 98 ARG CA C 98 57.509 58.873 -1.364 1
1 945 . 3 1 1 A 98 98 ARG CB C 98 27.191 30.035 -2.844 1
1 948 . 3 1 1 A 98 98 ARG N N 98 119.225 120.725 -1.500 1
1 949 . 3 1 1 A 99 99 LYS H H 99 8.101 7.702 0.399 1
1 950 . 3 1 1 A 99 99 LYS HA H 99 3.968 4.070 -0.102 1
1 959 . 3 1 1 A 99 99 LYS CA C 99 56.455 59.090 -2.635 1
1 960 . 3 1 1 A 99 99 LYS CB C 99 29.531 32.038 -2.507 1
1 964 . 3 1 1 A 99 99 LYS N N 99 119.464 118.459 1.005 1
1 965 . 3 1 1 A 100 100 ALA H H 100 8.167 8.026 0.141 1
1 966 . 3 1 1 A 100 100 ALA HA H 100 3.789 4.115 -0.326 1
1 970 . 3 1 1 A 100 100 ALA CA C 100 52.451 54.511 -2.060 1
1 971 . 3 1 1 A 100 100 ALA CB C 100 16.259 18.211 -1.952 1
1 972 . 3 1 1 A 100 100 ALA N N 100 122.398 121.432 0.966 1
1 973 . 3 1 1 A 101 101 ILE H H 101 8.777 7.762 1.015 1
1 974 . 3 1 1 A 101 101 ILE HA H 101 3.191 3.746 -0.555 1
1 984 . 3 1 1 A 101 101 ILE CA C 101 62.910 64.475 -1.565 1
1 985 . 3 1 1 A 101 101 ILE CB C 101 34.544 37.450 -2.906 1
1 989 . 3 1 1 A 101 101 ILE N N 101 120.431 117.796 2.635 1
1 990 . 3 1 1 A 102 102 GLU H H 102 7.890 7.625 0.265 1
1 991 . 3 1 1 A 102 102 GLU HA H 102 3.848 4.180 -0.332 1
1 996 . 3 1 1 A 102 102 GLU CA C 102 57.079 57.821 -0.742 1
1 997 . 3 1 1 A 102 102 GLU CB C 102 26.769 30.083 -3.314 1
1 999 . 3 1 1 A 102 102 GLU N N 102 120.248 120.163 0.085 1
1 1000 . 3 1 1 A 103 103 LEU H H 103 8.194 7.551 0.643 1
1 1001 . 3 1 1 A 103 103 LEU HA H 103 3.912 4.301 -0.389 1
1 1011 . 3 1 1 A 103 103 LEU CA C 103 55.078 56.187 -1.109 1
1 1012 . 3 1 1 A 103 103 LEU CB C 103 38.963 42.483 -3.520 1
1 1016 . 3 1 1 A 103 103 LEU N N 103 120.341 116.993 3.348 1
1 1017 . 3 1 1 A 104 104 SER H H 104 8.268 7.926 0.342 1
1 1018 . 3 1 1 A 104 104 SER HA H 104 4.120 4.362 -0.242 1
1 1021 . 3 1 1 A 104 104 SER CA C 104 58.301 59.501 -1.200 1
1 1022 . 3 1 1 A 104 104 SER CB C 104 60.193 63.778 -3.585 1
1 1023 . 3 1 1 A 104 104 SER N N 104 115.150 113.455 1.695 1
1 1024 . 3 1 1 A 105 105 LEU H H 105 7.501 7.555 -0.054 1
1 1025 . 3 1 1 A 105 105 LEU HA H 105 4.041 3.924 0.117 1
1 1035 . 3 1 1 A 105 105 LEU CA C 105 53.995 56.722 -2.727 1
1 1036 . 3 1 1 A 105 105 LEU CB C 105 39.597 41.757 -2.160 1
1 1040 . 3 1 1 A 105 105 LEU N N 105 124.223 119.751 4.472 1
1 1041 . 3 1 1 A 106 106 LYS H H 106 7.542 8.014 -0.472 1
1 1042 . 3 1 1 A 106 106 LYS HA H 106 4.090 3.994 0.096 1
1 1050 . 3 1 1 A 106 106 LYS CA C 106 55.495 58.660 -3.165 1
1 1051 . 3 1 1 A 106 106 LYS CB C 106 29.941 31.948 -2.007 1
1 1055 . 3 1 1 A 106 106 LYS N N 106 120.328 118.399 1.929 1
1 1056 . 3 1 1 A 107 107 GLU H H 107 7.884 8.223 -0.339 1
1 1057 . 3 1 1 A 107 107 GLU HA H 107 4.210 4.162 0.048 1
1 1060 . 3 1 1 A 107 107 GLU CA C 107 54.509 58.152 -3.643 1
1 1061 . 3 1 1 A 107 107 GLU CB C 107 27.239 29.666 -2.427 1
1 1062 . 3 1 1 A 107 107 GLU N N 107 118.621 119.993 -1.372 1
1 1063 . 3 1 1 A 108 108 SER H H 108 7.923 7.764 0.159 1
1 1064 . 3 1 1 A 108 108 SER HA H 108 4.385 4.189 0.196 1
1 1067 . 3 1 1 A 108 108 SER CA C 108 56.442 60.148 -3.706 1
1 1068 . 3 1 1 A 108 108 SER CB C 108 60.953 62.602 -1.649 1
1 1069 . 3 1 1 A 108 108 SER N N 108 115.670 115.804 -0.134 1
1 1070 . 3 1 1 A 109 109 ARG H H 109 8.068 7.640 0.428 1
1 1071 . 3 1 1 A 109 109 ARG HA H 109 4.307 3.926 0.381 1
1 1078 . 3 1 1 A 109 109 ARG CA C 109 53.732 59.284 -5.552 1
1 1079 . 3 1 1 A 109 109 ARG CB C 109 27.968 29.946 -1.978 1
1 1082 . 3 1 1 A 109 109 ARG N N 109 122.313 120.020 2.293 1
1 1083 . 3 1 1 A 110 110 ASN H H 110 8.292 7.745 0.547 1
1 1084 . 3 1 1 A 110 110 ASN HA H 110 4.720 4.443 0.277 1
1 1087 . 3 1 1 A 110 110 ASN CA C 110 50.750 56.214 -5.464 1
1 1088 . 3 1 1 A 110 110 ASN CB C 110 36.197 38.046 -1.849 1
1 1089 . 3 1 1 A 110 110 ASN N N 110 119.304 118.589 0.715 1
1 1090 . 3 1 1 A 111 111 SER H H 111 8.244 7.997 0.247 1
1 1091 . 3 1 1 A 111 111 SER HA H 111 4.423 4.215 0.208 1
1 1094 . 3 1 1 A 111 111 SER CA C 111 55.990 60.757 -4.767 1
1 1095 . 3 1 1 A 111 111 SER CB C 111 61.027 63.075 -2.048 1
1 1096 . 3 1 1 A 111 111 SER N N 111 116.119 115.538 0.581 1
1 1097 . 3 1 1 A 112 112 GLY H H 112 8.327 8.248 0.079 1
1 1098 . 3 1 1 A 112 112 GLY HA2 H 112 3.944 4.039 -0.095 1
1 1099 . 3 1 1 A 112 112 GLY HA3 H 112 3.912 4.296 -0.384 1
1 1100 . 3 1 1 A 112 112 GLY CA C 112 42.733 46.838 -4.105 1
1 1101 . 3 1 1 A 112 112 GLY N N 112 110.442 107.376 3.066 1
1 1102 . 3 1 1 A 113 113 GLY H H 113 8.097 7.963 0.134 1
1 1103 . 3 1 1 A 113 113 GLY HA2 H 113 3.831 4.012 -0.181 1
1 1104 . 3 1 1 A 113 113 GLY HA3 H 113 3.785 4.033 -0.248 1
1 1105 . 3 1 1 A 113 113 GLY CA C 113 42.435 46.015 -3.580 1
1 1106 . 3 1 1 A 113 113 GLY N N 113 108.745 109.348 -0.603 1
1 2 . 4 1 1 A 3 3 HIS CB C 3 33.709 28.528 5.181 1
1 3 . 4 1 1 A 7 7 HIS H H 7 8.731 9.083 -0.352 1
1 4 . 4 1 1 A 7 7 HIS HA H 7 4.564 4.804 -0.240 1
1 7 . 4 1 1 A 7 7 HIS CA C 7 53.649 55.071 -1.422 1
1 8 . 4 1 1 A 7 7 HIS CB C 7 26.268 31.315 -5.047 1
1 9 . 4 1 1 A 7 7 HIS N N 7 121.126 118.029 3.097 1
1 10 . 4 1 1 A 8 8 GLY H H 8 8.540 8.034 0.506 1
1 11 . 4 1 1 A 8 8 GLY HA2 H 8 3.973 3.790 0.183 1
1 12 . 4 1 1 A 8 8 GLY HA3 H 8 3.811 3.864 -0.053 1
1 13 . 4 1 1 A 8 8 GLY CA C 8 42.618 44.817 -2.199 1
1 14 . 4 1 1 A 8 8 GLY N N 8 110.662 108.671 1.991 1
1 15 . 4 1 1 A 9 9 GLU H H 9 8.239 8.626 -0.387 1
1 16 . 4 1 1 A 9 9 GLU HA H 9 4.568 4.253 0.315 1
1 18 . 4 1 1 A 9 9 GLU CA C 9 53.605 54.348 -0.743 1
1 19 . 4 1 1 A 9 9 GLU CB C 9 28.019 33.218 -5.199 1
1 20 . 4 1 1 A 9 9 GLU N N 9 121.669 122.006 -0.337 1
1 21 . 4 1 1 A 10 10 PHE H H 10 8.785 8.047 0.738 1
1 22 . 4 1 1 A 10 10 PHE HA H 10 4.850 4.998 -0.148 1
1 25 . 4 1 1 A 10 10 PHE CA C 10 52.630 56.352 -3.722 1
1 26 . 4 1 1 A 10 10 PHE CB C 10 37.906 41.653 -3.747 1
1 27 . 4 1 1 A 10 10 PHE N N 10 118.401 119.334 -0.933 1
1 28 . 4 1 1 A 11 11 GLN H H 11 8.552 9.095 -0.543 1
1 29 . 4 1 1 A 11 11 GLN HA H 11 5.425 5.319 0.106 1
1 34 . 4 1 1 A 11 11 GLN CA C 11 51.663 54.313 -2.650 1
1 35 . 4 1 1 A 11 11 GLN CB C 11 28.427 31.050 -2.623 1
1 37 . 4 1 1 A 11 11 GLN N N 11 117.519 122.083 -4.564 1
1 38 . 4 1 1 A 12 12 ILE H H 12 8.239 8.265 -0.026 1
1 39 . 4 1 1 A 12 12 ILE HA H 12 4.103 4.234 -0.131 1
1 49 . 4 1 1 A 12 12 ILE CA C 12 57.134 59.097 -1.963 1
1 50 . 4 1 1 A 12 12 ILE CB C 12 39.491 38.880 0.611 1
1 54 . 4 1 1 A 12 12 ILE N N 12 114.043 120.319 -6.276 1
1 55 . 4 1 1 A 13 13 PHE H H 13 8.538 8.198 0.340 1
1 56 . 4 1 1 A 13 13 PHE HA H 13 5.620 5.313 0.307 1
1 59 . 4 1 1 A 13 13 PHE CA C 13 52.438 56.370 -3.932 1
1 60 . 4 1 1 A 13 13 PHE CB C 13 39.253 42.468 -3.215 1
1 61 . 4 1 1 A 13 13 PHE N N 13 117.015 119.410 -2.395 1
1 62 . 4 1 1 A 14 14 ALA H H 14 9.238 9.677 -0.439 1
1 63 . 4 1 1 A 14 14 ALA HA H 14 5.311 5.553 -0.242 1
1 67 . 4 1 1 A 14 14 ALA CA C 14 47.183 50.018 -2.835 1
1 68 . 4 1 1 A 14 14 ALA CB C 14 17.811 21.503 -3.692 1
1 69 . 4 1 1 A 14 14 ALA N N 14 123.503 125.403 -1.900 1
1 70 . 4 1 1 A 15 15 LYS H H 15 8.810 9.539 -0.729 1
1 71 . 4 1 1 A 15 15 LYS HA H 15 5.511 5.379 0.132 1
1 80 . 4 1 1 A 15 15 LYS CA C 15 51.718 54.443 -2.725 1
1 81 . 4 1 1 A 15 15 LYS CB C 15 33.635 34.967 -1.332 1
1 85 . 4 1 1 A 15 15 LYS N N 15 123.382 123.259 0.123 1
1 86 . 4 1 1 A 16 16 THR H H 16 8.830 8.950 -0.120 1
1 87 . 4 1 1 A 16 16 THR HA H 16 5.212 5.086 0.126 1
1 92 . 4 1 1 A 16 16 THR CA C 16 57.614 60.916 -3.302 1
1 93 . 4 1 1 A 16 16 THR CB C 16 68.210 70.788 -2.578 1
1 95 . 4 1 1 A 16 16 THR N N 16 116.517 116.390 0.127 1
1 96 . 4 1 1 A 17 17 LEU H H 17 9.428 8.837 0.591 1
1 97 . 4 1 1 A 17 17 LEU HA H 17 4.286 4.235 0.051 1
1 107 . 4 1 1 A 17 17 LEU CA C 17 54.504 57.617 -3.113 1
1 108 . 4 1 1 A 17 17 LEU CB C 17 38.564 41.997 -3.433 1
1 112 . 4 1 1 A 17 17 LEU N N 17 121.786 123.926 -2.140 1
1 113 . 4 1 1 A 18 18 THR H H 18 7.546 7.789 -0.243 1
1 114 . 4 1 1 A 18 18 THR HA H 18 4.391 4.325 0.066 1
1 119 . 4 1 1 A 18 18 THR CA C 18 58.524 62.898 -4.374 1
1 120 . 4 1 1 A 18 18 THR CB C 18 66.166 70.548 -4.382 1
1 122 . 4 1 1 A 18 18 THR N N 18 105.598 107.812 -2.214 1
1 123 . 4 1 1 A 19 19 GLY H H 19 7.683 8.334 -0.651 1
1 124 . 4 1 1 A 19 19 GLY HA2 H 19 3.300 4.000 -0.700 1
1 125 . 4 1 1 A 19 19 GLY HA3 H 19 4.248 4.006 0.242 1
1 126 . 4 1 1 A 19 19 GLY CA C 19 42.947 45.569 -2.622 1
1 127 . 4 1 1 A 19 19 GLY N N 19 109.243 112.093 -2.850 1
1 128 . 4 1 1 A 20 20 LYS H H 20 7.375 7.796 -0.421 1
1 129 . 4 1 1 A 20 20 LYS HA H 20 4.331 4.662 -0.331 1
1 138 . 4 1 1 A 20 20 LYS CA C 20 53.829 55.065 -1.236 1
1 139 . 4 1 1 A 20 20 LYS CB C 20 30.385 34.534 -4.149 1
1 143 . 4 1 1 A 20 20 LYS N N 20 122.757 121.133 1.624 1
1 144 . 4 1 1 A 21 21 THR H H 21 8.637 8.872 -0.235 1
1 145 . 4 1 1 A 21 21 THR HA H 21 4.852 4.831 0.021 1
1 150 . 4 1 1 A 21 21 THR CA C 21 59.846 62.418 -2.572 1
1 151 . 4 1 1 A 21 21 THR CB C 21 67.140 69.980 -2.840 1
1 153 . 4 1 1 A 21 21 THR N N 21 121.524 123.430 -1.906 1
1 154 . 4 1 1 A 22 22 ILE H H 22 9.509 9.493 0.016 1
1 155 . 4 1 1 A 22 22 ILE HA H 22 4.349 4.989 -0.640 1
1 165 . 4 1 1 A 22 22 ILE CA C 22 57.634 60.017 -2.383 1
1 166 . 4 1 1 A 22 22 ILE CB C 22 38.334 41.187 -2.853 1
1 170 . 4 1 1 A 22 22 ILE N N 22 129.772 127.137 2.635 1
1 171 . 4 1 1 A 23 23 THR H H 23 8.838 8.982 -0.144 1
1 172 . 4 1 1 A 23 23 THR HA H 23 4.653 5.276 -0.623 1
1 177 . 4 1 1 A 23 23 THR CA C 23 60.194 62.178 -1.984 1
1 178 . 4 1 1 A 23 23 THR CB C 23 66.577 69.959 -3.382 1
1 180 . 4 1 1 A 23 23 THR N N 23 124.070 124.060 0.010 1
1 181 . 4 1 1 A 24 24 LEU H H 24 8.749 8.632 0.117 1
1 182 . 4 1 1 A 24 24 LEU HA H 24 4.619 4.988 -0.369 1
1 192 . 4 1 1 A 24 24 LEU CA C 24 50.257 53.179 -2.922 1
1 193 . 4 1 1 A 24 24 LEU CB C 24 42.932 45.839 -2.907 1
1 197 . 4 1 1 A 24 24 LEU N N 24 126.499 125.571 0.928 1
1 198 . 4 1 1 A 25 25 GLU H H 25 7.990 8.702 -0.712 1
1 199 . 4 1 1 A 25 25 GLU HA H 25 4.591 4.537 0.054 1
1 204 . 4 1 1 A 25 25 GLU CA C 25 52.845 56.241 -3.396 1
1 205 . 4 1 1 A 25 25 GLU CB C 25 27.210 30.171 -2.961 1
1 207 . 4 1 1 A 25 25 GLU N N 25 121.644 123.095 -1.451 1
1 208 . 4 1 1 A 26 26 VAL H H 26 8.657 8.674 -0.017 1
1 209 . 4 1 1 A 26 26 VAL HA H 26 4.403 4.887 -0.484 1
1 217 . 4 1 1 A 26 26 VAL CA C 26 56.020 59.123 -3.103 1
1 218 . 4 1 1 A 26 26 VAL CB C 26 33.631 35.450 -1.819 1
1 221 . 4 1 1 A 26 26 VAL N N 26 116.647 120.548 -3.901 1
1 222 . 4 1 1 A 27 27 GLU H H 27 7.970 8.967 -0.997 1
1 223 . 4 1 1 A 27 27 GLU HA H 27 4.447 4.719 -0.272 1
1 228 . 4 1 1 A 27 27 GLU CA C 27 51.386 56.691 -5.305 1
1 229 . 4 1 1 A 27 27 GLU CB C 27 30.905 30.904 0.001 1
1 231 . 4 1 1 A 27 27 GLU N N 27 115.496 124.373 -8.877 1
1 232 . 4 1 1 A 28 28 SER H H 28 9.192 8.666 0.526 1
1 233 . 4 1 1 A 28 28 SER HA H 28 4.108 3.931 0.177 1
1 236 . 4 1 1 A 28 28 SER CA C 28 59.909 60.888 -0.979 1
1 237 . 4 1 1 A 28 28 SER CB C 28 60.399 62.498 -2.099 1
1 238 . 4 1 1 A 28 28 SER N N 28 117.720 118.253 -0.533 1
1 239 . 4 1 1 A 29 29 SER H H 29 7.371 7.662 -0.291 1
1 240 . 4 1 1 A 29 29 SER HA H 29 4.327 4.482 -0.155 1
1 243 . 4 1 1 A 29 29 SER CA C 29 54.805 57.155 -2.350 1
1 244 . 4 1 1 A 29 29 SER CB C 29 60.775 64.134 -3.359 1
1 245 . 4 1 1 A 29 29 SER N N 29 108.936 110.011 -1.075 1
1 246 . 4 1 1 A 30 30 ASP H H 30 7.852 7.643 0.209 1
1 247 . 4 1 1 A 30 30 ASP HA H 30 4.591 4.519 0.072 1
1 250 . 4 1 1 A 30 30 ASP CA C 30 53.040 54.848 -1.808 1
1 251 . 4 1 1 A 30 30 ASP CB C 30 37.942 41.644 -3.702 1
1 252 . 4 1 1 A 30 30 ASP N N 30 123.735 124.085 -0.350 1
1 253 . 4 1 1 A 31 31 THR H H 31 7.852 8.269 -0.417 1
1 254 . 4 1 1 A 31 31 THR HA H 31 4.918 4.895 0.023 1
1 259 . 4 1 1 A 31 31 THR CA C 31 56.929 59.916 -2.987 1
1 260 . 4 1 1 A 31 31 THR CB C 31 68.674 71.928 -3.254 1
1 262 . 4 1 1 A 31 31 THR N N 31 109.181 112.806 -3.625 1
1 263 . 4 1 1 A 32 32 ILE H H 32 8.582 8.796 -0.214 1
1 264 . 4 1 1 A 32 32 ILE HA H 32 3.624 3.826 -0.202 1
1 274 . 4 1 1 A 32 32 ILE CA C 32 59.474 65.340 -5.866 1
1 275 . 4 1 1 A 32 32 ILE CB C 32 31.561 37.631 -6.070 1
1 279 . 4 1 1 A 32 32 ILE N N 32 121.833 122.816 -0.983 1
1 280 . 4 1 1 A 33 33 ASP H H 33 9.255 8.448 0.807 1
1 281 . 4 1 1 A 33 33 ASP HA H 33 4.201 4.286 -0.085 1
1 284 . 4 1 1 A 33 33 ASP CA C 33 54.679 57.458 -2.779 1
1 285 . 4 1 1 A 33 33 ASP CB C 33 37.700 40.195 -2.495 1
1 286 . 4 1 1 A 33 33 ASP N N 33 119.823 121.074 -1.251 1
1 287 . 4 1 1 A 34 34 ASN H H 34 8.026 7.671 0.355 1
1 288 . 4 1 1 A 34 34 ASN HA H 34 4.409 4.656 -0.247 1
1 291 . 4 1 1 A 34 34 ASN CA C 34 53.324 56.169 -2.845 1
1 292 . 4 1 1 A 34 34 ASN CB C 34 35.782 38.177 -2.395 1
1 293 . 4 1 1 A 34 34 ASN N N 34 119.540 117.660 1.880 1
1 294 . 4 1 1 A 35 35 VAL H H 35 8.167 8.128 0.039 1
1 295 . 4 1 1 A 35 35 VAL HA H 35 3.249 3.469 -0.220 1
1 303 . 4 1 1 A 35 35 VAL CA C 35 65.308 67.185 -1.877 1
1 304 . 4 1 1 A 35 35 VAL CB C 35 27.965 31.564 -3.599 1
1 307 . 4 1 1 A 35 35 VAL N N 35 122.223 120.584 1.639 1
1 308 . 4 1 1 A 36 36 LYS H H 36 8.460 8.245 0.215 1
1 313 . 4 1 1 A 36 36 LYS CB C 36 30.753 32.230 -1.477 1
1 315 . 4 1 1 A 36 36 LYS N N 36 119.438 119.327 0.111 1
1 316 . 4 1 1 A 37 37 SER H H 37 8.196 8.496 -0.300 1
1 317 . 4 1 1 A 37 37 SER HA H 37 4.130 4.177 -0.047 1
1 320 . 4 1 1 A 37 37 SER CA C 37 58.528 61.298 -2.770 1
1 321 . 4 1 1 A 37 37 SER CB C 37 59.768 62.673 -2.905 1
1 322 . 4 1 1 A 37 37 SER N N 37 117.791 114.246 3.545 1
1 323 . 4 1 1 A 38 38 LYS H H 38 8.043 8.122 -0.079 1
1 324 . 4 1 1 A 38 38 LYS HA H 38 4.095 4.000 0.095 1
1 325 . 4 1 1 A 38 38 LYS CA C 38 57.377 58.847 -1.470 1
1 326 . 4 1 1 A 38 38 LYS N N 38 124.094 120.878 3.216 1
1 327 . 4 1 1 A 39 39 ILE H H 39 8.254 8.282 -0.028 1
1 328 . 4 1 1 A 39 39 ILE HA H 39 3.439 3.757 -0.318 1
1 338 . 4 1 1 A 39 39 ILE CA C 39 63.977 64.466 -0.489 1
1 339 . 4 1 1 A 39 39 ILE CB C 39 33.935 37.468 -3.533 1
1 343 . 4 1 1 A 39 39 ILE N N 39 122.107 120.731 1.376 1
1 344 . 4 1 1 A 40 40 GLN H H 40 8.379 8.105 0.274 1
1 345 . 4 1 1 A 40 40 GLN HA H 40 3.746 4.203 -0.457 1
1 350 . 4 1 1 A 40 40 GLN CA C 40 57.472 57.959 -0.487 1
1 351 . 4 1 1 A 40 40 GLN CB C 40 25.072 27.305 -2.233 1
1 353 . 4 1 1 A 40 40 GLN N N 40 123.725 120.241 3.484 1
1 354 . 4 1 1 A 41 41 ASP H H 41 8.210 7.786 0.424 1
1 355 . 4 1 1 A 41 41 ASP HA H 41 4.247 4.363 -0.116 1
1 358 . 4 1 1 A 41 41 ASP CA C 41 54.646 57.155 -2.509 1
1 359 . 4 1 1 A 41 41 ASP CB C 41 38.136 40.977 -2.841 1
1 360 . 4 1 1 A 41 41 ASP N N 41 120.564 120.665 -0.101 1
1 361 . 4 1 1 A 42 42 LYS H H 42 7.381 7.719 -0.338 1
1 362 . 4 1 1 A 42 42 LYS HA H 42 4.246 4.310 -0.064 1
1 369 . 4 1 1 A 42 42 LYS CA C 42 55.579 58.125 -2.546 1
1 370 . 4 1 1 A 42 42 LYS CB C 42 31.406 33.544 -2.138 1
1 373 . 4 1 1 A 42 42 LYS N N 42 115.674 117.988 -2.314 1
1 374 . 4 1 1 A 43 43 GLU H H 43 8.537 8.917 -0.380 1
1 375 . 4 1 1 A 43 43 GLU HA H 43 4.522 4.531 -0.009 1
1 380 . 4 1 1 A 43 43 GLU CA C 43 52.772 55.621 -2.849 1
1 381 . 4 1 1 A 43 43 GLU CB C 43 30.535 31.038 -0.503 1
1 383 . 4 1 1 A 43 43 GLU N N 43 114.355 116.159 -1.804 1
1 384 . 4 1 1 A 44 44 GLY H H 44 8.611 7.975 0.636 1
1 385 . 4 1 1 A 44 44 GLY HA2 H 44 4.067 3.976 0.091 1
1 386 . 4 1 1 A 44 44 GLY HA3 H 44 3.819 3.977 -0.158 1
1 387 . 4 1 1 A 44 44 GLY CA C 44 43.205 45.626 -2.421 1
1 388 . 4 1 1 A 44 44 GLY N N 44 109.406 108.743 0.663 1
1 389 . 4 1 1 A 45 45 ILE H H 45 6.092 8.459 -2.367 1
1 390 . 4 1 1 A 45 45 ILE HA H 45 4.324 4.110 0.214 1
1 400 . 4 1 1 A 45 45 ILE CA C 45 55.211 60.238 -5.027 1
1 401 . 4 1 1 A 45 45 ILE CB C 45 37.903 38.237 -0.334 1
1 405 . 4 1 1 A 45 45 ILE N N 45 120.791 122.476 -1.685 1
1 406 . 4 1 1 A 46 46 PRO HA H 46 4.547 4.532 0.015 1
1 413 . 4 1 1 A 46 46 PRO CA C 46 58.971 62.186 -3.215 1
1 414 . 4 1 1 A 46 46 PRO CB C 46 29.142 32.516 -3.374 1
1 417 . 4 1 1 A 47 47 PRO HA H 47 4.062 4.184 -0.122 1
1 424 . 4 1 1 A 47 47 PRO CA C 47 63.476 65.582 -2.106 1
1 425 . 4 1 1 A 47 47 PRO CB C 47 30.113 31.921 -1.808 1
1 428 . 4 1 1 A 48 48 ASP H H 48 8.418 8.237 0.181 1
1 429 . 4 1 1 A 48 48 ASP HA H 48 4.346 4.381 -0.035 1
1 432 . 4 1 1 A 48 48 ASP CA C 48 52.838 57.040 -4.202 1
1 433 . 4 1 1 A 48 48 ASP CB C 48 36.926 40.943 -4.017 1
1 434 . 4 1 1 A 48 48 ASP N N 48 113.462 117.472 -4.010 1
1 435 . 4 1 1 A 49 49 GLN H H 49 7.822 7.889 -0.067 1
1 436 . 4 1 1 A 49 49 GLN HA H 49 4.283 4.116 0.167 1
1 439 . 4 1 1 A 49 49 GLN CA C 49 52.770 57.722 -4.952 1
1 441 . 4 1 1 A 49 49 GLN N N 49 117.377 116.936 0.441 1
1 442 . 4 1 1 A 50 50 GLN H H 50 7.451 7.597 -0.146 1
1 443 . 4 1 1 A 50 50 GLN HA H 50 4.260 5.045 -0.785 1
1 448 . 4 1 1 A 50 50 GLN CA C 50 53.725 54.708 -0.983 1
1 449 . 4 1 1 A 50 50 GLN CB C 50 29.142 31.971 -2.829 1
1 451 . 4 1 1 A 50 50 GLN N N 50 117.526 118.356 -0.830 1
1 452 . 4 1 1 A 51 51 ARG H H 51 8.534 9.279 -0.745 1
1 453 . 4 1 1 A 51 51 ARG HA H 51 4.486 5.125 -0.639 1
1 460 . 4 1 1 A 51 51 ARG CA C 51 52.492 54.216 -1.724 1
1 461 . 4 1 1 A 51 51 ARG CB C 51 29.096 34.871 -5.775 1
1 464 . 4 1 1 A 51 51 ARG N N 51 121.655 120.384 1.271 1
1 465 . 4 1 1 A 52 52 LEU H H 52 8.683 8.843 -0.160 1
1 466 . 4 1 1 A 52 52 LEU HA H 52 5.255 4.933 0.322 1
1 476 . 4 1 1 A 52 52 LEU CA C 52 50.618 53.783 -3.165 1
1 477 . 4 1 1 A 52 52 LEU CB C 52 43.007 43.821 -0.814 1
1 481 . 4 1 1 A 52 52 LEU N N 52 122.929 120.790 2.139 1
1 482 . 4 1 1 A 53 53 ILE H H 53 9.286 9.032 0.254 1
1 483 . 4 1 1 A 53 53 ILE HA H 53 5.096 5.011 0.085 1
1 492 . 4 1 1 A 53 53 ILE CA C 53 56.795 60.329 -3.534 1
1 496 . 4 1 1 A 53 53 ILE N N 53 124.718 125.739 -1.021 1
1 497 . 4 1 1 A 54 54 TRP H H 54 8.871 8.733 0.138 1
1 499 . 4 1 1 A 54 54 TRP N N 54 127.412 128.245 -0.833 1
1 501 . 4 1 1 A 55 55 ALA H H 55 8.401 8.545 -0.144 1
1 502 . 4 1 1 A 55 55 ALA HA H 55 3.183 3.245 -0.062 1
1 506 . 4 1 1 A 55 55 ALA CA C 55 49.712 52.578 -2.866 1
1 507 . 4 1 1 A 55 55 ALA CB C 55 13.252 17.090 -3.838 1
1 508 . 4 1 1 A 55 55 ALA N N 55 128.894 129.515 -0.621 1
1 509 . 4 1 1 A 56 56 GLY H H 56 8.248 8.441 -0.193 1
1 510 . 4 1 1 A 56 56 GLY HA2 H 56 3.968 3.725 0.243 1
1 511 . 4 1 1 A 56 56 GLY HA3 H 56 3.916 3.750 0.166 1
1 512 . 4 1 1 A 56 56 GLY CA C 56 43.142 45.440 -2.298 1
1 513 . 4 1 1 A 56 56 GLY N N 56 101.499 102.322 -0.823 1
1 514 . 4 1 1 A 57 57 LYS H H 57 8.028 7.595 0.433 1
1 515 . 4 1 1 A 57 57 LYS HA H 57 4.609 4.670 -0.061 1
1 522 . 4 1 1 A 57 57 LYS CA C 57 51.928 54.623 -2.695 1
1 523 . 4 1 1 A 57 57 LYS CB C 57 32.613 35.353 -2.740 1
1 526 . 4 1 1 A 57 57 LYS N N 57 118.995 121.330 -2.335 1
1 527 . 4 1 1 A 58 58 GLN H H 58 8.607 8.359 0.248 1
1 528 . 4 1 1 A 58 58 GLN HA H 58 4.617 4.572 0.045 1
1 533 . 4 1 1 A 58 58 GLN CA C 58 53.261 55.859 -2.598 1
1 534 . 4 1 1 A 58 58 GLN CB C 58 26.613 29.295 -2.682 1
1 536 . 4 1 1 A 58 58 GLN N N 58 119.825 125.126 -5.301 1
1 537 . 4 1 1 A 59 59 LEU H H 59 8.653 8.917 -0.264 1
1 538 . 4 1 1 A 59 59 LEU HA H 59 4.138 4.332 -0.194 1
1 548 . 4 1 1 A 59 59 LEU CA C 59 51.991 54.545 -2.554 1
1 549 . 4 1 1 A 59 59 LEU CB C 59 39.006 42.117 -3.111 1
1 553 . 4 1 1 A 59 59 LEU N N 59 125.484 124.541 0.943 1
1 554 . 4 1 1 A 60 60 GLU H H 60 8.461 8.984 -0.523 1
1 555 . 4 1 1 A 60 60 GLU HA H 60 4.371 4.492 -0.121 1
1 559 . 4 1 1 A 60 60 GLU CA C 60 53.436 55.660 -2.224 1
1 560 . 4 1 1 A 60 60 GLU CB C 60 29.057 30.945 -1.888 1
1 562 . 4 1 1 A 60 60 GLU N N 60 123.237 122.523 0.714 1
1 563 . 4 1 1 A 61 61 ASP H H 61 8.076 8.654 -0.578 1
1 564 . 4 1 1 A 61 61 ASP HA H 61 4.265 4.306 -0.041 1
1 567 . 4 1 1 A 61 61 ASP CA C 61 54.398 56.738 -2.340 1
1 568 . 4 1 1 A 61 61 ASP CB C 61 38.340 40.433 -2.093 1
1 569 . 4 1 1 A 61 61 ASP N N 61 120.701 122.922 -2.221 1
1 570 . 4 1 1 A 62 62 GLY HA2 H 62 4.104 3.977 0.127 1
1 571 . 4 1 1 A 62 62 GLY HA3 H 62 3.832 3.978 -0.146 1
1 572 . 4 1 1 A 62 62 GLY CA C 62 42.576 45.505 -2.929 1
1 573 . 4 1 1 A 63 63 ARG H H 63 7.319 8.226 -0.907 1
1 574 . 4 1 1 A 63 63 ARG HA H 63 4.595 4.463 0.132 1
1 579 . 4 1 1 A 63 63 ARG CA C 63 51.971 56.219 -4.248 1
1 582 . 4 1 1 A 63 63 ARG N N 63 119.206 121.918 -2.712 1
1 583 . 4 1 1 A 64 64 THR H H 64 8.735 8.622 0.113 1
1 584 . 4 1 1 A 64 64 THR HA H 64 5.208 4.980 0.228 1
1 589 . 4 1 1 A 64 64 THR CA C 64 57.126 59.538 -2.412 1
1 590 . 4 1 1 A 64 64 THR CB C 64 69.885 71.877 -1.992 1
1 592 . 4 1 1 A 64 64 THR N N 64 108.713 116.156 -7.443 1
1 593 . 4 1 1 A 65 65 LEU H H 65 8.241 9.017 -0.776 1
1 594 . 4 1 1 A 65 65 LEU HA H 65 4.003 4.036 -0.033 1
1 604 . 4 1 1 A 65 65 LEU CA C 65 56.409 57.212 -0.803 1
1 605 . 4 1 1 A 65 65 LEU CB C 65 37.179 41.555 -4.376 1
1 609 . 4 1 1 A 65 65 LEU N N 65 118.111 122.200 -4.089 1
1 610 . 4 1 1 A 66 66 SER H H 66 8.296 8.283 0.013 1
1 611 . 4 1 1 A 66 66 SER HA H 66 4.201 4.255 -0.054 1
1 614 . 4 1 1 A 66 66 SER CA C 66 58.454 60.395 -1.941 1
1 615 . 4 1 1 A 66 66 SER CB C 66 59.969 62.715 -2.746 1
1 616 . 4 1 1 A 66 66 SER N N 66 113.148 113.405 -0.257 1
1 617 . 4 1 1 A 67 67 ASP H H 67 7.984 8.415 -0.431 1
1 618 . 4 1 1 A 67 67 ASP HA H 67 4.187 4.290 -0.103 1
1 621 . 4 1 1 A 67 67 ASP CA C 67 54.744 57.368 -2.624 1
1 622 . 4 1 1 A 67 67 ASP CB C 67 37.794 41.173 -3.379 1
1 623 . 4 1 1 A 67 67 ASP N N 67 124.130 123.140 0.990 1
1 624 . 4 1 1 A 68 68 TYR H H 68 7.177 7.869 -0.692 1
1 625 . 4 1 1 A 68 68 TYR N N 68 115.334 115.490 -0.156 1
1 626 . 4 1 1 A 69 69 ASN H H 69 8.111 8.250 -0.139 1
1 627 . 4 1 1 A 69 69 ASN HA H 69 4.253 4.313 -0.060 1
1 630 . 4 1 1 A 69 69 ASN CA C 69 51.386 54.144 -2.758 1
1 631 . 4 1 1 A 69 69 ASN CB C 69 34.867 37.123 -2.256 1
1 632 . 4 1 1 A 69 69 ASN N N 69 116.867 117.359 -0.492 1
1 633 . 4 1 1 A 70 70 ILE H H 70 7.460 7.898 -0.438 1
1 634 . 4 1 1 A 70 70 ILE HA H 70 3.210 3.957 -0.747 1
1 644 . 4 1 1 A 70 70 ILE CA C 70 60.157 62.031 -1.874 1
1 645 . 4 1 1 A 70 70 ILE CB C 70 34.754 37.581 -2.827 1
1 649 . 4 1 1 A 70 70 ILE N N 70 119.821 119.786 0.035 1
1 650 . 4 1 1 A 71 71 GLN H H 71 7.368 8.912 -1.544 1
1 651 . 4 1 1 A 71 71 GLN HA H 71 4.099 4.411 -0.312 1
1 656 . 4 1 1 A 71 71 GLN CA C 71 50.906 54.809 -3.903 1
1 657 . 4 1 1 A 71 71 GLN CB C 71 28.793 29.990 -1.197 1
1 659 . 4 1 1 A 71 71 GLN N N 71 124.287 126.661 -2.374 1
1 660 . 4 1 1 A 72 72 ARG H H 72 7.583 8.752 -1.169 1
1 661 . 4 1 1 A 72 72 ARG HA H 72 3.907 3.848 0.059 1
1 668 . 4 1 1 A 72 72 ARG CA C 72 54.527 58.837 -4.310 1
1 669 . 4 1 1 A 72 72 ARG CB C 72 27.470 29.708 -2.238 1
1 672 . 4 1 1 A 72 72 ARG N N 72 119.007 122.319 -3.312 1
1 673 . 4 1 1 A 73 73 GLU H H 73 9.262 7.707 1.555 1
1 674 . 4 1 1 A 73 73 GLU HA H 73 3.586 4.579 -0.993 1
1 679 . 4 1 1 A 73 73 GLU CA C 73 55.703 56.163 -0.460 1
1 680 . 4 1 1 A 73 73 GLU CB C 73 23.669 28.274 -4.605 1
1 682 . 4 1 1 A 73 73 GLU N N 73 115.180 118.021 -2.841 1
1 683 . 4 1 1 A 74 74 SER H H 74 7.551 7.517 0.034 1
1 684 . 4 1 1 A 74 74 SER HA H 74 4.613 5.055 -0.442 1
1 687 . 4 1 1 A 74 74 SER CA C 74 58.305 56.598 1.707 1
1 688 . 4 1 1 A 74 74 SER CB C 74 62.156 65.686 -3.530 1
1 689 . 4 1 1 A 74 74 SER N N 74 115.104 116.665 -1.561 1
1 690 . 4 1 1 A 75 75 THR H H 75 8.785 8.705 0.080 1
1 691 . 4 1 1 A 75 75 THR HA H 75 5.014 4.854 0.160 1
1 696 . 4 1 1 A 75 75 THR CA C 75 59.835 61.834 -1.999 1
1 697 . 4 1 1 A 75 75 THR CB C 75 67.258 69.222 -1.964 1
1 699 . 4 1 1 A 75 75 THR N N 75 118.401 119.981 -1.580 1
1 700 . 4 1 1 A 76 76 LEU H H 76 9.447 10.018 -0.571 1
1 701 . 4 1 1 A 76 76 LEU HA H 76 4.930 4.636 0.294 1
1 711 . 4 1 1 A 76 76 LEU CA C 76 51.107 53.650 -2.543 1
1 712 . 4 1 1 A 76 76 LEU CB C 76 40.841 42.172 -1.331 1
1 716 . 4 1 1 A 76 76 LEU N N 76 127.905 127.951 -0.046 1
1 717 . 4 1 1 A 77 77 HIS HA H 77 4.976 4.909 0.067 1
1 720 . 4 1 1 A 77 77 HIS CA C 77 53.776 56.366 -2.590 1
1 721 . 4 1 1 A 77 77 HIS CB C 77 28.438 29.473 -1.035 1
1 722 . 4 1 1 A 78 78 LEU H H 78 8.450 8.945 -0.495 1
1 723 . 4 1 1 A 78 78 LEU HA H 78 5.085 4.988 0.097 1
1 733 . 4 1 1 A 78 78 LEU CA C 78 50.896 53.900 -3.004 1
1 734 . 4 1 1 A 78 78 LEU CB C 78 41.916 44.900 -2.984 1
1 738 . 4 1 1 A 78 78 LEU N N 78 126.178 126.488 -0.310 1
1 739 . 4 1 1 A 79 79 VAL H H 79 9.093 9.878 -0.785 1
1 740 . 4 1 1 A 79 79 VAL HA H 79 4.053 4.664 -0.611 1
1 748 . 4 1 1 A 79 79 VAL CA C 79 59.054 61.283 -2.229 1
1 749 . 4 1 1 A 79 79 VAL CB C 79 32.115 33.473 -1.358 1
1 752 . 4 1 1 A 79 79 VAL N N 79 128.372 127.588 0.784 1
1 753 . 4 1 1 A 80 80 LEU H H 80 8.000 8.992 -0.992 1
1 754 . 4 1 1 A 80 80 LEU HA H 80 5.105 4.874 0.231 1
1 764 . 4 1 1 A 80 80 LEU CA C 80 50.556 54.161 -3.605 1
1 765 . 4 1 1 A 80 80 LEU CB C 80 39.597 43.901 -4.304 1
1 769 . 4 1 1 A 80 80 LEU N N 80 126.145 127.811 -1.666 1
1 770 . 4 1 1 A 81 81 ARG H H 81 8.470 8.396 0.074 1
1 771 . 4 1 1 A 81 81 ARG HA H 81 4.197 4.426 -0.229 1
1 778 . 4 1 1 A 81 81 ARG CA C 81 53.133 55.456 -2.323 1
1 779 . 4 1 1 A 81 81 ARG CB C 81 28.413 31.120 -2.707 1
1 782 . 4 1 1 A 81 81 ARG N N 81 121.625 124.712 -3.087 1
1 783 . 4 1 1 A 82 82 LEU H H 82 8.454 8.438 0.016 1
1 784 . 4 1 1 A 82 82 LEU HA H 82 4.339 4.740 -0.401 1
1 794 . 4 1 1 A 82 82 LEU CA C 82 52.081 53.776 -1.695 1
1 795 . 4 1 1 A 82 82 LEU CB C 82 39.810 44.167 -4.357 1
1 799 . 4 1 1 A 82 82 LEU N N 82 123.832 122.285 1.547 1
1 800 . 4 1 1 A 83 83 ARG H H 83 8.404 8.864 -0.460 1
1 801 . 4 1 1 A 83 83 ARG HA H 83 4.308 4.751 -0.443 1
1 808 . 4 1 1 A 83 83 ARG CA C 83 53.258 56.026 -2.768 1
1 809 . 4 1 1 A 83 83 ARG CB C 83 28.160 32.491 -4.331 1
1 812 . 4 1 1 A 83 83 ARG N N 83 121.447 123.051 -1.604 1
1 813 . 4 1 1 A 84 84 GLY H H 84 8.410 7.590 0.820 1
1 814 . 4 1 1 A 84 84 GLY HA2 H 84 3.929 4.122 -0.193 1
1 815 . 4 1 1 A 84 84 GLY HA3 H 84 3.929 4.122 -0.193 1
1 816 . 4 1 1 A 84 84 GLY CA C 84 42.751 46.101 -3.350 1
1 817 . 4 1 1 A 84 84 GLY N N 84 110.030 105.173 4.857 1
1 818 . 4 1 1 A 85 85 GLY H H 85 8.295 8.157 0.138 1
1 819 . 4 1 1 A 85 85 GLY HA2 H 85 3.950 4.028 -0.078 1
1 820 . 4 1 1 A 85 85 GLY HA3 H 85 3.950 4.028 -0.078 1
1 821 . 4 1 1 A 85 85 GLY CA C 85 42.831 44.401 -1.570 1
1 822 . 4 1 1 A 85 85 GLY N N 85 108.838 109.996 -1.158 1
1 823 . 4 1 1 A 86 86 SER H H 86 8.292 8.970 -0.678 1
1 824 . 4 1 1 A 86 86 SER HA H 86 4.405 4.151 0.254 1
1 827 . 4 1 1 A 86 86 SER CA C 86 55.965 59.016 -3.051 1
1 828 . 4 1 1 A 86 86 SER CB C 86 61.232 61.798 -0.566 1
1 829 . 4 1 1 A 86 86 SER N N 86 116.028 116.830 -0.802 1
1 830 . 4 1 1 A 87 87 MET H H 87 8.470 8.472 -0.002 1
1 831 . 4 1 1 A 87 87 MET HA H 87 4.447 4.503 -0.056 1
1 836 . 4 1 1 A 87 87 MET CA C 87 53.281 57.033 -3.752 1
1 837 . 4 1 1 A 87 87 MET CB C 87 29.788 34.619 -4.831 1
1 839 . 4 1 1 A 87 87 MET N N 87 121.625 128.321 -6.696 1
1 840 . 4 1 1 A 88 88 GLY H H 88 8.320 7.792 0.528 1
1 841 . 4 1 1 A 88 88 GLY HA2 H 88 3.919 4.045 -0.126 1
1 842 . 4 1 1 A 88 88 GLY HA3 H 88 3.896 4.046 -0.150 1
1 843 . 4 1 1 A 88 88 GLY CA C 88 43.060 46.750 -3.690 1
1 844 . 4 1 1 A 88 88 GLY N N 88 109.625 107.483 2.142 1
1 845 . 4 1 1 A 89 89 GLY H H 89 8.256 7.741 0.515 1
1 846 . 4 1 1 A 89 89 GLY HA2 H 89 3.940 4.204 -0.264 1
1 847 . 4 1 1 A 89 89 GLY HA3 H 89 3.910 4.205 -0.295 1
1 848 . 4 1 1 A 89 89 GLY CA C 89 42.678 46.270 -3.592 1
1 849 . 4 1 1 A 89 89 GLY N N 89 108.982 111.720 -2.738 1
1 850 . 4 1 1 A 90 90 ALA H H 90 8.203 8.246 -0.043 1
1 851 . 4 1 1 A 90 90 ALA HA H 90 4.255 4.061 0.194 1
1 855 . 4 1 1 A 90 90 ALA CA C 90 50.763 54.704 -3.941 1
1 856 . 4 1 1 A 90 90 ALA CB C 90 16.364 18.670 -2.306 1
1 857 . 4 1 1 A 90 90 ALA N N 90 124.065 130.024 -5.959 1
1 858 . 4 1 1 A 91 91 ALA H H 91 8.273 7.790 0.483 1
1 859 . 4 1 1 A 91 91 ALA HA H 91 4.204 4.559 -0.355 1
1 863 . 4 1 1 A 91 91 ALA CA C 91 51.080 50.874 0.206 1
1 864 . 4 1 1 A 91 91 ALA CB C 91 16.036 20.460 -4.424 1
1 865 . 4 1 1 A 91 91 ALA N N 91 121.985 119.676 2.309 1
1 866 . 4 1 1 A 92 92 ASP H H 92 8.022 9.164 -1.142 1
1 867 . 4 1 1 A 92 92 ASP HA H 92 4.455 4.900 -0.445 1
1 870 . 4 1 1 A 92 92 ASP CA C 92 52.664 55.341 -2.677 1
1 871 . 4 1 1 A 92 92 ASP CB C 92 37.925 43.019 -5.094 1
1 872 . 4 1 1 A 92 92 ASP N N 92 118.621 122.761 -4.140 1
1 873 . 4 1 1 A 93 93 GLU H H 93 8.282 7.960 0.322 1
1 874 . 4 1 1 A 93 93 GLU HA H 93 3.912 4.658 -0.746 1
1 879 . 4 1 1 A 93 93 GLU CA C 93 56.947 58.038 -1.091 1
1 880 . 4 1 1 A 93 93 GLU CB C 93 27.413 31.483 -4.070 1
1 882 . 4 1 1 A 93 93 GLU N N 93 122.247 115.689 6.558 1
1 883 . 4 1 1 A 94 94 GLU H H 94 8.194 8.683 -0.489 1
1 884 . 4 1 1 A 94 94 GLU HA H 94 3.940 4.167 -0.227 1
1 889 . 4 1 1 A 94 94 GLU CA C 94 56.681 58.783 -2.102 1
1 890 . 4 1 1 A 94 94 GLU CB C 94 26.127 30.123 -3.996 1
1 892 . 4 1 1 A 94 94 GLU N N 94 118.024 120.171 -2.147 1
1 893 . 4 1 1 A 95 95 GLU H H 95 7.816 8.149 -0.333 1
1 894 . 4 1 1 A 95 95 GLU HA H 95 4.121 4.083 0.038 1
1 898 . 4 1 1 A 95 95 GLU CA C 95 56.162 59.273 -3.111 1
1 899 . 4 1 1 A 95 95 GLU CB C 95 26.403 29.328 -2.925 1
1 901 . 4 1 1 A 95 95 GLU N N 95 120.028 118.485 1.543 1
1 902 . 4 1 1 A 96 96 LEU H H 96 7.637 8.082 -0.445 1
1 903 . 4 1 1 A 96 96 LEU HA H 96 3.988 4.048 -0.060 1
1 913 . 4 1 1 A 96 96 LEU CA C 96 55.303 57.999 -2.696 1
1 914 . 4 1 1 A 96 96 LEU CB C 96 39.038 41.493 -2.455 1
1 918 . 4 1 1 A 96 96 LEU N N 96 119.866 117.717 2.149 1
1 919 . 4 1 1 A 97 97 ILE H H 97 8.044 7.477 0.567 1
1 920 . 4 1 1 A 97 97 ILE HA H 97 3.478 3.850 -0.372 1
1 930 . 4 1 1 A 97 97 ILE CA C 97 62.054 64.670 -2.616 1
1 931 . 4 1 1 A 97 97 ILE CB C 97 34.541 37.812 -3.271 1
1 935 . 4 1 1 A 97 97 ILE N N 97 119.088 119.803 -0.715 1
1 936 . 4 1 1 A 98 98 ARG H H 98 7.991 8.041 -0.050 1
1 937 . 4 1 1 A 98 98 ARG HA H 98 3.793 4.053 -0.260 1
1 944 . 4 1 1 A 98 98 ARG CA C 98 57.509 58.736 -1.227 1
1 945 . 4 1 1 A 98 98 ARG CB C 98 27.191 29.972 -2.781 1
1 948 . 4 1 1 A 98 98 ARG N N 98 119.225 120.923 -1.698 1
1 949 . 4 1 1 A 99 99 LYS H H 99 8.101 9.087 -0.986 1
1 950 . 4 1 1 A 99 99 LYS HA H 99 3.968 4.033 -0.065 1
1 959 . 4 1 1 A 99 99 LYS CA C 99 56.455 59.168 -2.713 1
1 960 . 4 1 1 A 99 99 LYS CB C 99 29.531 32.209 -2.678 1
1 964 . 4 1 1 A 99 99 LYS N N 99 119.464 119.511 -0.047 1
1 965 . 4 1 1 A 100 100 ALA H H 100 8.167 7.952 0.215 1
1 966 . 4 1 1 A 100 100 ALA HA H 100 3.789 4.008 -0.219 1
1 970 . 4 1 1 A 100 100 ALA CA C 100 52.451 54.845 -2.394 1
1 971 . 4 1 1 A 100 100 ALA CB C 100 16.259 18.397 -2.138 1
1 972 . 4 1 1 A 100 100 ALA N N 100 122.398 121.347 1.051 1
1 973 . 4 1 1 A 101 101 ILE H H 101 8.777 7.625 1.152 1
1 974 . 4 1 1 A 101 101 ILE HA H 101 3.191 3.744 -0.553 1
1 984 . 4 1 1 A 101 101 ILE CA C 101 62.910 64.997 -2.087 1
1 985 . 4 1 1 A 101 101 ILE CB C 101 34.544 37.661 -3.117 1
1 989 . 4 1 1 A 101 101 ILE N N 101 120.431 119.070 1.361 1
1 990 . 4 1 1 A 102 102 GLU H H 102 7.890 8.335 -0.445 1
1 991 . 4 1 1 A 102 102 GLU HA H 102 3.848 4.171 -0.323 1
1 996 . 4 1 1 A 102 102 GLU CA C 102 57.079 58.992 -1.913 1
1 997 . 4 1 1 A 102 102 GLU CB C 102 26.769 29.771 -3.002 1
1 999 . 4 1 1 A 102 102 GLU N N 102 120.248 119.266 0.982 1
1 1000 . 4 1 1 A 103 103 LEU H H 103 8.194 7.860 0.334 1
1 1001 . 4 1 1 A 103 103 LEU HA H 103 3.912 4.327 -0.415 1
1 1011 . 4 1 1 A 103 103 LEU CA C 103 55.078 56.427 -1.349 1
1 1012 . 4 1 1 A 103 103 LEU CB C 103 38.963 42.606 -3.643 1
1 1016 . 4 1 1 A 103 103 LEU N N 103 120.341 117.433 2.908 1
1 1017 . 4 1 1 A 104 104 SER H H 104 8.268 8.123 0.145 1
1 1018 . 4 1 1 A 104 104 SER HA H 104 4.120 4.377 -0.257 1
1 1021 . 4 1 1 A 104 104 SER CA C 104 58.301 60.197 -1.896 1
1 1022 . 4 1 1 A 104 104 SER CB C 104 60.193 63.447 -3.254 1
1 1023 . 4 1 1 A 104 104 SER N N 104 115.150 116.497 -1.347 1
1 1024 . 4 1 1 A 105 105 LEU H H 105 7.501 7.415 0.086 1
1 1025 . 4 1 1 A 105 105 LEU HA H 105 4.041 4.221 -0.180 1
1 1035 . 4 1 1 A 105 105 LEU CA C 105 53.995 56.638 -2.643 1
1 1036 . 4 1 1 A 105 105 LEU CB C 105 39.597 42.554 -2.957 1
1 1040 . 4 1 1 A 105 105 LEU N N 105 124.223 121.656 2.567 1
1 1041 . 4 1 1 A 106 106 LYS H H 106 7.542 8.266 -0.724 1
1 1042 . 4 1 1 A 106 106 LYS HA H 106 4.090 4.220 -0.130 1
1 1050 . 4 1 1 A 106 106 LYS CA C 106 55.495 58.861 -3.366 1
1 1051 . 4 1 1 A 106 106 LYS CB C 106 29.941 32.091 -2.150 1
1 1055 . 4 1 1 A 106 106 LYS N N 106 120.328 119.326 1.002 1
1 1056 . 4 1 1 A 107 107 GLU H H 107 7.884 8.101 -0.217 1
1 1057 . 4 1 1 A 107 107 GLU HA H 107 4.210 4.249 -0.039 1
1 1060 . 4 1 1 A 107 107 GLU CA C 107 54.509 58.727 -4.218 1
1 1061 . 4 1 1 A 107 107 GLU CB C 107 27.239 29.619 -2.380 1
1 1062 . 4 1 1 A 107 107 GLU N N 107 118.621 120.511 -1.890 1
1 1063 . 4 1 1 A 108 108 SER H H 108 7.923 7.892 0.031 1
1 1064 . 4 1 1 A 108 108 SER HA H 108 4.385 4.544 -0.159 1
1 1067 . 4 1 1 A 108 108 SER CA C 108 56.442 61.038 -4.596 1
1 1068 . 4 1 1 A 108 108 SER CB C 108 60.953 63.511 -2.558 1
1 1069 . 4 1 1 A 108 108 SER N N 108 115.670 115.511 0.159 1
1 1070 . 4 1 1 A 109 109 ARG H H 109 8.068 7.916 0.152 1
1 1071 . 4 1 1 A 109 109 ARG HA H 109 4.307 4.260 0.047 1
1 1078 . 4 1 1 A 109 109 ARG CA C 109 53.732 58.440 -4.708 1
1 1079 . 4 1 1 A 109 109 ARG CB C 109 27.968 29.811 -1.843 1
1 1082 . 4 1 1 A 109 109 ARG N N 109 122.313 121.782 0.531 1
1 1083 . 4 1 1 A 110 110 ASN H H 110 8.292 8.733 -0.441 1
1 1084 . 4 1 1 A 110 110 ASN HA H 110 4.720 4.496 0.224 1
1 1087 . 4 1 1 A 110 110 ASN CA C 110 50.750 55.841 -5.091 1
1 1088 . 4 1 1 A 110 110 ASN CB C 110 36.197 37.247 -1.050 1
1 1089 . 4 1 1 A 110 110 ASN N N 110 119.304 117.629 1.675 1
1 1090 . 4 1 1 A 111 111 SER H H 111 8.244 7.691 0.553 1
1 1091 . 4 1 1 A 111 111 SER HA H 111 4.423 4.475 -0.052 1
1 1094 . 4 1 1 A 111 111 SER CA C 111 55.990 60.646 -4.656 1
1 1095 . 4 1 1 A 111 111 SER CB C 111 61.027 62.969 -1.942 1
1 1096 . 4 1 1 A 111 111 SER N N 111 116.119 115.149 0.970 1
1 1097 . 4 1 1 A 112 112 GLY H H 112 8.327 8.561 -0.234 1
1 1098 . 4 1 1 A 112 112 GLY HA2 H 112 3.944 3.906 0.038 1
1 1099 . 4 1 1 A 112 112 GLY HA3 H 112 3.912 3.928 -0.016 1
1 1100 . 4 1 1 A 112 112 GLY CA C 112 42.733 47.123 -4.390 1
1 1101 . 4 1 1 A 112 112 GLY N N 112 110.442 108.052 2.390 1
1 1102 . 4 1 1 A 113 113 GLY H H 113 8.097 8.159 -0.062 1
1 1103 . 4 1 1 A 113 113 GLY HA2 H 113 3.831 3.726 0.105 1
1 1104 . 4 1 1 A 113 113 GLY HA3 H 113 3.785 3.728 0.057 1
1 1105 . 4 1 1 A 113 113 GLY CA C 113 42.435 47.133 -4.698 1
1 1106 . 4 1 1 A 113 113 GLY N N 113 108.745 109.652 -0.907 1
1 2 . 5 1 1 A 3 3 HIS CB C 3 33.709 31.500 2.209 1
1 3 . 5 1 1 A 7 7 HIS H H 7 8.731 7.363 1.368 1
1 4 . 5 1 1 A 7 7 HIS HA H 7 4.564 5.334 -0.770 1
1 7 . 5 1 1 A 7 7 HIS CA C 7 53.649 54.378 -0.729 1
1 8 . 5 1 1 A 7 7 HIS CB C 7 26.268 32.150 -5.882 1
1 9 . 5 1 1 A 7 7 HIS N N 7 121.126 120.876 0.250 1
1 10 . 5 1 1 A 8 8 GLY H H 8 8.540 8.207 0.333 1
1 11 . 5 1 1 A 8 8 GLY HA2 H 8 3.973 3.636 0.337 1
1 12 . 5 1 1 A 8 8 GLY HA3 H 8 3.811 3.842 -0.031 1
1 13 . 5 1 1 A 8 8 GLY CA C 8 42.618 45.165 -2.547 1
1 14 . 5 1 1 A 8 8 GLY N N 8 110.662 108.006 2.656 1
1 15 . 5 1 1 A 9 9 GLU H H 9 8.239 6.603 1.636 1
1 16 . 5 1 1 A 9 9 GLU HA H 9 4.568 4.309 0.259 1
1 18 . 5 1 1 A 9 9 GLU CA C 9 53.605 54.922 -1.317 1
1 19 . 5 1 1 A 9 9 GLU CB C 9 28.019 30.185 -2.166 1
1 20 . 5 1 1 A 9 9 GLU N N 9 121.669 118.938 2.731 1
1 21 . 5 1 1 A 10 10 PHE H H 10 8.785 6.976 1.809 1
1 22 . 5 1 1 A 10 10 PHE HA H 10 4.850 5.088 -0.238 1
1 25 . 5 1 1 A 10 10 PHE CA C 10 52.630 56.526 -3.896 1
1 26 . 5 1 1 A 10 10 PHE CB C 10 37.906 41.372 -3.466 1
1 27 . 5 1 1 A 10 10 PHE N N 10 118.401 119.318 -0.917 1
1 28 . 5 1 1 A 11 11 GLN H H 11 8.552 8.623 -0.071 1
1 29 . 5 1 1 A 11 11 GLN HA H 11 5.425 4.988 0.437 1
1 34 . 5 1 1 A 11 11 GLN CA C 11 51.663 54.558 -2.895 1
1 35 . 5 1 1 A 11 11 GLN CB C 11 28.427 30.563 -2.136 1
1 37 . 5 1 1 A 11 11 GLN N N 11 117.519 122.050 -4.531 1
1 38 . 5 1 1 A 12 12 ILE H H 12 8.239 8.151 0.088 1
1 39 . 5 1 1 A 12 12 ILE HA H 12 4.103 4.509 -0.406 1
1 49 . 5 1 1 A 12 12 ILE CA C 12 57.134 59.607 -2.473 1
1 50 . 5 1 1 A 12 12 ILE CB C 12 39.491 39.906 -0.415 1
1 54 . 5 1 1 A 12 12 ILE N N 12 114.043 121.661 -7.618 1
1 55 . 5 1 1 A 13 13 PHE H H 13 8.538 8.551 -0.013 1
1 56 . 5 1 1 A 13 13 PHE HA H 13 5.620 5.385 0.235 1
1 59 . 5 1 1 A 13 13 PHE CA C 13 52.438 56.391 -3.953 1
1 60 . 5 1 1 A 13 13 PHE CB C 13 39.253 42.852 -3.599 1
1 61 . 5 1 1 A 13 13 PHE N N 13 117.015 119.558 -2.543 1
1 62 . 5 1 1 A 14 14 ALA H H 14 9.238 9.445 -0.207 1
1 63 . 5 1 1 A 14 14 ALA HA H 14 5.311 5.455 -0.144 1
1 67 . 5 1 1 A 14 14 ALA CA C 14 47.183 49.933 -2.750 1
1 68 . 5 1 1 A 14 14 ALA CB C 14 17.811 22.678 -4.867 1
1 69 . 5 1 1 A 14 14 ALA N N 14 123.503 124.206 -0.703 1
1 70 . 5 1 1 A 15 15 LYS H H 15 8.810 9.347 -0.537 1
1 71 . 5 1 1 A 15 15 LYS HA H 15 5.511 5.431 0.080 1
1 80 . 5 1 1 A 15 15 LYS CA C 15 51.718 54.785 -3.067 1
1 81 . 5 1 1 A 15 15 LYS CB C 15 33.635 35.844 -2.209 1
1 85 . 5 1 1 A 15 15 LYS N N 15 123.382 122.371 1.011 1
1 86 . 5 1 1 A 16 16 THR H H 16 8.830 8.523 0.307 1
1 87 . 5 1 1 A 16 16 THR HA H 16 5.212 5.230 -0.018 1
1 92 . 5 1 1 A 16 16 THR CA C 16 57.614 60.771 -3.157 1
1 93 . 5 1 1 A 16 16 THR CB C 16 68.210 71.328 -3.118 1
1 95 . 5 1 1 A 16 16 THR N N 16 116.517 116.310 0.207 1
1 96 . 5 1 1 A 17 17 LEU H H 17 9.428 8.933 0.495 1
1 97 . 5 1 1 A 17 17 LEU HA H 17 4.286 4.027 0.259 1
1 107 . 5 1 1 A 17 17 LEU CA C 17 54.504 58.470 -3.966 1
1 108 . 5 1 1 A 17 17 LEU CB C 17 38.564 41.491 -2.927 1
1 112 . 5 1 1 A 17 17 LEU N N 17 121.786 123.360 -1.574 1
1 113 . 5 1 1 A 18 18 THR H H 18 7.546 7.859 -0.313 1
1 114 . 5 1 1 A 18 18 THR HA H 18 4.391 4.246 0.145 1
1 119 . 5 1 1 A 18 18 THR CA C 18 58.524 63.586 -5.062 1
1 120 . 5 1 1 A 18 18 THR CB C 18 66.166 70.474 -4.308 1
1 122 . 5 1 1 A 18 18 THR N N 18 105.598 109.293 -3.695 1
1 123 . 5 1 1 A 19 19 GLY H H 19 7.683 8.151 -0.468 1
1 124 . 5 1 1 A 19 19 GLY HA2 H 19 3.300 3.953 -0.653 1
1 125 . 5 1 1 A 19 19 GLY HA3 H 19 4.248 3.970 0.278 1
1 126 . 5 1 1 A 19 19 GLY CA C 19 42.947 45.937 -2.990 1
1 127 . 5 1 1 A 19 19 GLY N N 19 109.243 112.163 -2.920 1
1 128 . 5 1 1 A 20 20 LYS H H 20 7.375 7.549 -0.174 1
1 129 . 5 1 1 A 20 20 LYS HA H 20 4.331 4.658 -0.327 1
1 138 . 5 1 1 A 20 20 LYS CA C 20 53.829 55.108 -1.279 1
1 139 . 5 1 1 A 20 20 LYS CB C 20 30.385 33.767 -3.382 1
1 143 . 5 1 1 A 20 20 LYS N N 20 122.757 121.130 1.627 1
1 144 . 5 1 1 A 21 21 THR H H 21 8.637 8.744 -0.107 1
1 145 . 5 1 1 A 21 21 THR HA H 21 4.852 4.813 0.039 1
1 150 . 5 1 1 A 21 21 THR CA C 21 59.846 62.643 -2.797 1
1 151 . 5 1 1 A 21 21 THR CB C 21 67.140 69.675 -2.535 1
1 153 . 5 1 1 A 21 21 THR N N 21 121.524 123.282 -1.758 1
1 154 . 5 1 1 A 22 22 ILE H H 22 9.509 9.150 0.359 1
1 155 . 5 1 1 A 22 22 ILE HA H 22 4.349 4.893 -0.544 1
1 165 . 5 1 1 A 22 22 ILE CA C 22 57.634 60.158 -2.524 1
1 166 . 5 1 1 A 22 22 ILE CB C 22 38.334 41.771 -3.437 1
1 170 . 5 1 1 A 22 22 ILE N N 22 129.772 127.433 2.339 1
1 171 . 5 1 1 A 23 23 THR H H 23 8.838 8.928 -0.090 1
1 172 . 5 1 1 A 23 23 THR HA H 23 4.653 4.956 -0.303 1
1 177 . 5 1 1 A 23 23 THR CA C 23 60.194 61.761 -1.567 1
1 178 . 5 1 1 A 23 23 THR CB C 23 66.577 70.145 -3.568 1
1 180 . 5 1 1 A 23 23 THR N N 23 124.070 123.785 0.285 1
1 181 . 5 1 1 A 24 24 LEU H H 24 8.749 8.474 0.275 1
1 182 . 5 1 1 A 24 24 LEU HA H 24 4.619 5.074 -0.455 1
1 192 . 5 1 1 A 24 24 LEU CA C 24 50.257 52.763 -2.506 1
1 193 . 5 1 1 A 24 24 LEU CB C 24 42.932 45.502 -2.570 1
1 197 . 5 1 1 A 24 24 LEU N N 24 126.499 123.456 3.043 1
1 198 . 5 1 1 A 25 25 GLU H H 25 7.990 8.527 -0.537 1
1 199 . 5 1 1 A 25 25 GLU HA H 25 4.591 4.547 0.044 1
1 204 . 5 1 1 A 25 25 GLU CA C 25 52.845 56.295 -3.450 1
1 205 . 5 1 1 A 25 25 GLU CB C 25 27.210 30.116 -2.906 1
1 207 . 5 1 1 A 25 25 GLU N N 25 121.644 121.257 0.387 1
1 208 . 5 1 1 A 26 26 VAL H H 26 8.657 8.767 -0.110 1
1 209 . 5 1 1 A 26 26 VAL HA H 26 4.403 5.055 -0.652 1
1 217 . 5 1 1 A 26 26 VAL CA C 26 56.020 58.819 -2.799 1
1 218 . 5 1 1 A 26 26 VAL CB C 26 33.631 36.569 -2.938 1
1 221 . 5 1 1 A 26 26 VAL N N 26 116.647 118.030 -1.383 1
1 222 . 5 1 1 A 27 27 GLU H H 27 7.970 8.667 -0.697 1
1 223 . 5 1 1 A 27 27 GLU HA H 27 4.447 4.857 -0.410 1
1 228 . 5 1 1 A 27 27 GLU CA C 27 51.386 54.669 -3.283 1
1 229 . 5 1 1 A 27 27 GLU CB C 27 30.905 32.075 -1.170 1
1 231 . 5 1 1 A 27 27 GLU N N 27 115.496 120.780 -5.284 1
1 232 . 5 1 1 A 28 28 SER H H 28 9.192 8.795 0.397 1
1 233 . 5 1 1 A 28 28 SER HA H 28 4.108 4.415 -0.307 1
1 236 . 5 1 1 A 28 28 SER CA C 28 59.909 60.867 -0.958 1
1 237 . 5 1 1 A 28 28 SER CB C 28 60.399 62.787 -2.388 1
1 238 . 5 1 1 A 28 28 SER N N 28 117.720 117.397 0.323 1
1 239 . 5 1 1 A 29 29 SER H H 29 7.371 7.757 -0.386 1
1 240 . 5 1 1 A 29 29 SER HA H 29 4.327 4.682 -0.355 1
1 243 . 5 1 1 A 29 29 SER CA C 29 54.805 57.997 -3.192 1
1 244 . 5 1 1 A 29 29 SER CB C 29 60.775 64.335 -3.560 1
1 245 . 5 1 1 A 29 29 SER N N 29 108.936 114.392 -5.456 1
1 246 . 5 1 1 A 30 30 ASP H H 30 7.852 7.499 0.353 1
1 247 . 5 1 1 A 30 30 ASP HA H 30 4.591 4.502 0.089 1
1 250 . 5 1 1 A 30 30 ASP CA C 30 53.040 54.571 -1.531 1
1 251 . 5 1 1 A 30 30 ASP CB C 30 37.942 41.605 -3.663 1
1 252 . 5 1 1 A 30 30 ASP N N 30 123.735 123.132 0.603 1
1 253 . 5 1 1 A 31 31 THR H H 31 7.852 8.429 -0.577 1
1 254 . 5 1 1 A 31 31 THR HA H 31 4.918 4.830 0.088 1
1 259 . 5 1 1 A 31 31 THR CA C 31 56.929 60.191 -3.262 1
1 260 . 5 1 1 A 31 31 THR CB C 31 68.674 71.510 -2.836 1
1 262 . 5 1 1 A 31 31 THR N N 31 109.181 113.266 -4.085 1
1 263 . 5 1 1 A 32 32 ILE H H 32 8.582 8.793 -0.211 1
1 264 . 5 1 1 A 32 32 ILE HA H 32 3.624 3.827 -0.203 1
1 274 . 5 1 1 A 32 32 ILE CA C 32 59.474 65.558 -6.084 1
1 275 . 5 1 1 A 32 32 ILE CB C 32 31.561 37.843 -6.282 1
1 279 . 5 1 1 A 32 32 ILE N N 32 121.833 122.861 -1.028 1
1 280 . 5 1 1 A 33 33 ASP H H 33 9.255 8.025 1.230 1
1 281 . 5 1 1 A 33 33 ASP HA H 33 4.201 4.334 -0.133 1
1 284 . 5 1 1 A 33 33 ASP CA C 33 54.679 57.415 -2.736 1
1 285 . 5 1 1 A 33 33 ASP CB C 33 37.700 40.154 -2.454 1
1 286 . 5 1 1 A 33 33 ASP N N 33 119.823 120.511 -0.688 1
1 287 . 5 1 1 A 34 34 ASN H H 34 8.026 7.726 0.300 1
1 288 . 5 1 1 A 34 34 ASN HA H 34 4.409 4.689 -0.280 1
1 291 . 5 1 1 A 34 34 ASN CA C 34 53.324 56.199 -2.875 1
1 292 . 5 1 1 A 34 34 ASN CB C 34 35.782 38.801 -3.019 1
1 293 . 5 1 1 A 34 34 ASN N N 34 119.540 117.530 2.010 1
1 294 . 5 1 1 A 35 35 VAL H H 35 8.167 8.598 -0.431 1
1 295 . 5 1 1 A 35 35 VAL HA H 35 3.249 3.462 -0.213 1
1 303 . 5 1 1 A 35 35 VAL CA C 35 65.308 67.356 -2.048 1
1 304 . 5 1 1 A 35 35 VAL CB C 35 27.965 31.379 -3.414 1
1 307 . 5 1 1 A 35 35 VAL N N 35 122.223 120.309 1.914 1
1 308 . 5 1 1 A 36 36 LYS H H 36 8.460 8.631 -0.171 1
1 313 . 5 1 1 A 36 36 LYS CB C 36 30.753 32.221 -1.468 1
1 315 . 5 1 1 A 36 36 LYS N N 36 119.438 119.350 0.088 1
1 316 . 5 1 1 A 37 37 SER H H 37 8.196 8.495 -0.299 1
1 317 . 5 1 1 A 37 37 SER HA H 37 4.130 4.177 -0.047 1
1 320 . 5 1 1 A 37 37 SER CA C 37 58.528 61.266 -2.738 1
1 321 . 5 1 1 A 37 37 SER CB C 37 59.768 62.661 -2.893 1
1 322 . 5 1 1 A 37 37 SER N N 37 117.791 114.294 3.497 1
1 323 . 5 1 1 A 38 38 LYS H H 38 8.043 8.355 -0.312 1
1 324 . 5 1 1 A 38 38 LYS HA H 38 4.095 4.014 0.081 1
1 325 . 5 1 1 A 38 38 LYS CA C 38 57.377 58.994 -1.617 1
1 326 . 5 1 1 A 38 38 LYS N N 38 124.094 120.834 3.260 1
1 327 . 5 1 1 A 39 39 ILE H H 39 8.254 8.092 0.162 1
1 328 . 5 1 1 A 39 39 ILE HA H 39 3.439 3.851 -0.412 1
1 338 . 5 1 1 A 39 39 ILE CA C 39 63.977 63.978 -0.001 1
1 339 . 5 1 1 A 39 39 ILE CB C 39 33.935 37.373 -3.438 1
1 343 . 5 1 1 A 39 39 ILE N N 39 122.107 120.323 1.784 1
1 344 . 5 1 1 A 40 40 GLN H H 40 8.379 8.462 -0.083 1
1 345 . 5 1 1 A 40 40 GLN HA H 40 3.746 4.044 -0.298 1
1 350 . 5 1 1 A 40 40 GLN CA C 40 57.472 58.199 -0.727 1
1 351 . 5 1 1 A 40 40 GLN CB C 40 25.072 27.769 -2.697 1
1 353 . 5 1 1 A 40 40 GLN N N 40 123.725 119.615 4.110 1
1 354 . 5 1 1 A 41 41 ASP H H 41 8.210 7.898 0.312 1
1 355 . 5 1 1 A 41 41 ASP HA H 41 4.247 4.385 -0.138 1
1 358 . 5 1 1 A 41 41 ASP CA C 41 54.646 56.576 -1.930 1
1 359 . 5 1 1 A 41 41 ASP CB C 41 38.136 40.968 -2.832 1
1 360 . 5 1 1 A 41 41 ASP N N 41 120.564 120.628 -0.064 1
1 361 . 5 1 1 A 42 42 LYS H H 42 7.381 8.207 -0.826 1
1 362 . 5 1 1 A 42 42 LYS HA H 42 4.246 4.314 -0.068 1
1 369 . 5 1 1 A 42 42 LYS CA C 42 55.579 57.719 -2.140 1
1 370 . 5 1 1 A 42 42 LYS CB C 42 31.406 33.530 -2.124 1
1 373 . 5 1 1 A 42 42 LYS N N 42 115.674 116.506 -0.832 1
1 374 . 5 1 1 A 43 43 GLU H H 43 8.537 8.364 0.173 1
1 375 . 5 1 1 A 43 43 GLU HA H 43 4.522 4.521 0.001 1
1 380 . 5 1 1 A 43 43 GLU CA C 43 52.772 55.776 -3.004 1
1 381 . 5 1 1 A 43 43 GLU CB C 43 30.535 30.914 -0.379 1
1 383 . 5 1 1 A 43 43 GLU N N 43 114.355 116.222 -1.867 1
1 384 . 5 1 1 A 44 44 GLY H H 44 8.611 8.494 0.117 1
1 385 . 5 1 1 A 44 44 GLY HA2 H 44 4.067 3.972 0.095 1
1 386 . 5 1 1 A 44 44 GLY HA3 H 44 3.819 3.973 -0.154 1
1 387 . 5 1 1 A 44 44 GLY CA C 44 43.205 45.579 -2.374 1
1 388 . 5 1 1 A 44 44 GLY N N 44 109.406 108.471 0.935 1
1 389 . 5 1 1 A 45 45 ILE H H 45 6.092 8.103 -2.011 1
1 390 . 5 1 1 A 45 45 ILE HA H 45 4.324 4.128 0.196 1
1 400 . 5 1 1 A 45 45 ILE CA C 45 55.211 60.112 -4.901 1
1 401 . 5 1 1 A 45 45 ILE CB C 45 37.903 38.490 -0.587 1
1 405 . 5 1 1 A 45 45 ILE N N 45 120.791 122.481 -1.690 1
1 406 . 5 1 1 A 46 46 PRO HA H 46 4.547 4.561 -0.014 1
1 413 . 5 1 1 A 46 46 PRO CA C 46 58.971 62.017 -3.046 1
1 414 . 5 1 1 A 46 46 PRO CB C 46 29.142 32.363 -3.221 1
1 417 . 5 1 1 A 47 47 PRO HA H 47 4.062 4.231 -0.169 1
1 424 . 5 1 1 A 47 47 PRO CA C 47 63.476 65.873 -2.397 1
1 425 . 5 1 1 A 47 47 PRO CB C 47 30.113 31.762 -1.649 1
1 428 . 5 1 1 A 48 48 ASP H H 48 8.418 8.440 -0.022 1
1 429 . 5 1 1 A 48 48 ASP HA H 48 4.346 4.346 0.000 1
1 432 . 5 1 1 A 48 48 ASP CA C 48 52.838 57.395 -4.557 1
1 433 . 5 1 1 A 48 48 ASP CB C 48 36.926 40.098 -3.172 1
1 434 . 5 1 1 A 48 48 ASP N N 48 113.462 117.326 -3.864 1
1 435 . 5 1 1 A 49 49 GLN H H 49 7.822 7.812 0.010 1
1 436 . 5 1 1 A 49 49 GLN HA H 49 4.283 4.109 0.174 1
1 439 . 5 1 1 A 49 49 GLN CA C 49 52.770 57.847 -5.077 1
1 441 . 5 1 1 A 49 49 GLN N N 49 117.377 117.824 -0.447 1
1 442 . 5 1 1 A 50 50 GLN H H 50 7.451 7.731 -0.280 1
1 443 . 5 1 1 A 50 50 GLN HA H 50 4.260 4.795 -0.535 1
1 448 . 5 1 1 A 50 50 GLN CA C 50 53.725 54.643 -0.918 1
1 449 . 5 1 1 A 50 50 GLN CB C 50 29.142 32.259 -3.117 1
1 451 . 5 1 1 A 50 50 GLN N N 50 117.526 117.993 -0.467 1
1 452 . 5 1 1 A 51 51 ARG H H 51 8.534 9.002 -0.468 1
1 453 . 5 1 1 A 51 51 ARG HA H 51 4.486 5.160 -0.674 1
1 460 . 5 1 1 A 51 51 ARG CA C 51 52.492 54.444 -1.952 1
1 461 . 5 1 1 A 51 51 ARG CB C 51 29.096 34.268 -5.172 1
1 464 . 5 1 1 A 51 51 ARG N N 51 121.655 118.462 3.193 1
1 465 . 5 1 1 A 52 52 LEU H H 52 8.683 8.757 -0.074 1
1 466 . 5 1 1 A 52 52 LEU HA H 52 5.255 5.264 -0.009 1
1 476 . 5 1 1 A 52 52 LEU CA C 52 50.618 53.312 -2.694 1
1 477 . 5 1 1 A 52 52 LEU CB C 52 43.007 44.784 -1.777 1
1 481 . 5 1 1 A 52 52 LEU N N 52 122.929 121.362 1.567 1
1 482 . 5 1 1 A 53 53 ILE H H 53 9.286 8.810 0.476 1
1 483 . 5 1 1 A 53 53 ILE HA H 53 5.096 5.133 -0.037 1
1 492 . 5 1 1 A 53 53 ILE CA C 53 56.795 60.251 -3.456 1
1 496 . 5 1 1 A 53 53 ILE N N 53 124.718 123.779 0.939 1
1 497 . 5 1 1 A 54 54 TRP H H 54 8.871 8.875 -0.004 1
1 499 . 5 1 1 A 54 54 TRP N N 54 127.412 128.489 -1.077 1
1 501 . 5 1 1 A 55 55 ALA H H 55 8.401 8.529 -0.128 1
1 502 . 5 1 1 A 55 55 ALA HA H 55 3.183 3.295 -0.112 1
1 506 . 5 1 1 A 55 55 ALA CA C 55 49.712 52.638 -2.926 1
1 507 . 5 1 1 A 55 55 ALA CB C 55 13.252 17.056 -3.804 1
1 508 . 5 1 1 A 55 55 ALA N N 55 128.894 129.766 -0.872 1
1 509 . 5 1 1 A 56 56 GLY H H 56 8.248 8.425 -0.177 1
1 510 . 5 1 1 A 56 56 GLY HA2 H 56 3.968 3.731 0.237 1
1 511 . 5 1 1 A 56 56 GLY HA3 H 56 3.916 3.753 0.163 1
1 512 . 5 1 1 A 56 56 GLY CA C 56 43.142 45.458 -2.316 1
1 513 . 5 1 1 A 56 56 GLY N N 56 101.499 102.361 -0.862 1
1 514 . 5 1 1 A 57 57 LYS H H 57 8.028 7.270 0.758 1
1 515 . 5 1 1 A 57 57 LYS HA H 57 4.609 4.705 -0.096 1
1 522 . 5 1 1 A 57 57 LYS CA C 57 51.928 54.706 -2.778 1
1 523 . 5 1 1 A 57 57 LYS CB C 57 32.613 35.035 -2.422 1
1 526 . 5 1 1 A 57 57 LYS N N 57 118.995 121.169 -2.174 1
1 527 . 5 1 1 A 58 58 GLN H H 58 8.607 8.482 0.125 1
1 528 . 5 1 1 A 58 58 GLN HA H 58 4.617 4.468 0.149 1
1 533 . 5 1 1 A 58 58 GLN CA C 58 53.261 56.072 -2.811 1
1 534 . 5 1 1 A 58 58 GLN CB C 58 26.613 28.823 -2.210 1
1 536 . 5 1 1 A 58 58 GLN N N 58 119.825 125.551 -5.726 1
1 537 . 5 1 1 A 59 59 LEU H H 59 8.653 9.085 -0.432 1
1 538 . 5 1 1 A 59 59 LEU HA H 59 4.138 4.401 -0.263 1
1 548 . 5 1 1 A 59 59 LEU CA C 59 51.991 55.326 -3.335 1
1 549 . 5 1 1 A 59 59 LEU CB C 59 39.006 42.158 -3.152 1
1 553 . 5 1 1 A 59 59 LEU N N 59 125.484 125.518 -0.034 1
1 554 . 5 1 1 A 60 60 GLU H H 60 8.461 8.744 -0.283 1
1 555 . 5 1 1 A 60 60 GLU HA H 60 4.371 4.407 -0.036 1
1 559 . 5 1 1 A 60 60 GLU CA C 60 53.436 56.640 -3.204 1
1 560 . 5 1 1 A 60 60 GLU CB C 60 29.057 30.230 -1.173 1
1 562 . 5 1 1 A 60 60 GLU N N 60 123.237 124.951 -1.714 1
1 563 . 5 1 1 A 61 61 ASP H H 61 8.076 8.843 -0.767 1
1 564 . 5 1 1 A 61 61 ASP HA H 61 4.265 4.373 -0.108 1
1 567 . 5 1 1 A 61 61 ASP CA C 61 54.398 56.286 -1.888 1
1 568 . 5 1 1 A 61 61 ASP CB C 61 38.340 39.989 -1.649 1
1 569 . 5 1 1 A 61 61 ASP N N 61 120.701 123.253 -2.552 1
1 570 . 5 1 1 A 62 62 GLY HA2 H 62 4.104 3.988 0.116 1
1 571 . 5 1 1 A 62 62 GLY HA3 H 62 3.832 3.988 -0.156 1
1 572 . 5 1 1 A 62 62 GLY CA C 62 42.576 45.287 -2.711 1
1 573 . 5 1 1 A 63 63 ARG H H 63 7.319 8.173 -0.854 1
1 574 . 5 1 1 A 63 63 ARG HA H 63 4.595 4.639 -0.044 1
1 579 . 5 1 1 A 63 63 ARG CA C 63 51.971 55.111 -3.140 1
1 582 . 5 1 1 A 63 63 ARG N N 63 119.206 120.366 -1.160 1
1 583 . 5 1 1 A 64 64 THR H H 64 8.735 8.600 0.135 1
1 584 . 5 1 1 A 64 64 THR HA H 64 5.208 4.927 0.281 1
1 589 . 5 1 1 A 64 64 THR CA C 64 57.126 59.755 -2.629 1
1 590 . 5 1 1 A 64 64 THR CB C 64 69.885 71.843 -1.958 1
1 592 . 5 1 1 A 64 64 THR N N 64 108.713 111.829 -3.116 1
1 593 . 5 1 1 A 65 65 LEU H H 65 8.241 9.132 -0.891 1
1 594 . 5 1 1 A 65 65 LEU HA H 65 4.003 4.045 -0.042 1
1 604 . 5 1 1 A 65 65 LEU CA C 65 56.409 57.555 -1.146 1
1 605 . 5 1 1 A 65 65 LEU CB C 65 37.179 41.438 -4.259 1
1 609 . 5 1 1 A 65 65 LEU N N 65 118.111 122.590 -4.479 1
1 610 . 5 1 1 A 66 66 SER H H 66 8.296 8.083 0.213 1
1 611 . 5 1 1 A 66 66 SER HA H 66 4.201 4.292 -0.091 1
1 614 . 5 1 1 A 66 66 SER CA C 66 58.454 60.661 -2.207 1
1 615 . 5 1 1 A 66 66 SER CB C 66 59.969 62.975 -3.006 1
1 616 . 5 1 1 A 66 66 SER N N 66 113.148 114.302 -1.154 1
1 617 . 5 1 1 A 67 67 ASP H H 67 7.984 8.184 -0.200 1
1 618 . 5 1 1 A 67 67 ASP HA H 67 4.187 4.196 -0.009 1
1 621 . 5 1 1 A 67 67 ASP CA C 67 54.744 56.586 -1.842 1
1 622 . 5 1 1 A 67 67 ASP CB C 67 37.794 40.143 -2.349 1
1 623 . 5 1 1 A 67 67 ASP N N 67 124.130 121.158 2.972 1
1 624 . 5 1 1 A 68 68 TYR H H 68 7.177 7.126 0.051 1
1 625 . 5 1 1 A 68 68 TYR N N 68 115.334 116.179 -0.845 1
1 626 . 5 1 1 A 69 69 ASN H H 69 8.111 8.165 -0.054 1
1 627 . 5 1 1 A 69 69 ASN HA H 69 4.253 4.363 -0.110 1
1 630 . 5 1 1 A 69 69 ASN CA C 69 51.386 54.217 -2.831 1
1 631 . 5 1 1 A 69 69 ASN CB C 69 34.867 37.058 -2.191 1
1 632 . 5 1 1 A 69 69 ASN N N 69 116.867 117.179 -0.312 1
1 633 . 5 1 1 A 70 70 ILE H H 70 7.460 7.695 -0.235 1
1 634 . 5 1 1 A 70 70 ILE HA H 70 3.210 4.047 -0.837 1
1 644 . 5 1 1 A 70 70 ILE CA C 70 60.157 62.166 -2.009 1
1 645 . 5 1 1 A 70 70 ILE CB C 70 34.754 37.443 -2.689 1
1 649 . 5 1 1 A 70 70 ILE N N 70 119.821 119.661 0.160 1
1 650 . 5 1 1 A 71 71 GLN H H 71 7.368 8.972 -1.604 1
1 651 . 5 1 1 A 71 71 GLN HA H 71 4.099 4.811 -0.712 1
1 656 . 5 1 1 A 71 71 GLN CA C 71 50.906 54.935 -4.029 1
1 657 . 5 1 1 A 71 71 GLN CB C 71 28.793 29.791 -0.998 1
1 659 . 5 1 1 A 71 71 GLN N N 71 124.287 126.009 -1.722 1
1 660 . 5 1 1 A 72 72 ARG H H 72 7.583 8.707 -1.124 1
1 661 . 5 1 1 A 72 72 ARG HA H 72 3.907 4.373 -0.466 1
1 668 . 5 1 1 A 72 72 ARG CA C 72 54.527 57.888 -3.361 1
1 669 . 5 1 1 A 72 72 ARG CB C 72 27.470 31.498 -4.028 1
1 672 . 5 1 1 A 72 72 ARG N N 72 119.007 120.567 -1.560 1
1 673 . 5 1 1 A 73 73 GLU H H 73 9.262 8.255 1.007 1
1 674 . 5 1 1 A 73 73 GLU HA H 73 3.586 4.658 -1.072 1
1 679 . 5 1 1 A 73 73 GLU CA C 73 55.703 56.672 -0.969 1
1 680 . 5 1 1 A 73 73 GLU CB C 73 23.669 29.229 -5.560 1
1 682 . 5 1 1 A 73 73 GLU N N 73 115.180 116.945 -1.765 1
1 683 . 5 1 1 A 74 74 SER H H 74 7.551 7.888 -0.337 1
1 684 . 5 1 1 A 74 74 SER HA H 74 4.613 5.166 -0.553 1
1 687 . 5 1 1 A 74 74 SER CA C 74 58.305 56.051 2.254 1
1 688 . 5 1 1 A 74 74 SER CB C 74 62.156 65.031 -2.875 1
1 689 . 5 1 1 A 74 74 SER N N 74 115.104 114.592 0.512 1
1 690 . 5 1 1 A 75 75 THR H H 75 8.785 8.714 0.071 1
1 691 . 5 1 1 A 75 75 THR HA H 75 5.014 4.749 0.265 1
1 696 . 5 1 1 A 75 75 THR CA C 75 59.835 61.907 -2.072 1
1 697 . 5 1 1 A 75 75 THR CB C 75 67.258 68.724 -1.466 1
1 699 . 5 1 1 A 75 75 THR N N 75 118.401 119.981 -1.580 1
1 700 . 5 1 1 A 76 76 LEU H H 76 9.447 9.711 -0.264 1
1 701 . 5 1 1 A 76 76 LEU HA H 76 4.930 4.216 0.714 1
1 711 . 5 1 1 A 76 76 LEU CA C 76 51.107 54.303 -3.196 1
1 712 . 5 1 1 A 76 76 LEU CB C 76 40.841 42.593 -1.752 1
1 716 . 5 1 1 A 76 76 LEU N N 76 127.905 128.135 -0.230 1
1 717 . 5 1 1 A 77 77 HIS HA H 77 4.976 5.361 -0.385 1
1 720 . 5 1 1 A 77 77 HIS CA C 77 53.776 54.295 -0.519 1
1 721 . 5 1 1 A 77 77 HIS CB C 77 28.438 31.861 -3.423 1
1 722 . 5 1 1 A 78 78 LEU H H 78 8.450 8.767 -0.317 1
1 723 . 5 1 1 A 78 78 LEU HA H 78 5.085 5.131 -0.046 1
1 733 . 5 1 1 A 78 78 LEU CA C 78 50.896 53.619 -2.723 1
1 734 . 5 1 1 A 78 78 LEU CB C 78 41.916 45.090 -3.174 1
1 738 . 5 1 1 A 78 78 LEU N N 78 126.178 126.230 -0.052 1
1 739 . 5 1 1 A 79 79 VAL H H 79 9.093 9.595 -0.502 1
1 740 . 5 1 1 A 79 79 VAL HA H 79 4.053 4.809 -0.756 1
1 748 . 5 1 1 A 79 79 VAL CA C 79 59.054 61.145 -2.091 1
1 749 . 5 1 1 A 79 79 VAL CB C 79 32.115 33.424 -1.309 1
1 752 . 5 1 1 A 79 79 VAL N N 79 128.372 126.261 2.111 1
1 753 . 5 1 1 A 80 80 LEU H H 80 8.000 9.024 -1.024 1
1 754 . 5 1 1 A 80 80 LEU HA H 80 5.105 5.008 0.097 1
1 764 . 5 1 1 A 80 80 LEU CA C 80 50.556 53.846 -3.290 1
1 765 . 5 1 1 A 80 80 LEU CB C 80 39.597 42.038 -2.441 1
1 769 . 5 1 1 A 80 80 LEU N N 80 126.145 128.580 -2.435 1
1 770 . 5 1 1 A 81 81 ARG H H 81 8.470 8.654 -0.184 1
1 771 . 5 1 1 A 81 81 ARG HA H 81 4.197 4.276 -0.079 1
1 778 . 5 1 1 A 81 81 ARG CA C 81 53.133 56.085 -2.952 1
1 779 . 5 1 1 A 81 81 ARG CB C 81 28.413 30.479 -2.066 1
1 782 . 5 1 1 A 81 81 ARG N N 81 121.625 125.863 -4.238 1
1 783 . 5 1 1 A 82 82 LEU H H 82 8.454 8.368 0.086 1
1 784 . 5 1 1 A 82 82 LEU HA H 82 4.339 4.458 -0.119 1
1 794 . 5 1 1 A 82 82 LEU CA C 82 52.081 54.731 -2.650 1
1 795 . 5 1 1 A 82 82 LEU CB C 82 39.810 41.967 -2.157 1
1 799 . 5 1 1 A 82 82 LEU N N 82 123.832 125.762 -1.930 1
1 800 . 5 1 1 A 83 83 ARG H H 83 8.404 8.629 -0.225 1
1 801 . 5 1 1 A 83 83 ARG HA H 83 4.308 4.085 0.223 1
1 808 . 5 1 1 A 83 83 ARG CA C 83 53.258 58.206 -4.948 1
1 809 . 5 1 1 A 83 83 ARG CB C 83 28.160 29.973 -1.813 1
1 812 . 5 1 1 A 83 83 ARG N N 83 121.447 125.308 -3.861 1
1 813 . 5 1 1 A 84 84 GLY H H 84 8.410 7.870 0.540 1
1 814 . 5 1 1 A 84 84 GLY HA2 H 84 3.929 4.059 -0.130 1
1 815 . 5 1 1 A 84 84 GLY HA3 H 84 3.929 4.059 -0.130 1
1 816 . 5 1 1 A 84 84 GLY CA C 84 42.751 44.940 -2.189 1
1 817 . 5 1 1 A 84 84 GLY N N 84 110.030 109.469 0.561 1
1 818 . 5 1 1 A 85 85 GLY H H 85 8.295 8.545 -0.250 1
1 819 . 5 1 1 A 85 85 GLY HA2 H 85 3.950 3.887 0.063 1
1 820 . 5 1 1 A 85 85 GLY HA3 H 85 3.950 3.887 0.063 1
1 821 . 5 1 1 A 85 85 GLY CA C 85 42.831 47.003 -4.172 1
1 822 . 5 1 1 A 85 85 GLY N N 85 108.838 108.931 -0.093 1
1 823 . 5 1 1 A 86 86 SER H H 86 8.292 7.901 0.391 1
1 824 . 5 1 1 A 86 86 SER HA H 86 4.405 4.907 -0.502 1
1 827 . 5 1 1 A 86 86 SER CA C 86 55.965 57.088 -1.123 1
1 828 . 5 1 1 A 86 86 SER CB C 86 61.232 65.464 -4.232 1
1 829 . 5 1 1 A 86 86 SER N N 86 116.028 113.299 2.729 1
1 830 . 5 1 1 A 87 87 MET H H 87 8.470 9.079 -0.609 1
1 831 . 5 1 1 A 87 87 MET HA H 87 4.447 4.143 0.304 1
1 836 . 5 1 1 A 87 87 MET CA C 87 53.281 55.848 -2.567 1
1 837 . 5 1 1 A 87 87 MET CB C 87 29.788 33.574 -3.786 1
1 839 . 5 1 1 A 87 87 MET N N 87 121.625 126.423 -4.798 1
1 840 . 5 1 1 A 88 88 GLY H H 88 8.320 7.719 0.601 1
1 841 . 5 1 1 A 88 88 GLY HA2 H 88 3.919 3.956 -0.037 1
1 842 . 5 1 1 A 88 88 GLY HA3 H 88 3.896 3.956 -0.060 1
1 843 . 5 1 1 A 88 88 GLY CA C 88 43.060 45.424 -2.364 1
1 844 . 5 1 1 A 88 88 GLY N N 88 109.625 107.357 2.268 1
1 845 . 5 1 1 A 89 89 GLY H H 89 8.256 8.075 0.181 1
1 846 . 5 1 1 A 89 89 GLY HA2 H 89 3.940 4.047 -0.107 1
1 847 . 5 1 1 A 89 89 GLY HA3 H 89 3.910 4.048 -0.138 1
1 848 . 5 1 1 A 89 89 GLY CA C 89 42.678 44.333 -1.655 1
1 849 . 5 1 1 A 89 89 GLY N N 89 108.982 108.562 0.420 1
1 850 . 5 1 1 A 90 90 ALA H H 90 8.203 8.209 -0.006 1
1 851 . 5 1 1 A 90 90 ALA HA H 90 4.255 4.209 0.046 1
1 855 . 5 1 1 A 90 90 ALA CA C 90 50.763 54.492 -3.729 1
1 856 . 5 1 1 A 90 90 ALA CB C 90 16.364 18.929 -2.565 1
1 857 . 5 1 1 A 90 90 ALA N N 90 124.065 124.191 -0.126 1
1 858 . 5 1 1 A 91 91 ALA H H 91 8.273 7.988 0.285 1
1 859 . 5 1 1 A 91 91 ALA HA H 91 4.204 4.391 -0.187 1
1 863 . 5 1 1 A 91 91 ALA CA C 91 51.080 51.835 -0.755 1
1 864 . 5 1 1 A 91 91 ALA CB C 91 16.036 19.587 -3.551 1
1 865 . 5 1 1 A 91 91 ALA N N 91 121.985 119.686 2.299 1
1 866 . 5 1 1 A 92 92 ASP H H 92 8.022 8.735 -0.713 1
1 867 . 5 1 1 A 92 92 ASP HA H 92 4.455 4.913 -0.458 1
1 870 . 5 1 1 A 92 92 ASP CA C 92 52.664 53.063 -0.399 1
1 871 . 5 1 1 A 92 92 ASP CB C 92 37.925 41.670 -3.745 1
1 872 . 5 1 1 A 92 92 ASP N N 92 118.621 123.415 -4.794 1
1 873 . 5 1 1 A 93 93 GLU H H 93 8.282 8.309 -0.027 1
1 874 . 5 1 1 A 93 93 GLU HA H 93 3.912 3.937 -0.025 1
1 879 . 5 1 1 A 93 93 GLU CA C 93 56.947 57.321 -0.374 1
1 880 . 5 1 1 A 93 93 GLU CB C 93 27.413 28.589 -1.176 1
1 882 . 5 1 1 A 93 93 GLU N N 93 122.247 117.457 4.790 1
1 883 . 5 1 1 A 94 94 GLU H H 94 8.194 7.859 0.335 1
1 884 . 5 1 1 A 94 94 GLU HA H 94 3.940 4.453 -0.513 1
1 889 . 5 1 1 A 94 94 GLU CA C 94 56.681 57.578 -0.897 1
1 890 . 5 1 1 A 94 94 GLU CB C 94 26.127 31.123 -4.996 1
1 892 . 5 1 1 A 94 94 GLU N N 94 118.024 120.481 -2.457 1
1 893 . 5 1 1 A 95 95 GLU H H 95 7.816 8.625 -0.809 1
1 894 . 5 1 1 A 95 95 GLU HA H 95 4.121 4.151 -0.030 1
1 898 . 5 1 1 A 95 95 GLU CA C 95 56.162 58.723 -2.561 1
1 899 . 5 1 1 A 95 95 GLU CB C 95 26.403 28.732 -2.329 1
1 901 . 5 1 1 A 95 95 GLU N N 95 120.028 119.805 0.223 1
1 902 . 5 1 1 A 96 96 LEU H H 96 7.637 7.831 -0.194 1
1 903 . 5 1 1 A 96 96 LEU HA H 96 3.988 4.112 -0.124 1
1 913 . 5 1 1 A 96 96 LEU CA C 96 55.303 57.158 -1.855 1
1 914 . 5 1 1 A 96 96 LEU CB C 96 39.038 41.583 -2.545 1
1 918 . 5 1 1 A 96 96 LEU N N 96 119.866 117.983 1.883 1
1 919 . 5 1 1 A 97 97 ILE H H 97 8.044 7.536 0.508 1
1 920 . 5 1 1 A 97 97 ILE HA H 97 3.478 3.987 -0.509 1
1 930 . 5 1 1 A 97 97 ILE CA C 97 62.054 63.638 -1.584 1
1 931 . 5 1 1 A 97 97 ILE CB C 97 34.541 38.073 -3.532 1
1 935 . 5 1 1 A 97 97 ILE N N 97 119.088 119.421 -0.333 1
1 936 . 5 1 1 A 98 98 ARG H H 98 7.991 8.346 -0.355 1
1 937 . 5 1 1 A 98 98 ARG HA H 98 3.793 4.007 -0.214 1
1 944 . 5 1 1 A 98 98 ARG CA C 98 57.509 58.928 -1.419 1
1 945 . 5 1 1 A 98 98 ARG CB C 98 27.191 30.009 -2.818 1
1 948 . 5 1 1 A 98 98 ARG N N 98 119.225 121.137 -1.912 1
1 949 . 5 1 1 A 99 99 LYS H H 99 8.101 8.129 -0.028 1
1 950 . 5 1 1 A 99 99 LYS HA H 99 3.968 4.052 -0.084 1
1 959 . 5 1 1 A 99 99 LYS CA C 99 56.455 59.009 -2.554 1
1 960 . 5 1 1 A 99 99 LYS CB C 99 29.531 31.838 -2.307 1
1 964 . 5 1 1 A 99 99 LYS N N 99 119.464 117.916 1.548 1
1 965 . 5 1 1 A 100 100 ALA H H 100 8.167 7.879 0.288 1
1 966 . 5 1 1 A 100 100 ALA HA H 100 3.789 4.083 -0.294 1
1 970 . 5 1 1 A 100 100 ALA CA C 100 52.451 54.391 -1.940 1
1 971 . 5 1 1 A 100 100 ALA CB C 100 16.259 18.251 -1.992 1
1 972 . 5 1 1 A 100 100 ALA N N 100 122.398 121.163 1.235 1
1 973 . 5 1 1 A 101 101 ILE H H 101 8.777 7.887 0.890 1
1 974 . 5 1 1 A 101 101 ILE HA H 101 3.191 3.685 -0.494 1
1 984 . 5 1 1 A 101 101 ILE CA C 101 62.910 64.824 -1.914 1
1 985 . 5 1 1 A 101 101 ILE CB C 101 34.544 36.949 -2.405 1
1 989 . 5 1 1 A 101 101 ILE N N 101 120.431 118.774 1.657 1
1 990 . 5 1 1 A 102 102 GLU H H 102 7.890 7.998 -0.108 1
1 991 . 5 1 1 A 102 102 GLU HA H 102 3.848 4.227 -0.379 1
1 996 . 5 1 1 A 102 102 GLU CA C 102 57.079 57.469 -0.390 1
1 997 . 5 1 1 A 102 102 GLU CB C 102 26.769 30.187 -3.418 1
1 999 . 5 1 1 A 102 102 GLU N N 102 120.248 120.536 -0.288 1
1 1000 . 5 1 1 A 103 103 LEU H H 103 8.194 7.659 0.535 1
1 1001 . 5 1 1 A 103 103 LEU HA H 103 3.912 4.195 -0.283 1
1 1011 . 5 1 1 A 103 103 LEU CA C 103 55.078 57.191 -2.113 1
1 1012 . 5 1 1 A 103 103 LEU CB C 103 38.963 42.060 -3.097 1
1 1016 . 5 1 1 A 103 103 LEU N N 103 120.341 119.705 0.636 1
1 1017 . 5 1 1 A 104 104 SER H H 104 8.268 8.017 0.251 1
1 1018 . 5 1 1 A 104 104 SER HA H 104 4.120 4.452 -0.332 1
1 1021 . 5 1 1 A 104 104 SER CA C 104 58.301 59.267 -0.966 1
1 1022 . 5 1 1 A 104 104 SER CB C 104 60.193 63.430 -3.237 1
1 1023 . 5 1 1 A 104 104 SER N N 104 115.150 113.101 2.049 1
1 1024 . 5 1 1 A 105 105 LEU H H 105 7.501 7.680 -0.179 1
1 1025 . 5 1 1 A 105 105 LEU HA H 105 4.041 4.127 -0.086 1
1 1035 . 5 1 1 A 105 105 LEU CA C 105 53.995 57.157 -3.162 1
1 1036 . 5 1 1 A 105 105 LEU CB C 105 39.597 41.839 -2.242 1
1 1040 . 5 1 1 A 105 105 LEU N N 105 124.223 123.493 0.730 1
1 1041 . 5 1 1 A 106 106 LYS H H 106 7.542 8.285 -0.743 1
1 1042 . 5 1 1 A 106 106 LYS HA H 106 4.090 4.037 0.053 1
1 1050 . 5 1 1 A 106 106 LYS CA C 106 55.495 59.591 -4.096 1
1 1051 . 5 1 1 A 106 106 LYS CB C 106 29.941 32.514 -2.573 1
1 1055 . 5 1 1 A 106 106 LYS N N 106 120.328 119.423 0.905 1
1 1056 . 5 1 1 A 107 107 GLU H H 107 7.884 8.192 -0.308 1
1 1057 . 5 1 1 A 107 107 GLU HA H 107 4.210 4.100 0.110 1
1 1060 . 5 1 1 A 107 107 GLU CA C 107 54.509 59.721 -5.212 1
1 1061 . 5 1 1 A 107 107 GLU CB C 107 27.239 29.429 -2.190 1
1 1062 . 5 1 1 A 107 107 GLU N N 107 118.621 120.500 -1.879 1
1 1063 . 5 1 1 A 108 108 SER H H 108 7.923 7.629 0.294 1
1 1064 . 5 1 1 A 108 108 SER HA H 108 4.385 4.210 0.175 1
1 1067 . 5 1 1 A 108 108 SER CA C 108 56.442 61.169 -4.727 1
1 1068 . 5 1 1 A 108 108 SER CB C 108 60.953 63.275 -2.322 1
1 1069 . 5 1 1 A 108 108 SER N N 108 115.670 114.394 1.276 1
1 1070 . 5 1 1 A 109 109 ARG H H 109 8.068 7.574 0.494 1
1 1071 . 5 1 1 A 109 109 ARG HA H 109 4.307 4.265 0.042 1
1 1078 . 5 1 1 A 109 109 ARG CA C 109 53.732 58.214 -4.482 1
1 1079 . 5 1 1 A 109 109 ARG CB C 109 27.968 29.780 -1.812 1
1 1082 . 5 1 1 A 109 109 ARG N N 109 122.313 121.115 1.198 1
1 1083 . 5 1 1 A 110 110 ASN H H 110 8.292 8.012 0.280 1
1 1084 . 5 1 1 A 110 110 ASN HA H 110 4.720 4.458 0.262 1
1 1087 . 5 1 1 A 110 110 ASN CA C 110 50.750 56.708 -5.958 1
1 1088 . 5 1 1 A 110 110 ASN CB C 110 36.197 39.783 -3.586 1
1 1089 . 5 1 1 A 110 110 ASN N N 110 119.304 119.390 -0.086 1
1 1090 . 5 1 1 A 111 111 SER H H 111 8.244 8.034 0.210 1
1 1091 . 5 1 1 A 111 111 SER HA H 111 4.423 4.299 0.124 1
1 1094 . 5 1 1 A 111 111 SER CA C 111 55.990 60.900 -4.910 1
1 1095 . 5 1 1 A 111 111 SER CB C 111 61.027 62.965 -1.938 1
1 1096 . 5 1 1 A 111 111 SER N N 111 116.119 114.630 1.489 1
1 1097 . 5 1 1 A 112 112 GLY H H 112 8.327 8.193 0.134 1
1 1098 . 5 1 1 A 112 112 GLY HA2 H 112 3.944 3.871 0.073 1
1 1099 . 5 1 1 A 112 112 GLY HA3 H 112 3.912 3.888 0.024 1
1 1100 . 5 1 1 A 112 112 GLY CA C 112 42.733 47.237 -4.504 1
1 1101 . 5 1 1 A 112 112 GLY N N 112 110.442 107.853 2.589 1
1 1102 . 5 1 1 A 113 113 GLY H H 113 8.097 8.103 -0.006 1
1 1103 . 5 1 1 A 113 113 GLY HA2 H 113 3.831 3.794 0.037 1
1 1104 . 5 1 1 A 113 113 GLY HA3 H 113 3.785 3.798 -0.013 1
1 1105 . 5 1 1 A 113 113 GLY CA C 113 42.435 47.048 -4.613 1
1 1106 . 5 1 1 A 113 113 GLY N N 113 108.745 109.717 -0.972 1
1 2 . 6 1 1 A 3 3 HIS CB C 3 33.709 29.194 4.515 1
1 3 . 6 1 1 A 7 7 HIS H H 7 8.731 8.298 0.433 1
1 4 . 6 1 1 A 7 7 HIS HA H 7 4.564 4.821 -0.257 1
1 7 . 6 1 1 A 7 7 HIS CA C 7 53.649 55.237 -1.588 1
1 8 . 6 1 1 A 7 7 HIS CB C 7 26.268 30.945 -4.677 1
1 9 . 6 1 1 A 7 7 HIS N N 7 121.126 117.165 3.961 1
1 10 . 6 1 1 A 8 8 GLY H H 8 8.540 7.584 0.956 1
1 11 . 6 1 1 A 8 8 GLY HA2 H 8 3.973 3.927 0.046 1
1 12 . 6 1 1 A 8 8 GLY HA3 H 8 3.811 3.985 -0.174 1
1 13 . 6 1 1 A 8 8 GLY CA C 8 42.618 44.620 -2.002 1
1 14 . 6 1 1 A 8 8 GLY N N 8 110.662 108.889 1.773 1
1 15 . 6 1 1 A 9 9 GLU H H 9 8.239 8.458 -0.219 1
1 16 . 6 1 1 A 9 9 GLU HA H 9 4.568 3.957 0.611 1
1 18 . 6 1 1 A 9 9 GLU CA C 9 53.605 55.517 -1.912 1
1 19 . 6 1 1 A 9 9 GLU CB C 9 28.019 31.220 -3.201 1
1 20 . 6 1 1 A 9 9 GLU N N 9 121.669 121.137 0.532 1
1 21 . 6 1 1 A 10 10 PHE H H 10 8.785 8.279 0.506 1
1 22 . 6 1 1 A 10 10 PHE HA H 10 4.850 5.367 -0.517 1
1 25 . 6 1 1 A 10 10 PHE CA C 10 52.630 56.739 -4.109 1
1 26 . 6 1 1 A 10 10 PHE CB C 10 37.906 41.174 -3.268 1
1 27 . 6 1 1 A 10 10 PHE N N 10 118.401 119.605 -1.204 1
1 28 . 6 1 1 A 11 11 GLN H H 11 8.552 8.830 -0.278 1
1 29 . 6 1 1 A 11 11 GLN HA H 11 5.425 4.977 0.448 1
1 34 . 6 1 1 A 11 11 GLN CA C 11 51.663 54.629 -2.966 1
1 35 . 6 1 1 A 11 11 GLN CB C 11 28.427 30.979 -2.552 1
1 37 . 6 1 1 A 11 11 GLN N N 11 117.519 122.081 -4.562 1
1 38 . 6 1 1 A 12 12 ILE H H 12 8.239 8.261 -0.022 1
1 39 . 6 1 1 A 12 12 ILE HA H 12 4.103 4.979 -0.876 1
1 49 . 6 1 1 A 12 12 ILE CA C 12 57.134 59.915 -2.781 1
1 50 . 6 1 1 A 12 12 ILE CB C 12 39.491 39.976 -0.485 1
1 54 . 6 1 1 A 12 12 ILE N N 12 114.043 121.821 -7.778 1
1 55 . 6 1 1 A 13 13 PHE H H 13 8.538 8.703 -0.165 1
1 56 . 6 1 1 A 13 13 PHE HA H 13 5.620 5.237 0.383 1
1 59 . 6 1 1 A 13 13 PHE CA C 13 52.438 56.274 -3.836 1
1 60 . 6 1 1 A 13 13 PHE CB C 13 39.253 42.222 -2.969 1
1 61 . 6 1 1 A 13 13 PHE N N 13 117.015 119.593 -2.578 1
1 62 . 6 1 1 A 14 14 ALA H H 14 9.238 9.617 -0.379 1
1 63 . 6 1 1 A 14 14 ALA HA H 14 5.311 5.580 -0.269 1
1 67 . 6 1 1 A 14 14 ALA CA C 14 47.183 50.027 -2.844 1
1 68 . 6 1 1 A 14 14 ALA CB C 14 17.811 22.984 -5.173 1
1 69 . 6 1 1 A 14 14 ALA N N 14 123.503 124.993 -1.490 1
1 70 . 6 1 1 A 15 15 LYS H H 15 8.810 9.518 -0.708 1
1 71 . 6 1 1 A 15 15 LYS HA H 15 5.511 5.380 0.131 1
1 80 . 6 1 1 A 15 15 LYS CA C 15 51.718 54.837 -3.119 1
1 81 . 6 1 1 A 15 15 LYS CB C 15 33.635 36.069 -2.434 1
1 85 . 6 1 1 A 15 15 LYS N N 15 123.382 122.558 0.824 1
1 86 . 6 1 1 A 16 16 THR H H 16 8.830 8.997 -0.167 1
1 87 . 6 1 1 A 16 16 THR HA H 16 5.212 4.841 0.371 1
1 92 . 6 1 1 A 16 16 THR CA C 16 57.614 61.265 -3.651 1
1 93 . 6 1 1 A 16 16 THR CB C 16 68.210 70.752 -2.542 1
1 95 . 6 1 1 A 16 16 THR N N 16 116.517 116.252 0.265 1
1 96 . 6 1 1 A 17 17 LEU H H 17 9.428 8.473 0.955 1
1 97 . 6 1 1 A 17 17 LEU HA H 17 4.286 4.157 0.129 1
1 107 . 6 1 1 A 17 17 LEU CA C 17 54.504 57.021 -2.517 1
1 108 . 6 1 1 A 17 17 LEU CB C 17 38.564 42.038 -3.474 1
1 112 . 6 1 1 A 17 17 LEU N N 17 121.786 123.631 -1.845 1
1 113 . 6 1 1 A 18 18 THR H H 18 7.546 7.729 -0.183 1
1 114 . 6 1 1 A 18 18 THR HA H 18 4.391 4.412 -0.021 1
1 119 . 6 1 1 A 18 18 THR CA C 18 58.524 62.498 -3.974 1
1 120 . 6 1 1 A 18 18 THR CB C 18 66.166 70.699 -4.533 1
1 122 . 6 1 1 A 18 18 THR N N 18 105.598 108.219 -2.621 1
1 123 . 6 1 1 A 19 19 GLY H H 19 7.683 8.266 -0.583 1
1 124 . 6 1 1 A 19 19 GLY HA2 H 19 3.300 4.020 -0.720 1
1 125 . 6 1 1 A 19 19 GLY HA3 H 19 4.248 4.032 0.216 1
1 126 . 6 1 1 A 19 19 GLY CA C 19 42.947 45.496 -2.549 1
1 127 . 6 1 1 A 19 19 GLY N N 19 109.243 111.886 -2.643 1
1 128 . 6 1 1 A 20 20 LYS H H 20 7.375 7.940 -0.565 1
1 129 . 6 1 1 A 20 20 LYS HA H 20 4.331 4.671 -0.340 1
1 138 . 6 1 1 A 20 20 LYS CA C 20 53.829 55.085 -1.256 1
1 139 . 6 1 1 A 20 20 LYS CB C 20 30.385 34.040 -3.655 1
1 143 . 6 1 1 A 20 20 LYS N N 20 122.757 121.566 1.191 1
1 144 . 6 1 1 A 21 21 THR H H 21 8.637 8.815 -0.178 1
1 145 . 6 1 1 A 21 21 THR HA H 21 4.852 4.972 -0.120 1
1 150 . 6 1 1 A 21 21 THR CA C 21 59.846 62.381 -2.535 1
1 151 . 6 1 1 A 21 21 THR CB C 21 67.140 69.957 -2.817 1
1 153 . 6 1 1 A 21 21 THR N N 21 121.524 123.613 -2.089 1
1 154 . 6 1 1 A 22 22 ILE H H 22 9.509 9.668 -0.159 1
1 155 . 6 1 1 A 22 22 ILE HA H 22 4.349 4.801 -0.452 1
1 165 . 6 1 1 A 22 22 ILE CA C 22 57.634 60.066 -2.432 1
1 166 . 6 1 1 A 22 22 ILE CB C 22 38.334 42.074 -3.740 1
1 170 . 6 1 1 A 22 22 ILE N N 22 129.772 127.398 2.374 1
1 171 . 6 1 1 A 23 23 THR H H 23 8.838 8.654 0.184 1
1 172 . 6 1 1 A 23 23 THR HA H 23 4.653 4.553 0.100 1
1 177 . 6 1 1 A 23 23 THR CA C 23 60.194 61.588 -1.394 1
1 178 . 6 1 1 A 23 23 THR CB C 23 66.577 69.946 -3.369 1
1 180 . 6 1 1 A 23 23 THR N N 23 124.070 124.012 0.058 1
1 181 . 6 1 1 A 24 24 LEU H H 24 8.749 8.490 0.259 1
1 182 . 6 1 1 A 24 24 LEU HA H 24 4.619 5.082 -0.463 1
1 192 . 6 1 1 A 24 24 LEU CA C 24 50.257 52.770 -2.513 1
1 193 . 6 1 1 A 24 24 LEU CB C 24 42.932 45.558 -2.626 1
1 197 . 6 1 1 A 24 24 LEU N N 24 126.499 123.175 3.324 1
1 198 . 6 1 1 A 25 25 GLU H H 25 7.990 8.524 -0.534 1
1 199 . 6 1 1 A 25 25 GLU HA H 25 4.591 4.669 -0.078 1
1 204 . 6 1 1 A 25 25 GLU CA C 25 52.845 56.290 -3.445 1
1 205 . 6 1 1 A 25 25 GLU CB C 25 27.210 30.105 -2.895 1
1 207 . 6 1 1 A 25 25 GLU N N 25 121.644 120.556 1.088 1
1 208 . 6 1 1 A 26 26 VAL H H 26 8.657 8.448 0.209 1
1 209 . 6 1 1 A 26 26 VAL HA H 26 4.403 5.061 -0.658 1
1 217 . 6 1 1 A 26 26 VAL CA C 26 56.020 59.109 -3.089 1
1 218 . 6 1 1 A 26 26 VAL CB C 26 33.631 36.178 -2.547 1
1 221 . 6 1 1 A 26 26 VAL N N 26 116.647 117.537 -0.890 1
1 222 . 6 1 1 A 27 27 GLU H H 27 7.970 8.686 -0.716 1
1 223 . 6 1 1 A 27 27 GLU HA H 27 4.447 4.650 -0.203 1
1 228 . 6 1 1 A 27 27 GLU CA C 27 51.386 54.661 -3.275 1
1 229 . 6 1 1 A 27 27 GLU CB C 27 30.905 32.098 -1.193 1
1 231 . 6 1 1 A 27 27 GLU N N 27 115.496 121.078 -5.582 1
1 232 . 6 1 1 A 28 28 SER H H 28 9.192 8.689 0.503 1
1 233 . 6 1 1 A 28 28 SER HA H 28 4.108 4.085 0.023 1
1 236 . 6 1 1 A 28 28 SER CA C 28 59.909 60.834 -0.925 1
1 237 . 6 1 1 A 28 28 SER CB C 28 60.399 62.652 -2.253 1
1 238 . 6 1 1 A 28 28 SER N N 28 117.720 118.355 -0.635 1
1 239 . 6 1 1 A 29 29 SER H H 29 7.371 7.649 -0.278 1
1 240 . 6 1 1 A 29 29 SER HA H 29 4.327 4.495 -0.168 1
1 243 . 6 1 1 A 29 29 SER CA C 29 54.805 57.124 -2.319 1
1 244 . 6 1 1 A 29 29 SER CB C 29 60.775 64.325 -3.550 1
1 245 . 6 1 1 A 29 29 SER N N 29 108.936 110.052 -1.116 1
1 246 . 6 1 1 A 30 30 ASP H H 30 7.852 7.416 0.436 1
1 247 . 6 1 1 A 30 30 ASP HA H 30 4.591 4.565 0.026 1
1 250 . 6 1 1 A 30 30 ASP CA C 30 53.040 54.459 -1.419 1
1 251 . 6 1 1 A 30 30 ASP CB C 30 37.942 41.561 -3.619 1
1 252 . 6 1 1 A 30 30 ASP N N 30 123.735 123.524 0.211 1
1 253 . 6 1 1 A 31 31 THR H H 31 7.852 8.326 -0.474 1
1 254 . 6 1 1 A 31 31 THR HA H 31 4.918 4.860 0.058 1
1 259 . 6 1 1 A 31 31 THR CA C 31 56.929 59.996 -3.067 1
1 260 . 6 1 1 A 31 31 THR CB C 31 68.674 71.651 -2.977 1
1 262 . 6 1 1 A 31 31 THR N N 31 109.181 113.633 -4.452 1
1 263 . 6 1 1 A 32 32 ILE H H 32 8.582 8.699 -0.117 1
1 264 . 6 1 1 A 32 32 ILE HA H 32 3.624 3.805 -0.181 1
1 274 . 6 1 1 A 32 32 ILE CA C 32 59.474 65.537 -6.063 1
1 275 . 6 1 1 A 32 32 ILE CB C 32 31.561 37.694 -6.133 1
1 279 . 6 1 1 A 32 32 ILE N N 32 121.833 122.843 -1.010 1
1 280 . 6 1 1 A 33 33 ASP H H 33 9.255 8.445 0.810 1
1 281 . 6 1 1 A 33 33 ASP HA H 33 4.201 4.286 -0.085 1
1 284 . 6 1 1 A 33 33 ASP CA C 33 54.679 57.408 -2.729 1
1 285 . 6 1 1 A 33 33 ASP CB C 33 37.700 40.040 -2.340 1
1 286 . 6 1 1 A 33 33 ASP N N 33 119.823 120.941 -1.118 1
1 287 . 6 1 1 A 34 34 ASN H H 34 8.026 7.511 0.515 1
1 288 . 6 1 1 A 34 34 ASN HA H 34 4.409 4.699 -0.290 1
1 291 . 6 1 1 A 34 34 ASN CA C 34 53.324 56.162 -2.838 1
1 292 . 6 1 1 A 34 34 ASN CB C 34 35.782 38.174 -2.392 1
1 293 . 6 1 1 A 34 34 ASN N N 34 119.540 117.719 1.821 1
1 294 . 6 1 1 A 35 35 VAL H H 35 8.167 8.171 -0.004 1
1 295 . 6 1 1 A 35 35 VAL HA H 35 3.249 3.427 -0.178 1
1 303 . 6 1 1 A 35 35 VAL CA C 35 65.308 67.200 -1.892 1
1 304 . 6 1 1 A 35 35 VAL CB C 35 27.965 31.419 -3.454 1
1 307 . 6 1 1 A 35 35 VAL N N 35 122.223 120.734 1.489 1
1 308 . 6 1 1 A 36 36 LYS H H 36 8.460 8.394 0.066 1
1 313 . 6 1 1 A 36 36 LYS CB C 36 30.753 32.221 -1.468 1
1 315 . 6 1 1 A 36 36 LYS N N 36 119.438 119.219 0.219 1
1 316 . 6 1 1 A 37 37 SER H H 37 8.196 8.601 -0.405 1
1 317 . 6 1 1 A 37 37 SER HA H 37 4.130 4.175 -0.045 1
1 320 . 6 1 1 A 37 37 SER CA C 37 58.528 61.118 -2.590 1
1 321 . 6 1 1 A 37 37 SER CB C 37 59.768 62.588 -2.820 1
1 322 . 6 1 1 A 37 37 SER N N 37 117.791 114.262 3.529 1
1 323 . 6 1 1 A 38 38 LYS H H 38 8.043 8.281 -0.238 1
1 324 . 6 1 1 A 38 38 LYS HA H 38 4.095 4.036 0.059 1
1 325 . 6 1 1 A 38 38 LYS CA C 38 57.377 58.931 -1.554 1
1 326 . 6 1 1 A 38 38 LYS N N 38 124.094 120.861 3.233 1
1 327 . 6 1 1 A 39 39 ILE H H 39 8.254 7.966 0.288 1
1 328 . 6 1 1 A 39 39 ILE HA H 39 3.439 3.729 -0.290 1
1 338 . 6 1 1 A 39 39 ILE CA C 39 63.977 64.740 -0.763 1
1 339 . 6 1 1 A 39 39 ILE CB C 39 33.935 37.637 -3.702 1
1 343 . 6 1 1 A 39 39 ILE N N 39 122.107 120.508 1.599 1
1 344 . 6 1 1 A 40 40 GLN H H 40 8.379 8.324 0.055 1
1 345 . 6 1 1 A 40 40 GLN HA H 40 3.746 4.025 -0.279 1
1 350 . 6 1 1 A 40 40 GLN CA C 40 57.472 58.134 -0.662 1
1 351 . 6 1 1 A 40 40 GLN CB C 40 25.072 28.103 -3.031 1
1 353 . 6 1 1 A 40 40 GLN N N 40 123.725 120.904 2.821 1
1 354 . 6 1 1 A 41 41 ASP H H 41 8.210 7.913 0.297 1
1 355 . 6 1 1 A 41 41 ASP HA H 41 4.247 4.376 -0.129 1
1 358 . 6 1 1 A 41 41 ASP CA C 41 54.646 56.533 -1.887 1
1 359 . 6 1 1 A 41 41 ASP CB C 41 38.136 40.704 -2.568 1
1 360 . 6 1 1 A 41 41 ASP N N 41 120.564 120.614 -0.050 1
1 361 . 6 1 1 A 42 42 LYS H H 42 7.381 7.969 -0.588 1
1 362 . 6 1 1 A 42 42 LYS HA H 42 4.246 4.289 -0.043 1
1 369 . 6 1 1 A 42 42 LYS CA C 42 55.579 57.883 -2.304 1
1 370 . 6 1 1 A 42 42 LYS CB C 42 31.406 33.545 -2.139 1
1 373 . 6 1 1 A 42 42 LYS N N 42 115.674 117.037 -1.363 1
1 374 . 6 1 1 A 43 43 GLU H H 43 8.537 8.568 -0.031 1
1 375 . 6 1 1 A 43 43 GLU HA H 43 4.522 4.553 -0.031 1
1 380 . 6 1 1 A 43 43 GLU CA C 43 52.772 55.563 -2.791 1
1 381 . 6 1 1 A 43 43 GLU CB C 43 30.535 31.130 -0.595 1
1 383 . 6 1 1 A 43 43 GLU N N 43 114.355 116.222 -1.867 1
1 384 . 6 1 1 A 44 44 GLY H H 44 8.611 8.297 0.314 1
1 385 . 6 1 1 A 44 44 GLY HA2 H 44 4.067 3.961 0.106 1
1 386 . 6 1 1 A 44 44 GLY HA3 H 44 3.819 3.962 -0.143 1
1 387 . 6 1 1 A 44 44 GLY CA C 44 43.205 45.371 -2.166 1
1 388 . 6 1 1 A 44 44 GLY N N 44 109.406 109.014 0.392 1
1 389 . 6 1 1 A 45 45 ILE H H 45 6.092 8.010 -1.918 1
1 390 . 6 1 1 A 45 45 ILE HA H 45 4.324 4.106 0.218 1
1 400 . 6 1 1 A 45 45 ILE CA C 45 55.211 60.131 -4.920 1
1 401 . 6 1 1 A 45 45 ILE CB C 45 37.903 38.437 -0.534 1
1 405 . 6 1 1 A 45 45 ILE N N 45 120.791 122.510 -1.719 1
1 406 . 6 1 1 A 46 46 PRO HA H 46 4.547 4.601 -0.054 1
1 413 . 6 1 1 A 46 46 PRO CA C 46 58.971 61.917 -2.946 1
1 414 . 6 1 1 A 46 46 PRO CB C 46 29.142 32.100 -2.958 1
1 417 . 6 1 1 A 47 47 PRO HA H 47 4.062 4.135 -0.073 1
1 424 . 6 1 1 A 47 47 PRO CA C 47 63.476 65.779 -2.303 1
1 425 . 6 1 1 A 47 47 PRO CB C 47 30.113 32.033 -1.920 1
1 428 . 6 1 1 A 48 48 ASP H H 48 8.418 8.397 0.021 1
1 429 . 6 1 1 A 48 48 ASP HA H 48 4.346 4.393 -0.047 1
1 432 . 6 1 1 A 48 48 ASP CA C 48 52.838 57.166 -4.328 1
1 433 . 6 1 1 A 48 48 ASP CB C 48 36.926 40.386 -3.460 1
1 434 . 6 1 1 A 48 48 ASP N N 48 113.462 117.255 -3.793 1
1 435 . 6 1 1 A 49 49 GLN H H 49 7.822 7.756 0.066 1
1 436 . 6 1 1 A 49 49 GLN HA H 49 4.283 4.102 0.181 1
1 439 . 6 1 1 A 49 49 GLN CA C 49 52.770 57.770 -5.000 1
1 441 . 6 1 1 A 49 49 GLN N N 49 117.377 117.921 -0.544 1
1 442 . 6 1 1 A 50 50 GLN H H 50 7.451 7.412 0.039 1
1 443 . 6 1 1 A 50 50 GLN HA H 50 4.260 5.027 -0.767 1
1 448 . 6 1 1 A 50 50 GLN CA C 50 53.725 54.276 -0.551 1
1 449 . 6 1 1 A 50 50 GLN CB C 50 29.142 31.648 -2.506 1
1 451 . 6 1 1 A 50 50 GLN N N 50 117.526 115.689 1.837 1
1 452 . 6 1 1 A 51 51 ARG H H 51 8.534 8.845 -0.311 1
1 453 . 6 1 1 A 51 51 ARG HA H 51 4.486 5.101 -0.615 1
1 460 . 6 1 1 A 51 51 ARG CA C 51 52.492 54.358 -1.866 1
1 461 . 6 1 1 A 51 51 ARG CB C 51 29.096 34.254 -5.158 1
1 464 . 6 1 1 A 51 51 ARG N N 51 121.655 120.167 1.488 1
1 465 . 6 1 1 A 52 52 LEU H H 52 8.683 8.867 -0.184 1
1 466 . 6 1 1 A 52 52 LEU HA H 52 5.255 5.157 0.098 1
1 476 . 6 1 1 A 52 52 LEU CA C 52 50.618 53.669 -3.051 1
1 477 . 6 1 1 A 52 52 LEU CB C 52 43.007 45.543 -2.536 1
1 481 . 6 1 1 A 52 52 LEU N N 52 122.929 123.407 -0.478 1
1 482 . 6 1 1 A 53 53 ILE H H 53 9.286 8.805 0.481 1
1 483 . 6 1 1 A 53 53 ILE HA H 53 5.096 5.218 -0.122 1
1 492 . 6 1 1 A 53 53 ILE CA C 53 56.795 60.031 -3.236 1
1 496 . 6 1 1 A 53 53 ILE N N 53 124.718 123.417 1.301 1
1 497 . 6 1 1 A 54 54 TRP H H 54 8.871 8.915 -0.044 1
1 499 . 6 1 1 A 54 54 TRP N N 54 127.412 127.796 -0.384 1
1 501 . 6 1 1 A 55 55 ALA H H 55 8.401 8.647 -0.246 1
1 502 . 6 1 1 A 55 55 ALA HA H 55 3.183 3.417 -0.234 1
1 506 . 6 1 1 A 55 55 ALA CA C 55 49.712 52.634 -2.922 1
1 507 . 6 1 1 A 55 55 ALA CB C 55 13.252 16.963 -3.711 1
1 508 . 6 1 1 A 55 55 ALA N N 55 128.894 129.863 -0.969 1
1 509 . 6 1 1 A 56 56 GLY H H 56 8.248 8.417 -0.169 1
1 510 . 6 1 1 A 56 56 GLY HA2 H 56 3.968 3.743 0.225 1
1 511 . 6 1 1 A 56 56 GLY HA3 H 56 3.916 3.762 0.154 1
1 512 . 6 1 1 A 56 56 GLY CA C 56 43.142 45.410 -2.268 1
1 513 . 6 1 1 A 56 56 GLY N N 56 101.499 102.381 -0.882 1
1 514 . 6 1 1 A 57 57 LYS H H 57 8.028 7.431 0.597 1
1 515 . 6 1 1 A 57 57 LYS HA H 57 4.609 4.675 -0.066 1
1 522 . 6 1 1 A 57 57 LYS CA C 57 51.928 54.707 -2.779 1
1 523 . 6 1 1 A 57 57 LYS CB C 57 32.613 34.833 -2.220 1
1 526 . 6 1 1 A 57 57 LYS N N 57 118.995 121.360 -2.365 1
1 527 . 6 1 1 A 58 58 GLN H H 58 8.607 8.557 0.050 1
1 528 . 6 1 1 A 58 58 GLN HA H 58 4.617 4.296 0.321 1
1 533 . 6 1 1 A 58 58 GLN CA C 58 53.261 56.275 -3.014 1
1 534 . 6 1 1 A 58 58 GLN CB C 58 26.613 28.971 -2.358 1
1 536 . 6 1 1 A 58 58 GLN N N 58 119.825 124.336 -4.511 1
1 537 . 6 1 1 A 59 59 LEU H H 59 8.653 8.762 -0.109 1
1 538 . 6 1 1 A 59 59 LEU HA H 59 4.138 4.325 -0.187 1
1 548 . 6 1 1 A 59 59 LEU CA C 59 51.991 55.417 -3.426 1
1 549 . 6 1 1 A 59 59 LEU CB C 59 39.006 41.474 -2.468 1
1 553 . 6 1 1 A 59 59 LEU N N 59 125.484 125.178 0.306 1
1 554 . 6 1 1 A 60 60 GLU H H 60 8.461 8.565 -0.104 1
1 555 . 6 1 1 A 60 60 GLU HA H 60 4.371 4.429 -0.058 1
1 559 . 6 1 1 A 60 60 GLU CA C 60 53.436 56.416 -2.980 1
1 560 . 6 1 1 A 60 60 GLU CB C 60 29.057 31.406 -2.349 1
1 562 . 6 1 1 A 60 60 GLU N N 60 123.237 125.425 -2.188 1
1 563 . 6 1 1 A 61 61 ASP H H 61 8.076 8.677 -0.601 1
1 564 . 6 1 1 A 61 61 ASP HA H 61 4.265 4.322 -0.057 1
1 567 . 6 1 1 A 61 61 ASP CA C 61 54.398 56.951 -2.553 1
1 568 . 6 1 1 A 61 61 ASP CB C 61 38.340 40.586 -2.246 1
1 569 . 6 1 1 A 61 61 ASP N N 61 120.701 123.163 -2.462 1
1 570 . 6 1 1 A 62 62 GLY HA2 H 62 4.104 3.984 0.120 1
1 571 . 6 1 1 A 62 62 GLY HA3 H 62 3.832 3.987 -0.155 1
1 572 . 6 1 1 A 62 62 GLY CA C 62 42.576 45.504 -2.928 1
1 573 . 6 1 1 A 63 63 ARG H H 63 7.319 8.560 -1.241 1
1 574 . 6 1 1 A 63 63 ARG HA H 63 4.595 4.569 0.026 1
1 579 . 6 1 1 A 63 63 ARG CA C 63 51.971 55.807 -3.836 1
1 582 . 6 1 1 A 63 63 ARG N N 63 119.206 121.672 -2.466 1
1 583 . 6 1 1 A 64 64 THR H H 64 8.735 8.723 0.012 1
1 584 . 6 1 1 A 64 64 THR HA H 64 5.208 4.901 0.307 1
1 589 . 6 1 1 A 64 64 THR CA C 64 57.126 59.918 -2.792 1
1 590 . 6 1 1 A 64 64 THR CB C 64 69.885 71.402 -1.517 1
1 592 . 6 1 1 A 64 64 THR N N 64 108.713 116.289 -7.576 1
1 593 . 6 1 1 A 65 65 LEU H H 65 8.241 8.442 -0.201 1
1 594 . 6 1 1 A 65 65 LEU HA H 65 4.003 4.140 -0.137 1
1 604 . 6 1 1 A 65 65 LEU CA C 65 56.409 56.883 -0.474 1
1 605 . 6 1 1 A 65 65 LEU CB C 65 37.179 41.725 -4.546 1
1 609 . 6 1 1 A 65 65 LEU N N 65 118.111 122.272 -4.161 1
1 610 . 6 1 1 A 66 66 SER H H 66 8.296 8.039 0.257 1
1 611 . 6 1 1 A 66 66 SER HA H 66 4.201 4.264 -0.063 1
1 614 . 6 1 1 A 66 66 SER CA C 66 58.454 60.823 -2.369 1
1 615 . 6 1 1 A 66 66 SER CB C 66 59.969 62.883 -2.914 1
1 616 . 6 1 1 A 66 66 SER N N 66 113.148 114.112 -0.964 1
1 617 . 6 1 1 A 67 67 ASP H H 67 7.984 8.666 -0.682 1
1 618 . 6 1 1 A 67 67 ASP HA H 67 4.187 4.383 -0.196 1
1 621 . 6 1 1 A 67 67 ASP CA C 67 54.744 56.760 -2.016 1
1 622 . 6 1 1 A 67 67 ASP CB C 67 37.794 40.280 -2.486 1
1 623 . 6 1 1 A 67 67 ASP N N 67 124.130 119.959 4.171 1
1 624 . 6 1 1 A 68 68 TYR H H 68 7.177 7.688 -0.511 1
1 625 . 6 1 1 A 68 68 TYR N N 68 115.334 118.842 -3.508 1
1 626 . 6 1 1 A 69 69 ASN H H 69 8.111 8.107 0.004 1
1 627 . 6 1 1 A 69 69 ASN HA H 69 4.253 4.362 -0.109 1
1 630 . 6 1 1 A 69 69 ASN CA C 69 51.386 54.387 -3.001 1
1 631 . 6 1 1 A 69 69 ASN CB C 69 34.867 36.550 -1.683 1
1 632 . 6 1 1 A 69 69 ASN N N 69 116.867 115.671 1.196 1
1 633 . 6 1 1 A 70 70 ILE H H 70 7.460 7.657 -0.197 1
1 634 . 6 1 1 A 70 70 ILE HA H 70 3.210 3.979 -0.769 1
1 644 . 6 1 1 A 70 70 ILE CA C 70 60.157 62.094 -1.937 1
1 645 . 6 1 1 A 70 70 ILE CB C 70 34.754 37.524 -2.770 1
1 649 . 6 1 1 A 70 70 ILE N N 70 119.821 119.035 0.786 1
1 650 . 6 1 1 A 71 71 GLN H H 71 7.368 8.590 -1.222 1
1 651 . 6 1 1 A 71 71 GLN HA H 71 4.099 4.458 -0.359 1
1 656 . 6 1 1 A 71 71 GLN CA C 71 50.906 54.885 -3.979 1
1 657 . 6 1 1 A 71 71 GLN CB C 71 28.793 30.725 -1.932 1
1 659 . 6 1 1 A 71 71 GLN N N 71 124.287 127.025 -2.738 1
1 660 . 6 1 1 A 72 72 ARG H H 72 7.583 8.637 -1.054 1
1 661 . 6 1 1 A 72 72 ARG HA H 72 3.907 4.380 -0.473 1
1 668 . 6 1 1 A 72 72 ARG CA C 72 54.527 58.022 -3.495 1
1 669 . 6 1 1 A 72 72 ARG CB C 72 27.470 31.346 -3.876 1
1 672 . 6 1 1 A 72 72 ARG N N 72 119.007 121.038 -2.031 1
1 673 . 6 1 1 A 73 73 GLU H H 73 9.262 7.842 1.420 1
1 674 . 6 1 1 A 73 73 GLU HA H 73 3.586 4.436 -0.850 1
1 679 . 6 1 1 A 73 73 GLU CA C 73 55.703 56.400 -0.697 1
1 680 . 6 1 1 A 73 73 GLU CB C 73 23.669 30.020 -6.351 1
1 682 . 6 1 1 A 73 73 GLU N N 73 115.180 118.511 -3.331 1
1 683 . 6 1 1 A 74 74 SER H H 74 7.551 7.542 0.009 1
1 684 . 6 1 1 A 74 74 SER HA H 74 4.613 4.671 -0.058 1
1 687 . 6 1 1 A 74 74 SER CA C 74 58.305 58.394 -0.089 1
1 688 . 6 1 1 A 74 74 SER CB C 74 62.156 64.360 -2.204 1
1 689 . 6 1 1 A 74 74 SER N N 74 115.104 117.983 -2.879 1
1 690 . 6 1 1 A 75 75 THR H H 75 8.785 8.524 0.261 1
1 691 . 6 1 1 A 75 75 THR HA H 75 5.014 4.785 0.229 1
1 696 . 6 1 1 A 75 75 THR CA C 75 59.835 62.017 -2.182 1
1 697 . 6 1 1 A 75 75 THR CB C 75 67.258 69.308 -2.050 1
1 699 . 6 1 1 A 75 75 THR N N 75 118.401 120.706 -2.305 1
1 700 . 6 1 1 A 76 76 LEU H H 76 9.447 9.881 -0.434 1
1 701 . 6 1 1 A 76 76 LEU HA H 76 4.930 4.235 0.695 1
1 711 . 6 1 1 A 76 76 LEU CA C 76 51.107 54.614 -3.507 1
1 712 . 6 1 1 A 76 76 LEU CB C 76 40.841 42.541 -1.700 1
1 716 . 6 1 1 A 76 76 LEU N N 76 127.905 128.143 -0.238 1
1 717 . 6 1 1 A 77 77 HIS HA H 77 4.976 5.221 -0.245 1
1 720 . 6 1 1 A 77 77 HIS CA C 77 53.776 54.771 -0.995 1
1 721 . 6 1 1 A 77 77 HIS CB C 77 28.438 31.099 -2.661 1
1 722 . 6 1 1 A 78 78 LEU H H 78 8.450 9.143 -0.693 1
1 723 . 6 1 1 A 78 78 LEU HA H 78 5.085 5.108 -0.023 1
1 733 . 6 1 1 A 78 78 LEU CA C 78 50.896 53.689 -2.793 1
1 734 . 6 1 1 A 78 78 LEU CB C 78 41.916 45.135 -3.219 1
1 738 . 6 1 1 A 78 78 LEU N N 78 126.178 126.197 -0.019 1
1 739 . 6 1 1 A 79 79 VAL H H 79 9.093 9.312 -0.219 1
1 740 . 6 1 1 A 79 79 VAL HA H 79 4.053 4.980 -0.927 1
1 748 . 6 1 1 A 79 79 VAL CA C 79 59.054 59.293 -0.239 1
1 749 . 6 1 1 A 79 79 VAL CB C 79 32.115 34.914 -2.799 1
1 752 . 6 1 1 A 79 79 VAL N N 79 128.372 120.263 8.109 1
1 753 . 6 1 1 A 80 80 LEU H H 80 8.000 8.991 -0.991 1
1 754 . 6 1 1 A 80 80 LEU HA H 80 5.105 5.167 -0.062 1
1 764 . 6 1 1 A 80 80 LEU CA C 80 50.556 53.023 -2.467 1
1 765 . 6 1 1 A 80 80 LEU CB C 80 39.597 44.787 -5.190 1
1 769 . 6 1 1 A 80 80 LEU N N 80 126.145 125.236 0.909 1
1 770 . 6 1 1 A 81 81 ARG H H 81 8.470 7.867 0.603 1
1 771 . 6 1 1 A 81 81 ARG HA H 81 4.197 4.725 -0.528 1
1 778 . 6 1 1 A 81 81 ARG CA C 81 53.133 55.812 -2.679 1
1 779 . 6 1 1 A 81 81 ARG CB C 81 28.413 31.732 -3.319 1
1 782 . 6 1 1 A 81 81 ARG N N 81 121.625 122.445 -0.820 1
1 783 . 6 1 1 A 82 82 LEU H H 82 8.454 8.516 -0.062 1
1 784 . 6 1 1 A 82 82 LEU HA H 82 4.339 4.748 -0.409 1
1 794 . 6 1 1 A 82 82 LEU CA C 82 52.081 54.255 -2.174 1
1 795 . 6 1 1 A 82 82 LEU CB C 82 39.810 42.968 -3.158 1
1 799 . 6 1 1 A 82 82 LEU N N 82 123.832 121.851 1.981 1
1 800 . 6 1 1 A 83 83 ARG H H 83 8.404 8.456 -0.052 1
1 801 . 6 1 1 A 83 83 ARG HA H 83 4.308 4.339 -0.031 1
1 808 . 6 1 1 A 83 83 ARG CA C 83 53.258 57.139 -3.881 1
1 809 . 6 1 1 A 83 83 ARG CB C 83 28.160 30.698 -2.538 1
1 812 . 6 1 1 A 83 83 ARG N N 83 121.447 125.224 -3.777 1
1 813 . 6 1 1 A 84 84 GLY H H 84 8.410 8.115 0.295 1
1 814 . 6 1 1 A 84 84 GLY HA2 H 84 3.929 4.078 -0.149 1
1 815 . 6 1 1 A 84 84 GLY HA3 H 84 3.929 4.079 -0.150 1
1 816 . 6 1 1 A 84 84 GLY CA C 84 42.751 45.095 -2.344 1
1 817 . 6 1 1 A 84 84 GLY N N 84 110.030 108.145 1.885 1
1 818 . 6 1 1 A 85 85 GLY H H 85 8.295 8.525 -0.230 1
1 819 . 6 1 1 A 85 85 GLY HA2 H 85 3.950 3.906 0.044 1
1 820 . 6 1 1 A 85 85 GLY HA3 H 85 3.950 3.906 0.044 1
1 821 . 6 1 1 A 85 85 GLY CA C 85 42.831 45.950 -3.119 1
1 822 . 6 1 1 A 85 85 GLY N N 85 108.838 108.304 0.534 1
1 823 . 6 1 1 A 86 86 SER H H 86 8.292 7.805 0.487 1
1 824 . 6 1 1 A 86 86 SER HA H 86 4.405 4.588 -0.183 1
1 827 . 6 1 1 A 86 86 SER CA C 86 55.965 57.084 -1.119 1
1 828 . 6 1 1 A 86 86 SER CB C 86 61.232 63.975 -2.743 1
1 829 . 6 1 1 A 86 86 SER N N 86 116.028 116.236 -0.208 1
1 830 . 6 1 1 A 87 87 MET H H 87 8.470 8.537 -0.067 1
1 831 . 6 1 1 A 87 87 MET HA H 87 4.447 4.747 -0.300 1
1 836 . 6 1 1 A 87 87 MET CA C 87 53.281 55.069 -1.788 1
1 837 . 6 1 1 A 87 87 MET CB C 87 29.788 31.962 -2.174 1
1 839 . 6 1 1 A 87 87 MET N N 87 121.625 125.911 -4.286 1
1 840 . 6 1 1 A 88 88 GLY H H 88 8.320 7.554 0.766 1
1 841 . 6 1 1 A 88 88 GLY HA2 H 88 3.919 3.686 0.233 1
1 842 . 6 1 1 A 88 88 GLY HA3 H 88 3.896 3.687 0.209 1
1 843 . 6 1 1 A 88 88 GLY CA C 88 43.060 46.599 -3.539 1
1 844 . 6 1 1 A 88 88 GLY N N 88 109.625 107.740 1.885 1
1 845 . 6 1 1 A 89 89 GLY H H 89 8.256 8.451 -0.195 1
1 846 . 6 1 1 A 89 89 GLY HA2 H 89 3.940 4.180 -0.240 1
1 847 . 6 1 1 A 89 89 GLY HA3 H 89 3.910 4.181 -0.271 1
1 848 . 6 1 1 A 89 89 GLY CA C 89 42.678 45.363 -2.685 1
1 849 . 6 1 1 A 89 89 GLY N N 89 108.982 111.426 -2.444 1
1 850 . 6 1 1 A 90 90 ALA H H 90 8.203 8.815 -0.612 1
1 851 . 6 1 1 A 90 90 ALA HA H 90 4.255 4.092 0.163 1
1 855 . 6 1 1 A 90 90 ALA CA C 90 50.763 55.510 -4.747 1
1 856 . 6 1 1 A 90 90 ALA CB C 90 16.364 18.787 -2.423 1
1 857 . 6 1 1 A 90 90 ALA N N 90 124.065 124.043 0.022 1
1 858 . 6 1 1 A 91 91 ALA H H 91 8.273 7.758 0.515 1
1 859 . 6 1 1 A 91 91 ALA HA H 91 4.204 4.335 -0.131 1
1 863 . 6 1 1 A 91 91 ALA CA C 91 51.080 52.163 -1.083 1
1 864 . 6 1 1 A 91 91 ALA CB C 91 16.036 19.854 -3.818 1
1 865 . 6 1 1 A 91 91 ALA N N 91 121.985 119.126 2.859 1
1 866 . 6 1 1 A 92 92 ASP H H 92 8.022 8.483 -0.461 1
1 867 . 6 1 1 A 92 92 ASP HA H 92 4.455 5.007 -0.552 1
1 870 . 6 1 1 A 92 92 ASP CA C 92 52.664 53.521 -0.857 1
1 871 . 6 1 1 A 92 92 ASP CB C 92 37.925 42.221 -4.296 1
1 872 . 6 1 1 A 92 92 ASP N N 92 118.621 120.122 -1.501 1
1 873 . 6 1 1 A 93 93 GLU H H 93 8.282 8.452 -0.170 1
1 874 . 6 1 1 A 93 93 GLU HA H 93 3.912 4.277 -0.365 1
1 879 . 6 1 1 A 93 93 GLU CA C 93 56.947 58.305 -1.358 1
1 880 . 6 1 1 A 93 93 GLU CB C 93 27.413 30.361 -2.948 1
1 882 . 6 1 1 A 93 93 GLU N N 93 122.247 123.238 -0.991 1
1 883 . 6 1 1 A 94 94 GLU H H 94 8.194 8.188 0.006 1
1 884 . 6 1 1 A 94 94 GLU HA H 94 3.940 4.274 -0.334 1
1 889 . 6 1 1 A 94 94 GLU CA C 94 56.681 59.242 -2.561 1
1 890 . 6 1 1 A 94 94 GLU CB C 94 26.127 30.074 -3.947 1
1 892 . 6 1 1 A 94 94 GLU N N 94 118.024 118.275 -0.251 1
1 893 . 6 1 1 A 95 95 GLU H H 95 7.816 8.188 -0.372 1
1 894 . 6 1 1 A 95 95 GLU HA H 95 4.121 3.985 0.136 1
1 898 . 6 1 1 A 95 95 GLU CA C 95 56.162 59.069 -2.907 1
1 899 . 6 1 1 A 95 95 GLU CB C 95 26.403 29.356 -2.953 1
1 901 . 6 1 1 A 95 95 GLU N N 95 120.028 120.065 -0.037 1
1 902 . 6 1 1 A 96 96 LEU H H 96 7.637 8.050 -0.413 1
1 903 . 6 1 1 A 96 96 LEU HA H 96 3.988 4.008 -0.020 1
1 913 . 6 1 1 A 96 96 LEU CA C 96 55.303 58.246 -2.943 1
1 914 . 6 1 1 A 96 96 LEU CB C 96 39.038 41.578 -2.540 1
1 918 . 6 1 1 A 96 96 LEU N N 96 119.866 118.926 0.940 1
1 919 . 6 1 1 A 97 97 ILE H H 97 8.044 7.640 0.404 1
1 920 . 6 1 1 A 97 97 ILE HA H 97 3.478 3.797 -0.319 1
1 930 . 6 1 1 A 97 97 ILE CA C 97 62.054 64.737 -2.683 1
1 931 . 6 1 1 A 97 97 ILE CB C 97 34.541 37.852 -3.311 1
1 935 . 6 1 1 A 97 97 ILE N N 97 119.088 119.335 -0.247 1
1 936 . 6 1 1 A 98 98 ARG H H 98 7.991 8.323 -0.332 1
1 937 . 6 1 1 A 98 98 ARG HA H 98 3.793 4.022 -0.229 1
1 944 . 6 1 1 A 98 98 ARG CA C 98 57.509 58.382 -0.873 1
1 945 . 6 1 1 A 98 98 ARG CB C 98 27.191 29.730 -2.539 1
1 948 . 6 1 1 A 98 98 ARG N N 98 119.225 121.089 -1.864 1
1 949 . 6 1 1 A 99 99 LYS H H 99 8.101 9.036 -0.935 1
1 950 . 6 1 1 A 99 99 LYS HA H 99 3.968 4.006 -0.038 1
1 959 . 6 1 1 A 99 99 LYS CA C 99 56.455 59.277 -2.822 1
1 960 . 6 1 1 A 99 99 LYS CB C 99 29.531 32.130 -2.599 1
1 964 . 6 1 1 A 99 99 LYS N N 99 119.464 118.642 0.822 1
1 965 . 6 1 1 A 100 100 ALA H H 100 8.167 7.649 0.518 1
1 966 . 6 1 1 A 100 100 ALA HA H 100 3.789 4.084 -0.295 1
1 970 . 6 1 1 A 100 100 ALA CA C 100 52.451 54.370 -1.919 1
1 971 . 6 1 1 A 100 100 ALA CB C 100 16.259 18.314 -2.055 1
1 972 . 6 1 1 A 100 100 ALA N N 100 122.398 121.824 0.574 1
1 973 . 6 1 1 A 101 101 ILE H H 101 8.777 7.881 0.896 1
1 974 . 6 1 1 A 101 101 ILE HA H 101 3.191 3.720 -0.529 1
1 984 . 6 1 1 A 101 101 ILE CA C 101 62.910 64.917 -2.007 1
1 985 . 6 1 1 A 101 101 ILE CB C 101 34.544 37.143 -2.599 1
1 989 . 6 1 1 A 101 101 ILE N N 101 120.431 118.488 1.943 1
1 990 . 6 1 1 A 102 102 GLU H H 102 7.890 7.842 0.048 1
1 991 . 6 1 1 A 102 102 GLU HA H 102 3.848 4.280 -0.432 1
1 996 . 6 1 1 A 102 102 GLU CA C 102 57.079 57.522 -0.443 1
1 997 . 6 1 1 A 102 102 GLU CB C 102 26.769 30.186 -3.417 1
1 999 . 6 1 1 A 102 102 GLU N N 102 120.248 120.115 0.133 1
1 1000 . 6 1 1 A 103 103 LEU H H 103 8.194 7.854 0.340 1
1 1001 . 6 1 1 A 103 103 LEU HA H 103 3.912 4.202 -0.290 1
1 1011 . 6 1 1 A 103 103 LEU CA C 103 55.078 56.993 -1.915 1
1 1012 . 6 1 1 A 103 103 LEU CB C 103 38.963 41.911 -2.948 1
1 1016 . 6 1 1 A 103 103 LEU N N 103 120.341 119.063 1.278 1
1 1017 . 6 1 1 A 104 104 SER H H 104 8.268 8.158 0.110 1
1 1018 . 6 1 1 A 104 104 SER HA H 104 4.120 4.282 -0.162 1
1 1021 . 6 1 1 A 104 104 SER CA C 104 58.301 59.796 -1.495 1
1 1022 . 6 1 1 A 104 104 SER CB C 104 60.193 63.178 -2.985 1
1 1023 . 6 1 1 A 104 104 SER N N 104 115.150 111.866 3.284 1
1 1024 . 6 1 1 A 105 105 LEU H H 105 7.501 7.679 -0.178 1
1 1025 . 6 1 1 A 105 105 LEU HA H 105 4.041 3.984 0.057 1
1 1035 . 6 1 1 A 105 105 LEU CA C 105 53.995 56.600 -2.605 1
1 1036 . 6 1 1 A 105 105 LEU CB C 105 39.597 42.025 -2.428 1
1 1040 . 6 1 1 A 105 105 LEU N N 105 124.223 123.174 1.049 1
1 1041 . 6 1 1 A 106 106 LYS H H 106 7.542 8.142 -0.600 1
1 1042 . 6 1 1 A 106 106 LYS HA H 106 4.090 4.041 0.049 1
1 1050 . 6 1 1 A 106 106 LYS CA C 106 55.495 58.978 -3.483 1
1 1051 . 6 1 1 A 106 106 LYS CB C 106 29.941 32.398 -2.457 1
1 1055 . 6 1 1 A 106 106 LYS N N 106 120.328 120.504 -0.176 1
1 1056 . 6 1 1 A 107 107 GLU H H 107 7.884 7.958 -0.074 1
1 1057 . 6 1 1 A 107 107 GLU HA H 107 4.210 4.072 0.138 1
1 1060 . 6 1 1 A 107 107 GLU CA C 107 54.509 59.284 -4.775 1
1 1061 . 6 1 1 A 107 107 GLU CB C 107 27.239 29.408 -2.169 1
1 1062 . 6 1 1 A 107 107 GLU N N 107 118.621 120.537 -1.916 1
1 1063 . 6 1 1 A 108 108 SER H H 108 7.923 7.946 -0.023 1
1 1064 . 6 1 1 A 108 108 SER HA H 108 4.385 4.376 0.009 1
1 1067 . 6 1 1 A 108 108 SER CA C 108 56.442 60.489 -4.047 1
1 1068 . 6 1 1 A 108 108 SER CB C 108 60.953 63.279 -2.326 1
1 1069 . 6 1 1 A 108 108 SER N N 108 115.670 114.624 1.046 1
1 1070 . 6 1 1 A 109 109 ARG H H 109 8.068 7.989 0.079 1
1 1071 . 6 1 1 A 109 109 ARG HA H 109 4.307 4.051 0.256 1
1 1078 . 6 1 1 A 109 109 ARG CA C 109 53.732 59.156 -5.424 1
1 1079 . 6 1 1 A 109 109 ARG CB C 109 27.968 30.023 -2.055 1
1 1082 . 6 1 1 A 109 109 ARG N N 109 122.313 121.959 0.354 1
1 1083 . 6 1 1 A 110 110 ASN H H 110 8.292 8.471 -0.179 1
1 1084 . 6 1 1 A 110 110 ASN HA H 110 4.720 4.485 0.235 1
1 1087 . 6 1 1 A 110 110 ASN CA C 110 50.750 55.969 -5.219 1
1 1088 . 6 1 1 A 110 110 ASN CB C 110 36.197 37.757 -1.560 1
1 1089 . 6 1 1 A 110 110 ASN N N 110 119.304 116.666 2.638 1
1 1090 . 6 1 1 A 111 111 SER H H 111 8.244 8.085 0.159 1
1 1091 . 6 1 1 A 111 111 SER HA H 111 4.423 4.297 0.126 1
1 1094 . 6 1 1 A 111 111 SER CA C 111 55.990 60.753 -4.763 1
1 1095 . 6 1 1 A 111 111 SER CB C 111 61.027 63.029 -2.002 1
1 1096 . 6 1 1 A 111 111 SER N N 111 116.119 115.236 0.883 1
1 1097 . 6 1 1 A 112 112 GLY H H 112 8.327 8.058 0.269 1
1 1098 . 6 1 1 A 112 112 GLY HA2 H 112 3.944 3.954 -0.010 1
1 1099 . 6 1 1 A 112 112 GLY HA3 H 112 3.912 3.984 -0.072 1
1 1100 . 6 1 1 A 112 112 GLY CA C 112 42.733 46.212 -3.479 1
1 1101 . 6 1 1 A 112 112 GLY N N 112 110.442 106.720 3.722 1
1 1102 . 6 1 1 A 113 113 GLY H H 113 8.097 8.138 -0.041 1
1 1103 . 6 1 1 A 113 113 GLY HA2 H 113 3.831 3.740 0.091 1
1 1104 . 6 1 1 A 113 113 GLY HA3 H 113 3.785 3.761 0.024 1
1 1105 . 6 1 1 A 113 113 GLY CA C 113 42.435 47.172 -4.737 1
1 1106 . 6 1 1 A 113 113 GLY N N 113 108.745 109.739 -0.994 1
1 2 . 7 1 1 A 3 3 HIS CB C 3 33.709 31.129 2.580 1
1 3 . 7 1 1 A 7 7 HIS H H 7 8.731 8.108 0.623 1
1 4 . 7 1 1 A 7 7 HIS HA H 7 4.564 4.611 -0.047 1
1 7 . 7 1 1 A 7 7 HIS CA C 7 53.649 55.195 -1.546 1
1 8 . 7 1 1 A 7 7 HIS CB C 7 26.268 29.860 -3.592 1
1 9 . 7 1 1 A 7 7 HIS N N 7 121.126 117.862 3.264 1
1 10 . 7 1 1 A 8 8 GLY H H 8 8.540 8.713 -0.173 1
1 11 . 7 1 1 A 8 8 GLY HA2 H 8 3.973 3.867 0.106 1
1 12 . 7 1 1 A 8 8 GLY HA3 H 8 3.811 3.936 -0.125 1
1 13 . 7 1 1 A 8 8 GLY CA C 8 42.618 45.101 -2.483 1
1 14 . 7 1 1 A 8 8 GLY N N 8 110.662 108.450 2.212 1
1 15 . 7 1 1 A 9 9 GLU H H 9 8.239 8.561 -0.322 1
1 16 . 7 1 1 A 9 9 GLU HA H 9 4.568 4.047 0.521 1
1 18 . 7 1 1 A 9 9 GLU CA C 9 53.605 54.692 -1.087 1
1 19 . 7 1 1 A 9 9 GLU CB C 9 28.019 33.763 -5.744 1
1 20 . 7 1 1 A 9 9 GLU N N 9 121.669 121.249 0.420 1
1 21 . 7 1 1 A 10 10 PHE H H 10 8.785 7.997 0.788 1
1 22 . 7 1 1 A 10 10 PHE HA H 10 4.850 5.174 -0.324 1
1 25 . 7 1 1 A 10 10 PHE CA C 10 52.630 56.836 -4.206 1
1 26 . 7 1 1 A 10 10 PHE CB C 10 37.906 40.735 -2.829 1
1 27 . 7 1 1 A 10 10 PHE N N 10 118.401 120.890 -2.489 1
1 28 . 7 1 1 A 11 11 GLN H H 11 8.552 8.665 -0.113 1
1 29 . 7 1 1 A 11 11 GLN HA H 11 5.425 5.019 0.406 1
1 34 . 7 1 1 A 11 11 GLN CA C 11 51.663 54.295 -2.632 1
1 35 . 7 1 1 A 11 11 GLN CB C 11 28.427 30.858 -2.431 1
1 37 . 7 1 1 A 11 11 GLN N N 11 117.519 122.466 -4.947 1
1 38 . 7 1 1 A 12 12 ILE H H 12 8.239 8.235 0.004 1
1 39 . 7 1 1 A 12 12 ILE HA H 12 4.103 4.432 -0.329 1
1 49 . 7 1 1 A 12 12 ILE CA C 12 57.134 59.539 -2.405 1
1 50 . 7 1 1 A 12 12 ILE CB C 12 39.491 39.792 -0.301 1
1 54 . 7 1 1 A 12 12 ILE N N 12 114.043 121.645 -7.602 1
1 55 . 7 1 1 A 13 13 PHE H H 13 8.538 8.543 -0.005 1
1 56 . 7 1 1 A 13 13 PHE HA H 13 5.620 5.381 0.239 1
1 59 . 7 1 1 A 13 13 PHE CA C 13 52.438 56.393 -3.955 1
1 60 . 7 1 1 A 13 13 PHE CB C 13 39.253 42.662 -3.409 1
1 61 . 7 1 1 A 13 13 PHE N N 13 117.015 119.558 -2.543 1
1 62 . 7 1 1 A 14 14 ALA H H 14 9.238 9.575 -0.337 1
1 63 . 7 1 1 A 14 14 ALA HA H 14 5.311 5.646 -0.335 1
1 67 . 7 1 1 A 14 14 ALA CA C 14 47.183 50.133 -2.950 1
1 68 . 7 1 1 A 14 14 ALA CB C 14 17.811 22.791 -4.980 1
1 69 . 7 1 1 A 14 14 ALA N N 14 123.503 123.307 0.196 1
1 70 . 7 1 1 A 15 15 LYS H H 15 8.810 8.935 -0.125 1
1 71 . 7 1 1 A 15 15 LYS HA H 15 5.511 5.389 0.122 1
1 80 . 7 1 1 A 15 15 LYS CA C 15 51.718 54.485 -2.767 1
1 81 . 7 1 1 A 15 15 LYS CB C 15 33.635 35.168 -1.533 1
1 85 . 7 1 1 A 15 15 LYS N N 15 123.382 122.190 1.192 1
1 86 . 7 1 1 A 16 16 THR H H 16 8.830 8.662 0.168 1
1 87 . 7 1 1 A 16 16 THR HA H 16 5.212 4.794 0.418 1
1 92 . 7 1 1 A 16 16 THR CA C 16 57.614 61.127 -3.513 1
1 93 . 7 1 1 A 16 16 THR CB C 16 68.210 71.076 -2.866 1
1 95 . 7 1 1 A 16 16 THR N N 16 116.517 116.420 0.097 1
1 96 . 7 1 1 A 17 17 LEU H H 17 9.428 8.794 0.634 1
1 97 . 7 1 1 A 17 17 LEU HA H 17 4.286 4.230 0.056 1
1 107 . 7 1 1 A 17 17 LEU CA C 17 54.504 57.377 -2.873 1
1 108 . 7 1 1 A 17 17 LEU CB C 17 38.564 42.016 -3.452 1
1 112 . 7 1 1 A 17 17 LEU N N 17 121.786 123.376 -1.590 1
1 113 . 7 1 1 A 18 18 THR H H 18 7.546 7.749 -0.203 1
1 114 . 7 1 1 A 18 18 THR HA H 18 4.391 4.393 -0.002 1
1 119 . 7 1 1 A 18 18 THR CA C 18 58.524 62.634 -4.110 1
1 120 . 7 1 1 A 18 18 THR CB C 18 66.166 70.581 -4.415 1
1 122 . 7 1 1 A 18 18 THR N N 18 105.598 107.633 -2.035 1
1 123 . 7 1 1 A 19 19 GLY H H 19 7.683 8.154 -0.471 1
1 124 . 7 1 1 A 19 19 GLY HA2 H 19 3.300 3.978 -0.678 1
1 125 . 7 1 1 A 19 19 GLY HA3 H 19 4.248 3.991 0.257 1
1 126 . 7 1 1 A 19 19 GLY CA C 19 42.947 45.906 -2.959 1
1 127 . 7 1 1 A 19 19 GLY N N 19 109.243 112.133 -2.890 1
1 128 . 7 1 1 A 20 20 LYS H H 20 7.375 7.634 -0.259 1
1 129 . 7 1 1 A 20 20 LYS HA H 20 4.331 4.707 -0.376 1
1 138 . 7 1 1 A 20 20 LYS CA C 20 53.829 54.984 -1.155 1
1 139 . 7 1 1 A 20 20 LYS CB C 20 30.385 34.474 -4.089 1
1 143 . 7 1 1 A 20 20 LYS N N 20 122.757 120.681 2.076 1
1 144 . 7 1 1 A 21 21 THR H H 21 8.637 8.647 -0.010 1
1 145 . 7 1 1 A 21 21 THR HA H 21 4.852 4.931 -0.079 1
1 150 . 7 1 1 A 21 21 THR CA C 21 59.846 61.014 -1.168 1
1 151 . 7 1 1 A 21 21 THR CB C 21 67.140 69.983 -2.843 1
1 153 . 7 1 1 A 21 21 THR N N 21 121.524 117.282 4.242 1
1 154 . 7 1 1 A 22 22 ILE H H 22 9.509 9.112 0.397 1
1 155 . 7 1 1 A 22 22 ILE HA H 22 4.349 4.816 -0.467 1
1 165 . 7 1 1 A 22 22 ILE CA C 22 57.634 60.161 -2.527 1
1 166 . 7 1 1 A 22 22 ILE CB C 22 38.334 42.113 -3.779 1
1 170 . 7 1 1 A 22 22 ILE N N 22 129.772 125.962 3.810 1
1 171 . 7 1 1 A 23 23 THR H H 23 8.838 8.907 -0.069 1
1 172 . 7 1 1 A 23 23 THR HA H 23 4.653 5.079 -0.426 1
1 177 . 7 1 1 A 23 23 THR CA C 23 60.194 61.960 -1.766 1
1 178 . 7 1 1 A 23 23 THR CB C 23 66.577 70.320 -3.743 1
1 180 . 7 1 1 A 23 23 THR N N 23 124.070 123.716 0.354 1
1 181 . 7 1 1 A 24 24 LEU H H 24 8.749 8.797 -0.048 1
1 182 . 7 1 1 A 24 24 LEU HA H 24 4.619 4.804 -0.185 1
1 192 . 7 1 1 A 24 24 LEU CA C 24 50.257 53.162 -2.905 1
1 193 . 7 1 1 A 24 24 LEU CB C 24 42.932 44.651 -1.719 1
1 197 . 7 1 1 A 24 24 LEU N N 24 126.499 126.562 -0.063 1
1 198 . 7 1 1 A 25 25 GLU H H 25 7.990 8.649 -0.659 1
1 199 . 7 1 1 A 25 25 GLU HA H 25 4.591 4.539 0.052 1
1 204 . 7 1 1 A 25 25 GLU CA C 25 52.845 56.162 -3.317 1
1 205 . 7 1 1 A 25 25 GLU CB C 25 27.210 29.405 -2.195 1
1 207 . 7 1 1 A 25 25 GLU N N 25 121.644 124.944 -3.300 1
1 208 . 7 1 1 A 26 26 VAL H H 26 8.657 8.280 0.377 1
1 209 . 7 1 1 A 26 26 VAL HA H 26 4.403 5.051 -0.648 1
1 217 . 7 1 1 A 26 26 VAL CA C 26 56.020 59.053 -3.033 1
1 218 . 7 1 1 A 26 26 VAL CB C 26 33.631 36.168 -2.537 1
1 221 . 7 1 1 A 26 26 VAL N N 26 116.647 117.680 -1.033 1
1 222 . 7 1 1 A 27 27 GLU H H 27 7.970 8.818 -0.848 1
1 223 . 7 1 1 A 27 27 GLU HA H 27 4.447 4.762 -0.315 1
1 228 . 7 1 1 A 27 27 GLU CA C 27 51.386 54.768 -3.382 1
1 229 . 7 1 1 A 27 27 GLU CB C 27 30.905 31.912 -1.007 1
1 231 . 7 1 1 A 27 27 GLU N N 27 115.496 121.191 -5.695 1
1 232 . 7 1 1 A 28 28 SER H H 28 9.192 8.872 0.320 1
1 233 . 7 1 1 A 28 28 SER HA H 28 4.108 4.143 -0.035 1
1 236 . 7 1 1 A 28 28 SER CA C 28 59.909 60.973 -1.064 1
1 237 . 7 1 1 A 28 28 SER CB C 28 60.399 62.862 -2.463 1
1 238 . 7 1 1 A 28 28 SER N N 28 117.720 118.737 -1.017 1
1 239 . 7 1 1 A 29 29 SER H H 29 7.371 7.819 -0.448 1
1 240 . 7 1 1 A 29 29 SER HA H 29 4.327 4.655 -0.328 1
1 243 . 7 1 1 A 29 29 SER CA C 29 54.805 57.386 -2.581 1
1 244 . 7 1 1 A 29 29 SER CB C 29 60.775 63.906 -3.131 1
1 245 . 7 1 1 A 29 29 SER N N 29 108.936 115.793 -6.857 1
1 246 . 7 1 1 A 30 30 ASP H H 30 7.852 7.630 0.222 1
1 247 . 7 1 1 A 30 30 ASP HA H 30 4.591 4.560 0.031 1
1 250 . 7 1 1 A 30 30 ASP CA C 30 53.040 54.779 -1.739 1
1 251 . 7 1 1 A 30 30 ASP CB C 30 37.942 41.408 -3.466 1
1 252 . 7 1 1 A 30 30 ASP N N 30 123.735 121.592 2.143 1
1 253 . 7 1 1 A 31 31 THR H H 31 7.852 8.459 -0.607 1
1 254 . 7 1 1 A 31 31 THR HA H 31 4.918 4.861 0.057 1
1 259 . 7 1 1 A 31 31 THR CA C 31 56.929 60.087 -3.158 1
1 260 . 7 1 1 A 31 31 THR CB C 31 68.674 71.638 -2.964 1
1 262 . 7 1 1 A 31 31 THR N N 31 109.181 112.509 -3.328 1
1 263 . 7 1 1 A 32 32 ILE H H 32 8.582 8.820 -0.238 1
1 264 . 7 1 1 A 32 32 ILE HA H 32 3.624 3.812 -0.188 1
1 274 . 7 1 1 A 32 32 ILE CA C 32 59.474 65.364 -5.890 1
1 275 . 7 1 1 A 32 32 ILE CB C 32 31.561 37.584 -6.023 1
1 279 . 7 1 1 A 32 32 ILE N N 32 121.833 122.869 -1.036 1
1 280 . 7 1 1 A 33 33 ASP H H 33 9.255 8.273 0.982 1
1 281 . 7 1 1 A 33 33 ASP HA H 33 4.201 4.292 -0.091 1
1 284 . 7 1 1 A 33 33 ASP CA C 33 54.679 57.769 -3.090 1
1 285 . 7 1 1 A 33 33 ASP CB C 33 37.700 42.039 -4.339 1
1 286 . 7 1 1 A 33 33 ASP N N 33 119.823 120.656 -0.833 1
1 287 . 7 1 1 A 34 34 ASN H H 34 8.026 7.659 0.367 1
1 288 . 7 1 1 A 34 34 ASN HA H 34 4.409 4.610 -0.201 1
1 291 . 7 1 1 A 34 34 ASN CA C 34 53.324 56.269 -2.945 1
1 292 . 7 1 1 A 34 34 ASN CB C 34 35.782 38.784 -3.002 1
1 293 . 7 1 1 A 34 34 ASN N N 34 119.540 115.830 3.710 1
1 294 . 7 1 1 A 35 35 VAL H H 35 8.167 7.608 0.559 1
1 295 . 7 1 1 A 35 35 VAL HA H 35 3.249 3.728 -0.479 1
1 303 . 7 1 1 A 35 35 VAL CA C 35 65.308 65.504 -0.196 1
1 304 . 7 1 1 A 35 35 VAL CB C 35 27.965 31.512 -3.547 1
1 307 . 7 1 1 A 35 35 VAL N N 35 122.223 116.535 5.688 1
1 308 . 7 1 1 A 36 36 LYS H H 36 8.460 8.358 0.102 1
1 313 . 7 1 1 A 36 36 LYS CB C 36 30.753 32.280 -1.527 1
1 315 . 7 1 1 A 36 36 LYS N N 36 119.438 122.500 -3.062 1
1 316 . 7 1 1 A 37 37 SER H H 37 8.196 8.614 -0.418 1
1 317 . 7 1 1 A 37 37 SER HA H 37 4.130 4.179 -0.049 1
1 320 . 7 1 1 A 37 37 SER CA C 37 58.528 61.273 -2.745 1
1 321 . 7 1 1 A 37 37 SER CB C 37 59.768 62.596 -2.828 1
1 322 . 7 1 1 A 37 37 SER N N 37 117.791 114.344 3.447 1
1 323 . 7 1 1 A 38 38 LYS H H 38 8.043 8.103 -0.060 1
1 324 . 7 1 1 A 38 38 LYS HA H 38 4.095 4.004 0.091 1
1 325 . 7 1 1 A 38 38 LYS CA C 38 57.377 59.185 -1.808 1
1 326 . 7 1 1 A 38 38 LYS N N 38 124.094 120.589 3.505 1
1 327 . 7 1 1 A 39 39 ILE H H 39 8.254 8.184 0.070 1
1 328 . 7 1 1 A 39 39 ILE HA H 39 3.439 3.716 -0.277 1
1 338 . 7 1 1 A 39 39 ILE CA C 39 63.977 65.180 -1.203 1
1 339 . 7 1 1 A 39 39 ILE CB C 39 33.935 37.771 -3.836 1
1 343 . 7 1 1 A 39 39 ILE N N 39 122.107 120.364 1.743 1
1 344 . 7 1 1 A 40 40 GLN H H 40 8.379 8.373 0.006 1
1 345 . 7 1 1 A 40 40 GLN HA H 40 3.746 4.055 -0.309 1
1 350 . 7 1 1 A 40 40 GLN CA C 40 57.472 58.139 -0.667 1
1 351 . 7 1 1 A 40 40 GLN CB C 40 25.072 27.753 -2.681 1
1 353 . 7 1 1 A 40 40 GLN N N 40 123.725 120.212 3.513 1
1 354 . 7 1 1 A 41 41 ASP H H 41 8.210 7.878 0.332 1
1 355 . 7 1 1 A 41 41 ASP HA H 41 4.247 4.386 -0.139 1
1 358 . 7 1 1 A 41 41 ASP CA C 41 54.646 56.599 -1.953 1
1 359 . 7 1 1 A 41 41 ASP CB C 41 38.136 40.793 -2.657 1
1 360 . 7 1 1 A 41 41 ASP N N 41 120.564 120.612 -0.048 1
1 361 . 7 1 1 A 42 42 LYS H H 42 7.381 8.035 -0.654 1
1 362 . 7 1 1 A 42 42 LYS HA H 42 4.246 4.318 -0.072 1
1 369 . 7 1 1 A 42 42 LYS CA C 42 55.579 57.788 -2.209 1
1 370 . 7 1 1 A 42 42 LYS CB C 42 31.406 33.532 -2.126 1
1 373 . 7 1 1 A 42 42 LYS N N 42 115.674 116.555 -0.881 1
1 374 . 7 1 1 A 43 43 GLU H H 43 8.537 8.504 0.033 1
1 375 . 7 1 1 A 43 43 GLU HA H 43 4.522 4.545 -0.023 1
1 380 . 7 1 1 A 43 43 GLU CA C 43 52.772 55.672 -2.900 1
1 381 . 7 1 1 A 43 43 GLU CB C 43 30.535 31.052 -0.517 1
1 383 . 7 1 1 A 43 43 GLU N N 43 114.355 116.241 -1.886 1
1 384 . 7 1 1 A 44 44 GLY H H 44 8.611 8.295 0.316 1
1 385 . 7 1 1 A 44 44 GLY HA2 H 44 4.067 3.978 0.089 1
1 386 . 7 1 1 A 44 44 GLY HA3 H 44 3.819 3.978 -0.159 1
1 387 . 7 1 1 A 44 44 GLY CA C 44 43.205 45.345 -2.140 1
1 388 . 7 1 1 A 44 44 GLY N N 44 109.406 108.535 0.871 1
1 389 . 7 1 1 A 45 45 ILE H H 45 6.092 8.074 -1.982 1
1 390 . 7 1 1 A 45 45 ILE HA H 45 4.324 4.129 0.195 1
1 400 . 7 1 1 A 45 45 ILE CA C 45 55.211 60.085 -4.874 1
1 401 . 7 1 1 A 45 45 ILE CB C 45 37.903 38.184 -0.281 1
1 405 . 7 1 1 A 45 45 ILE N N 45 120.791 122.506 -1.715 1
1 406 . 7 1 1 A 46 46 PRO HA H 46 4.547 4.549 -0.002 1
1 413 . 7 1 1 A 46 46 PRO CA C 46 58.971 62.049 -3.078 1
1 414 . 7 1 1 A 46 46 PRO CB C 46 29.142 32.449 -3.307 1
1 417 . 7 1 1 A 47 47 PRO HA H 47 4.062 4.157 -0.095 1
1 424 . 7 1 1 A 47 47 PRO CA C 47 63.476 65.837 -2.361 1
1 425 . 7 1 1 A 47 47 PRO CB C 47 30.113 31.944 -1.831 1
1 428 . 7 1 1 A 48 48 ASP H H 48 8.418 8.156 0.262 1
1 429 . 7 1 1 A 48 48 ASP HA H 48 4.346 4.410 -0.064 1
1 432 . 7 1 1 A 48 48 ASP CA C 48 52.838 57.082 -4.244 1
1 433 . 7 1 1 A 48 48 ASP CB C 48 36.926 40.805 -3.879 1
1 434 . 7 1 1 A 48 48 ASP N N 48 113.462 117.507 -4.045 1
1 435 . 7 1 1 A 49 49 GLN H H 49 7.822 7.784 0.038 1
1 436 . 7 1 1 A 49 49 GLN HA H 49 4.283 4.085 0.198 1
1 439 . 7 1 1 A 49 49 GLN CA C 49 52.770 57.884 -5.114 1
1 441 . 7 1 1 A 49 49 GLN N N 49 117.377 117.472 -0.095 1
1 442 . 7 1 1 A 50 50 GLN H H 50 7.451 7.411 0.040 1
1 443 . 7 1 1 A 50 50 GLN HA H 50 4.260 4.955 -0.695 1
1 448 . 7 1 1 A 50 50 GLN CA C 50 53.725 53.921 -0.196 1
1 449 . 7 1 1 A 50 50 GLN CB C 50 29.142 31.825 -2.683 1
1 451 . 7 1 1 A 50 50 GLN N N 50 117.526 115.071 2.455 1
1 452 . 7 1 1 A 51 51 ARG H H 51 8.534 8.282 0.252 1
1 453 . 7 1 1 A 51 51 ARG HA H 51 4.486 5.139 -0.653 1
1 460 . 7 1 1 A 51 51 ARG CA C 51 52.492 54.253 -1.761 1
1 461 . 7 1 1 A 51 51 ARG CB C 51 29.096 34.744 -5.648 1
1 464 . 7 1 1 A 51 51 ARG N N 51 121.655 119.097 2.558 1
1 465 . 7 1 1 A 52 52 LEU H H 52 8.683 8.801 -0.118 1
1 466 . 7 1 1 A 52 52 LEU HA H 52 5.255 5.109 0.146 1
1 476 . 7 1 1 A 52 52 LEU CA C 52 50.618 53.722 -3.104 1
1 477 . 7 1 1 A 52 52 LEU CB C 52 43.007 44.610 -1.603 1
1 481 . 7 1 1 A 52 52 LEU N N 52 122.929 120.505 2.424 1
1 482 . 7 1 1 A 53 53 ILE H H 53 9.286 8.974 0.312 1
1 483 . 7 1 1 A 53 53 ILE HA H 53 5.096 4.950 0.146 1
1 492 . 7 1 1 A 53 53 ILE CA C 53 56.795 60.429 -3.634 1
1 496 . 7 1 1 A 53 53 ILE N N 53 124.718 125.348 -0.630 1
1 497 . 7 1 1 A 54 54 TRP H H 54 8.871 9.155 -0.284 1
1 499 . 7 1 1 A 54 54 TRP N N 54 127.412 128.556 -1.144 1
1 501 . 7 1 1 A 55 55 ALA H H 55 8.401 8.633 -0.232 1
1 502 . 7 1 1 A 55 55 ALA HA H 55 3.183 3.399 -0.216 1
1 506 . 7 1 1 A 55 55 ALA CA C 55 49.712 52.572 -2.860 1
1 507 . 7 1 1 A 55 55 ALA CB C 55 13.252 16.927 -3.675 1
1 508 . 7 1 1 A 55 55 ALA N N 55 128.894 130.305 -1.411 1
1 509 . 7 1 1 A 56 56 GLY H H 56 8.248 8.433 -0.185 1
1 510 . 7 1 1 A 56 56 GLY HA2 H 56 3.968 3.745 0.223 1
1 511 . 7 1 1 A 56 56 GLY HA3 H 56 3.916 3.760 0.156 1
1 512 . 7 1 1 A 56 56 GLY CA C 56 43.142 45.566 -2.424 1
1 513 . 7 1 1 A 56 56 GLY N N 56 101.499 102.550 -1.051 1
1 514 . 7 1 1 A 57 57 LYS H H 57 8.028 7.472 0.556 1
1 515 . 7 1 1 A 57 57 LYS HA H 57 4.609 4.703 -0.094 1
1 522 . 7 1 1 A 57 57 LYS CA C 57 51.928 54.690 -2.762 1
1 523 . 7 1 1 A 57 57 LYS CB C 57 32.613 35.192 -2.579 1
1 526 . 7 1 1 A 57 57 LYS N N 57 118.995 121.379 -2.384 1
1 527 . 7 1 1 A 58 58 GLN H H 58 8.607 8.441 0.166 1
1 528 . 7 1 1 A 58 58 GLN HA H 58 4.617 4.534 0.083 1
1 533 . 7 1 1 A 58 58 GLN CA C 58 53.261 55.863 -2.602 1
1 534 . 7 1 1 A 58 58 GLN CB C 58 26.613 29.330 -2.717 1
1 536 . 7 1 1 A 58 58 GLN N N 58 119.825 125.816 -5.991 1
1 537 . 7 1 1 A 59 59 LEU H H 59 8.653 8.970 -0.317 1
1 538 . 7 1 1 A 59 59 LEU HA H 59 4.138 4.464 -0.326 1
1 548 . 7 1 1 A 59 59 LEU CA C 59 51.991 54.515 -2.524 1
1 549 . 7 1 1 A 59 59 LEU CB C 59 39.006 42.247 -3.241 1
1 553 . 7 1 1 A 59 59 LEU N N 59 125.484 124.386 1.098 1
1 554 . 7 1 1 A 60 60 GLU H H 60 8.461 9.058 -0.597 1
1 555 . 7 1 1 A 60 60 GLU HA H 60 4.371 4.493 -0.122 1
1 559 . 7 1 1 A 60 60 GLU CA C 60 53.436 56.039 -2.603 1
1 560 . 7 1 1 A 60 60 GLU CB C 60 29.057 30.838 -1.781 1
1 562 . 7 1 1 A 60 60 GLU N N 60 123.237 122.980 0.257 1
1 563 . 7 1 1 A 61 61 ASP H H 61 8.076 8.892 -0.816 1
1 564 . 7 1 1 A 61 61 ASP HA H 61 4.265 4.351 -0.086 1
1 567 . 7 1 1 A 61 61 ASP CA C 61 54.398 56.404 -2.006 1
1 568 . 7 1 1 A 61 61 ASP CB C 61 38.340 40.086 -1.746 1
1 569 . 7 1 1 A 61 61 ASP N N 61 120.701 123.325 -2.624 1
1 570 . 7 1 1 A 62 62 GLY HA2 H 62 4.104 3.988 0.116 1
1 571 . 7 1 1 A 62 62 GLY HA3 H 62 3.832 3.989 -0.157 1
1 572 . 7 1 1 A 62 62 GLY CA C 62 42.576 45.436 -2.860 1
1 573 . 7 1 1 A 63 63 ARG H H 63 7.319 8.474 -1.155 1
1 574 . 7 1 1 A 63 63 ARG HA H 63 4.595 4.458 0.137 1
1 579 . 7 1 1 A 63 63 ARG CA C 63 51.971 56.179 -4.208 1
1 582 . 7 1 1 A 63 63 ARG N N 63 119.206 121.915 -2.709 1
1 583 . 7 1 1 A 64 64 THR H H 64 8.735 8.573 0.162 1
1 584 . 7 1 1 A 64 64 THR HA H 64 5.208 5.030 0.178 1
1 589 . 7 1 1 A 64 64 THR CA C 64 57.126 59.542 -2.416 1
1 590 . 7 1 1 A 64 64 THR CB C 64 69.885 71.888 -2.003 1
1 592 . 7 1 1 A 64 64 THR N N 64 108.713 115.717 -7.004 1
1 593 . 7 1 1 A 65 65 LEU H H 65 8.241 9.355 -1.114 1
1 594 . 7 1 1 A 65 65 LEU HA H 65 4.003 3.993 0.010 1
1 604 . 7 1 1 A 65 65 LEU CA C 65 56.409 57.893 -1.484 1
1 605 . 7 1 1 A 65 65 LEU CB C 65 37.179 41.605 -4.426 1
1 609 . 7 1 1 A 65 65 LEU N N 65 118.111 122.716 -4.605 1
1 610 . 7 1 1 A 66 66 SER H H 66 8.296 8.037 0.259 1
1 611 . 7 1 1 A 66 66 SER HA H 66 4.201 4.234 -0.033 1
1 614 . 7 1 1 A 66 66 SER CA C 66 58.454 60.678 -2.224 1
1 615 . 7 1 1 A 66 66 SER CB C 66 59.969 63.054 -3.085 1
1 616 . 7 1 1 A 66 66 SER N N 66 113.148 113.781 -0.633 1
1 617 . 7 1 1 A 67 67 ASP H H 67 7.984 8.291 -0.307 1
1 618 . 7 1 1 A 67 67 ASP HA H 67 4.187 4.200 -0.013 1
1 621 . 7 1 1 A 67 67 ASP CA C 67 54.744 57.127 -2.383 1
1 622 . 7 1 1 A 67 67 ASP CB C 67 37.794 41.508 -3.714 1
1 623 . 7 1 1 A 67 67 ASP N N 67 124.130 121.621 2.509 1
1 624 . 7 1 1 A 68 68 TYR H H 68 7.177 7.779 -0.602 1
1 625 . 7 1 1 A 68 68 TYR N N 68 115.334 115.538 -0.204 1
1 626 . 7 1 1 A 69 69 ASN H H 69 8.111 8.038 0.073 1
1 627 . 7 1 1 A 69 69 ASN HA H 69 4.253 4.346 -0.093 1
1 630 . 7 1 1 A 69 69 ASN CA C 69 51.386 54.254 -2.868 1
1 631 . 7 1 1 A 69 69 ASN CB C 69 34.867 36.390 -1.523 1
1 632 . 7 1 1 A 69 69 ASN N N 69 116.867 114.264 2.603 1
1 633 . 7 1 1 A 70 70 ILE H H 70 7.460 7.805 -0.345 1
1 634 . 7 1 1 A 70 70 ILE HA H 70 3.210 3.959 -0.749 1
1 644 . 7 1 1 A 70 70 ILE CA C 70 60.157 61.711 -1.554 1
1 645 . 7 1 1 A 70 70 ILE CB C 70 34.754 37.486 -2.732 1
1 649 . 7 1 1 A 70 70 ILE N N 70 119.821 119.344 0.477 1
1 650 . 7 1 1 A 71 71 GLN H H 71 7.368 8.855 -1.487 1
1 651 . 7 1 1 A 71 71 GLN HA H 71 4.099 4.589 -0.490 1
1 656 . 7 1 1 A 71 71 GLN CA C 71 50.906 55.070 -4.164 1
1 657 . 7 1 1 A 71 71 GLN CB C 71 28.793 29.482 -0.689 1
1 659 . 7 1 1 A 71 71 GLN N N 71 124.287 125.538 -1.251 1
1 660 . 7 1 1 A 72 72 ARG H H 72 7.583 8.218 -0.635 1
1 661 . 7 1 1 A 72 72 ARG HA H 72 3.907 4.439 -0.532 1
1 668 . 7 1 1 A 72 72 ARG CA C 72 54.527 57.237 -2.710 1
1 669 . 7 1 1 A 72 72 ARG CB C 72 27.470 31.414 -3.944 1
1 672 . 7 1 1 A 72 72 ARG N N 72 119.007 121.765 -2.758 1
1 673 . 7 1 1 A 73 73 GLU H H 73 9.262 8.037 1.225 1
1 674 . 7 1 1 A 73 73 GLU HA H 73 3.586 4.821 -1.235 1
1 679 . 7 1 1 A 73 73 GLU CA C 73 55.703 55.305 0.398 1
1 680 . 7 1 1 A 73 73 GLU CB C 73 23.669 28.699 -5.030 1
1 682 . 7 1 1 A 73 73 GLU N N 73 115.180 118.028 -2.848 1
1 683 . 7 1 1 A 74 74 SER H H 74 7.551 8.733 -1.182 1
1 684 . 7 1 1 A 74 74 SER HA H 74 4.613 5.275 -0.662 1
1 687 . 7 1 1 A 74 74 SER CA C 74 58.305 57.475 0.830 1
1 688 . 7 1 1 A 74 74 SER CB C 74 62.156 66.359 -4.203 1
1 689 . 7 1 1 A 74 74 SER N N 74 115.104 120.197 -5.093 1
1 690 . 7 1 1 A 75 75 THR H H 75 8.785 8.733 0.052 1
1 691 . 7 1 1 A 75 75 THR HA H 75 5.014 4.750 0.264 1
1 696 . 7 1 1 A 75 75 THR CA C 75 59.835 62.041 -2.206 1
1 697 . 7 1 1 A 75 75 THR CB C 75 67.258 68.662 -1.404 1
1 699 . 7 1 1 A 75 75 THR N N 75 118.401 119.148 -0.747 1
1 700 . 7 1 1 A 76 76 LEU H H 76 9.447 9.668 -0.221 1
1 701 . 7 1 1 A 76 76 LEU HA H 76 4.930 4.535 0.395 1
1 711 . 7 1 1 A 76 76 LEU CA C 76 51.107 54.144 -3.037 1
1 712 . 7 1 1 A 76 76 LEU CB C 76 40.841 41.011 -0.170 1
1 716 . 7 1 1 A 76 76 LEU N N 76 127.905 127.915 -0.010 1
1 717 . 7 1 1 A 77 77 HIS HA H 77 4.976 4.627 0.349 1
1 720 . 7 1 1 A 77 77 HIS CA C 77 53.776 57.303 -3.527 1
1 721 . 7 1 1 A 77 77 HIS CB C 77 28.438 29.705 -1.267 1
1 722 . 7 1 1 A 78 78 LEU H H 78 8.450 9.554 -1.104 1
1 723 . 7 1 1 A 78 78 LEU HA H 78 5.085 5.073 0.012 1
1 733 . 7 1 1 A 78 78 LEU CA C 78 50.896 53.675 -2.779 1
1 734 . 7 1 1 A 78 78 LEU CB C 78 41.916 44.924 -3.008 1
1 738 . 7 1 1 A 78 78 LEU N N 78 126.178 126.240 -0.062 1
1 739 . 7 1 1 A 79 79 VAL H H 79 9.093 9.511 -0.418 1
1 740 . 7 1 1 A 79 79 VAL HA H 79 4.053 4.723 -0.670 1
1 748 . 7 1 1 A 79 79 VAL CA C 79 59.054 61.669 -2.615 1
1 749 . 7 1 1 A 79 79 VAL CB C 79 32.115 33.049 -0.934 1
1 752 . 7 1 1 A 79 79 VAL N N 79 128.372 126.396 1.976 1
1 753 . 7 1 1 A 80 80 LEU H H 80 8.000 8.853 -0.853 1
1 754 . 7 1 1 A 80 80 LEU HA H 80 5.105 5.064 0.041 1
1 764 . 7 1 1 A 80 80 LEU CA C 80 50.556 53.228 -2.672 1
1 765 . 7 1 1 A 80 80 LEU CB C 80 39.597 45.455 -5.858 1
1 769 . 7 1 1 A 80 80 LEU N N 80 126.145 128.714 -2.569 1
1 770 . 7 1 1 A 81 81 ARG H H 81 8.470 7.925 0.545 1
1 771 . 7 1 1 A 81 81 ARG HA H 81 4.197 4.377 -0.180 1
1 778 . 7 1 1 A 81 81 ARG CA C 81 53.133 54.544 -1.411 1
1 779 . 7 1 1 A 81 81 ARG CB C 81 28.413 32.008 -3.595 1
1 782 . 7 1 1 A 81 81 ARG N N 81 121.625 128.268 -6.643 1
1 783 . 7 1 1 A 82 82 LEU H H 82 8.454 8.137 0.317 1
1 784 . 7 1 1 A 82 82 LEU HA H 82 4.339 4.278 0.061 1
1 794 . 7 1 1 A 82 82 LEU CA C 82 52.081 55.829 -3.748 1
1 795 . 7 1 1 A 82 82 LEU CB C 82 39.810 42.210 -2.400 1
1 799 . 7 1 1 A 82 82 LEU N N 82 123.832 123.071 0.761 1
1 800 . 7 1 1 A 83 83 ARG H H 83 8.404 8.982 -0.578 1
1 801 . 7 1 1 A 83 83 ARG HA H 83 4.308 4.188 0.120 1
1 808 . 7 1 1 A 83 83 ARG CA C 83 53.258 57.162 -3.904 1
1 809 . 7 1 1 A 83 83 ARG CB C 83 28.160 31.790 -3.630 1
1 812 . 7 1 1 A 83 83 ARG N N 83 121.447 128.489 -7.042 1
1 813 . 7 1 1 A 84 84 GLY H H 84 8.410 7.467 0.943 1
1 814 . 7 1 1 A 84 84 GLY HA2 H 84 3.929 4.128 -0.199 1
1 815 . 7 1 1 A 84 84 GLY HA3 H 84 3.929 4.128 -0.199 1
1 816 . 7 1 1 A 84 84 GLY CA C 84 42.751 45.376 -2.625 1
1 817 . 7 1 1 A 84 84 GLY N N 84 110.030 107.057 2.973 1
1 818 . 7 1 1 A 85 85 GLY H H 85 8.295 8.816 -0.521 1
1 819 . 7 1 1 A 85 85 GLY HA2 H 85 3.950 3.916 0.034 1
1 820 . 7 1 1 A 85 85 GLY HA3 H 85 3.950 3.916 0.034 1
1 821 . 7 1 1 A 85 85 GLY CA C 85 42.831 46.992 -4.161 1
1 822 . 7 1 1 A 85 85 GLY N N 85 108.838 111.526 -2.688 1
1 823 . 7 1 1 A 86 86 SER H H 86 8.292 8.017 0.275 1
1 824 . 7 1 1 A 86 86 SER HA H 86 4.405 4.707 -0.302 1
1 827 . 7 1 1 A 86 86 SER CA C 86 55.965 56.975 -1.010 1
1 828 . 7 1 1 A 86 86 SER CB C 86 61.232 63.587 -2.355 1
1 829 . 7 1 1 A 86 86 SER N N 86 116.028 114.609 1.419 1
1 830 . 7 1 1 A 87 87 MET H H 87 8.470 8.147 0.323 1
1 831 . 7 1 1 A 87 87 MET HA H 87 4.447 4.627 -0.180 1
1 836 . 7 1 1 A 87 87 MET CA C 87 53.281 57.310 -4.029 1
1 837 . 7 1 1 A 87 87 MET CB C 87 29.788 33.570 -3.782 1
1 839 . 7 1 1 A 87 87 MET N N 87 121.625 124.324 -2.699 1
1 840 . 7 1 1 A 88 88 GLY H H 88 8.320 8.150 0.170 1
1 841 . 7 1 1 A 88 88 GLY HA2 H 88 3.919 3.822 0.097 1
1 842 . 7 1 1 A 88 88 GLY HA3 H 88 3.896 3.822 0.074 1
1 843 . 7 1 1 A 88 88 GLY CA C 88 43.060 47.309 -4.249 1
1 844 . 7 1 1 A 88 88 GLY N N 88 109.625 108.633 0.992 1
1 845 . 7 1 1 A 89 89 GLY H H 89 8.256 8.697 -0.441 1
1 846 . 7 1 1 A 89 89 GLY HA2 H 89 3.940 4.082 -0.142 1
1 847 . 7 1 1 A 89 89 GLY HA3 H 89 3.910 4.082 -0.172 1
1 848 . 7 1 1 A 89 89 GLY CA C 89 42.678 45.254 -2.576 1
1 849 . 7 1 1 A 89 89 GLY N N 89 108.982 114.118 -5.136 1
1 850 . 7 1 1 A 90 90 ALA H H 90 8.203 8.187 0.016 1
1 851 . 7 1 1 A 90 90 ALA HA H 90 4.255 4.220 0.035 1
1 855 . 7 1 1 A 90 90 ALA CA C 90 50.763 53.119 -2.356 1
1 856 . 7 1 1 A 90 90 ALA CB C 90 16.364 19.720 -3.356 1
1 857 . 7 1 1 A 90 90 ALA N N 90 124.065 120.763 3.302 1
1 858 . 7 1 1 A 91 91 ALA H H 91 8.273 7.012 1.261 1
1 859 . 7 1 1 A 91 91 ALA HA H 91 4.204 4.570 -0.366 1
1 863 . 7 1 1 A 91 91 ALA CA C 91 51.080 52.272 -1.192 1
1 864 . 7 1 1 A 91 91 ALA CB C 91 16.036 20.567 -4.531 1
1 865 . 7 1 1 A 91 91 ALA N N 91 121.985 118.520 3.465 1
1 866 . 7 1 1 A 92 92 ASP H H 92 8.022 8.892 -0.870 1
1 867 . 7 1 1 A 92 92 ASP HA H 92 4.455 4.942 -0.487 1
1 870 . 7 1 1 A 92 92 ASP CA C 92 52.664 53.351 -0.687 1
1 871 . 7 1 1 A 92 92 ASP CB C 92 37.925 41.029 -3.104 1
1 872 . 7 1 1 A 92 92 ASP N N 92 118.621 124.697 -6.076 1
1 873 . 7 1 1 A 93 93 GLU H H 93 8.282 8.126 0.156 1
1 874 . 7 1 1 A 93 93 GLU HA H 93 3.912 3.934 -0.022 1
1 879 . 7 1 1 A 93 93 GLU CA C 93 56.947 57.772 -0.825 1
1 880 . 7 1 1 A 93 93 GLU CB C 93 27.413 27.944 -0.531 1
1 882 . 7 1 1 A 93 93 GLU N N 93 122.247 115.369 6.878 1
1 883 . 7 1 1 A 94 94 GLU H H 94 8.194 7.965 0.229 1
1 884 . 7 1 1 A 94 94 GLU HA H 94 3.940 4.446 -0.506 1
1 889 . 7 1 1 A 94 94 GLU CA C 94 56.681 57.628 -0.947 1
1 890 . 7 1 1 A 94 94 GLU CB C 94 26.127 32.020 -5.893 1
1 892 . 7 1 1 A 94 94 GLU N N 94 118.024 115.463 2.561 1
1 893 . 7 1 1 A 95 95 GLU H H 95 7.816 8.618 -0.802 1
1 894 . 7 1 1 A 95 95 GLU HA H 95 4.121 4.125 -0.004 1
1 898 . 7 1 1 A 95 95 GLU CA C 95 56.162 58.731 -2.569 1
1 899 . 7 1 1 A 95 95 GLU CB C 95 26.403 28.695 -2.292 1
1 901 . 7 1 1 A 95 95 GLU N N 95 120.028 120.440 -0.412 1
1 902 . 7 1 1 A 96 96 LEU H H 96 7.637 7.804 -0.167 1
1 903 . 7 1 1 A 96 96 LEU HA H 96 3.988 4.080 -0.092 1
1 913 . 7 1 1 A 96 96 LEU CA C 96 55.303 57.336 -2.033 1
1 914 . 7 1 1 A 96 96 LEU CB C 96 39.038 41.536 -2.498 1
1 918 . 7 1 1 A 96 96 LEU N N 96 119.866 118.343 1.523 1
1 919 . 7 1 1 A 97 97 ILE H H 97 8.044 7.461 0.583 1
1 920 . 7 1 1 A 97 97 ILE HA H 97 3.478 3.989 -0.511 1
1 930 . 7 1 1 A 97 97 ILE CA C 97 62.054 63.641 -1.587 1
1 931 . 7 1 1 A 97 97 ILE CB C 97 34.541 38.060 -3.519 1
1 935 . 7 1 1 A 97 97 ILE N N 97 119.088 119.480 -0.392 1
1 936 . 7 1 1 A 98 98 ARG H H 98 7.991 8.345 -0.354 1
1 937 . 7 1 1 A 98 98 ARG HA H 98 3.793 4.022 -0.229 1
1 944 . 7 1 1 A 98 98 ARG CA C 98 57.509 58.886 -1.377 1
1 945 . 7 1 1 A 98 98 ARG CB C 98 27.191 30.014 -2.823 1
1 948 . 7 1 1 A 98 98 ARG N N 98 119.225 120.597 -1.372 1
1 949 . 7 1 1 A 99 99 LYS H H 99 8.101 7.941 0.160 1
1 950 . 7 1 1 A 99 99 LYS HA H 99 3.968 4.056 -0.088 1
1 959 . 7 1 1 A 99 99 LYS CA C 99 56.455 59.177 -2.722 1
1 960 . 7 1 1 A 99 99 LYS CB C 99 29.531 31.941 -2.410 1
1 964 . 7 1 1 A 99 99 LYS N N 99 119.464 118.525 0.939 1
1 965 . 7 1 1 A 100 100 ALA H H 100 8.167 8.011 0.156 1
1 966 . 7 1 1 A 100 100 ALA HA H 100 3.789 4.090 -0.301 1
1 970 . 7 1 1 A 100 100 ALA CA C 100 52.451 54.724 -2.273 1
1 971 . 7 1 1 A 100 100 ALA CB C 100 16.259 18.273 -2.014 1
1 972 . 7 1 1 A 100 100 ALA N N 100 122.398 121.289 1.109 1
1 973 . 7 1 1 A 101 101 ILE H H 101 8.777 7.976 0.801 1
1 974 . 7 1 1 A 101 101 ILE HA H 101 3.191 3.701 -0.510 1
1 984 . 7 1 1 A 101 101 ILE CA C 101 62.910 64.806 -1.896 1
1 985 . 7 1 1 A 101 101 ILE CB C 101 34.544 37.234 -2.690 1
1 989 . 7 1 1 A 101 101 ILE N N 101 120.431 118.964 1.467 1
1 990 . 7 1 1 A 102 102 GLU H H 102 7.890 7.618 0.272 1
1 991 . 7 1 1 A 102 102 GLU HA H 102 3.848 4.192 -0.344 1
1 996 . 7 1 1 A 102 102 GLU CA C 102 57.079 57.830 -0.751 1
1 997 . 7 1 1 A 102 102 GLU CB C 102 26.769 30.078 -3.309 1
1 999 . 7 1 1 A 102 102 GLU N N 102 120.248 120.212 0.036 1
1 1000 . 7 1 1 A 103 103 LEU H H 103 8.194 7.584 0.610 1
1 1001 . 7 1 1 A 103 103 LEU HA H 103 3.912 4.317 -0.405 1
1 1011 . 7 1 1 A 103 103 LEU CA C 103 55.078 56.200 -1.122 1
1 1012 . 7 1 1 A 103 103 LEU CB C 103 38.963 42.568 -3.605 1
1 1016 . 7 1 1 A 103 103 LEU N N 103 120.341 117.015 3.326 1
1 1017 . 7 1 1 A 104 104 SER H H 104 8.268 8.022 0.246 1
1 1018 . 7 1 1 A 104 104 SER HA H 104 4.120 4.403 -0.283 1
1 1021 . 7 1 1 A 104 104 SER CA C 104 58.301 58.794 -0.493 1
1 1022 . 7 1 1 A 104 104 SER CB C 104 60.193 63.566 -3.373 1
1 1023 . 7 1 1 A 104 104 SER N N 104 115.150 114.791 0.359 1
1 1024 . 7 1 1 A 105 105 LEU H H 105 7.501 7.614 -0.113 1
1 1025 . 7 1 1 A 105 105 LEU HA H 105 4.041 3.984 0.057 1
1 1035 . 7 1 1 A 105 105 LEU CA C 105 53.995 56.957 -2.962 1
1 1036 . 7 1 1 A 105 105 LEU CB C 105 39.597 42.179 -2.582 1
1 1040 . 7 1 1 A 105 105 LEU N N 105 124.223 119.665 4.558 1
1 1041 . 7 1 1 A 106 106 LYS H H 106 7.542 8.046 -0.504 1
1 1042 . 7 1 1 A 106 106 LYS HA H 106 4.090 3.982 0.108 1
1 1050 . 7 1 1 A 106 106 LYS CA C 106 55.495 59.095 -3.600 1
1 1051 . 7 1 1 A 106 106 LYS CB C 106 29.941 32.002 -2.061 1
1 1055 . 7 1 1 A 106 106 LYS N N 106 120.328 117.948 2.380 1
1 1056 . 7 1 1 A 107 107 GLU H H 107 7.884 7.978 -0.094 1
1 1057 . 7 1 1 A 107 107 GLU HA H 107 4.210 4.108 0.102 1
1 1060 . 7 1 1 A 107 107 GLU CA C 107 54.509 59.049 -4.540 1
1 1061 . 7 1 1 A 107 107 GLU CB C 107 27.239 29.329 -2.090 1
1 1062 . 7 1 1 A 107 107 GLU N N 107 118.621 120.080 -1.459 1
1 1063 . 7 1 1 A 108 108 SER H H 108 7.923 7.827 0.096 1
1 1064 . 7 1 1 A 108 108 SER HA H 108 4.385 4.315 0.070 1
1 1067 . 7 1 1 A 108 108 SER CA C 108 56.442 61.010 -4.568 1
1 1068 . 7 1 1 A 108 108 SER CB C 108 60.953 63.199 -2.246 1
1 1069 . 7 1 1 A 108 108 SER N N 108 115.670 114.282 1.388 1
1 1070 . 7 1 1 A 109 109 ARG H H 109 8.068 7.986 0.082 1
1 1071 . 7 1 1 A 109 109 ARG HA H 109 4.307 3.869 0.438 1
1 1078 . 7 1 1 A 109 109 ARG CA C 109 53.732 59.610 -5.878 1
1 1079 . 7 1 1 A 109 109 ARG CB C 109 27.968 29.801 -1.833 1
1 1082 . 7 1 1 A 109 109 ARG N N 109 122.313 122.597 -0.284 1
1 1083 . 7 1 1 A 110 110 ASN H H 110 8.292 8.249 0.043 1
1 1084 . 7 1 1 A 110 110 ASN HA H 110 4.720 4.512 0.208 1
1 1087 . 7 1 1 A 110 110 ASN CA C 110 50.750 56.023 -5.273 1
1 1088 . 7 1 1 A 110 110 ASN CB C 110 36.197 38.285 -2.088 1
1 1089 . 7 1 1 A 110 110 ASN N N 110 119.304 118.493 0.811 1
1 1090 . 7 1 1 A 111 111 SER H H 111 8.244 8.073 0.171 1
1 1091 . 7 1 1 A 111 111 SER HA H 111 4.423 4.535 -0.112 1
1 1094 . 7 1 1 A 111 111 SER CA C 111 55.990 58.493 -2.503 1
1 1095 . 7 1 1 A 111 111 SER CB C 111 61.027 63.030 -2.003 1
1 1096 . 7 1 1 A 111 111 SER N N 111 116.119 113.993 2.126 1
1 1097 . 7 1 1 A 112 112 GLY H H 112 8.327 8.400 -0.073 1
1 1098 . 7 1 1 A 112 112 GLY HA2 H 112 3.944 3.889 0.055 1
1 1099 . 7 1 1 A 112 112 GLY HA3 H 112 3.912 3.977 -0.065 1
1 1100 . 7 1 1 A 112 112 GLY CA C 112 42.733 46.813 -4.080 1
1 1101 . 7 1 1 A 112 112 GLY N N 112 110.442 108.663 1.779 1
1 1102 . 7 1 1 A 113 113 GLY H H 113 8.097 8.449 -0.352 1
1 1103 . 7 1 1 A 113 113 GLY HA2 H 113 3.831 4.030 -0.199 1
1 1104 . 7 1 1 A 113 113 GLY HA3 H 113 3.785 4.038 -0.253 1
1 1105 . 7 1 1 A 113 113 GLY CA C 113 42.435 46.587 -4.152 1
1 1106 . 7 1 1 A 113 113 GLY N N 113 108.745 109.375 -0.630 1
1 2 . 8 1 1 A 3 3 HIS CB C 3 33.709 27.104 6.605 1
1 3 . 8 1 1 A 7 7 HIS H H 7 8.731 8.273 0.458 1
1 4 . 8 1 1 A 7 7 HIS HA H 7 4.564 4.597 -0.033 1
1 7 . 8 1 1 A 7 7 HIS CA C 7 53.649 56.626 -2.977 1
1 8 . 8 1 1 A 7 7 HIS CB C 7 26.268 30.737 -4.469 1
1 9 . 8 1 1 A 7 7 HIS N N 7 121.126 123.153 -2.027 1
1 10 . 8 1 1 A 8 8 GLY H H 8 8.540 7.271 1.269 1
1 11 . 8 1 1 A 8 8 GLY HA2 H 8 3.973 3.936 0.037 1
1 12 . 8 1 1 A 8 8 GLY HA3 H 8 3.811 3.959 -0.148 1
1 13 . 8 1 1 A 8 8 GLY CA C 8 42.618 44.856 -2.238 1
1 14 . 8 1 1 A 8 8 GLY N N 8 110.662 106.243 4.419 1
1 15 . 8 1 1 A 9 9 GLU H H 9 8.239 8.225 0.014 1
1 16 . 8 1 1 A 9 9 GLU HA H 9 4.568 4.299 0.269 1
1 18 . 8 1 1 A 9 9 GLU CA C 9 53.605 55.907 -2.302 1
1 19 . 8 1 1 A 9 9 GLU CB C 9 28.019 31.255 -3.236 1
1 20 . 8 1 1 A 9 9 GLU N N 9 121.669 118.115 3.554 1
1 21 . 8 1 1 A 10 10 PHE H H 10 8.785 7.241 1.544 1
1 22 . 8 1 1 A 10 10 PHE HA H 10 4.850 5.061 -0.211 1
1 25 . 8 1 1 A 10 10 PHE CA C 10 52.630 56.883 -4.253 1
1 26 . 8 1 1 A 10 10 PHE CB C 10 37.906 41.149 -3.243 1
1 27 . 8 1 1 A 10 10 PHE N N 10 118.401 118.395 0.006 1
1 28 . 8 1 1 A 11 11 GLN H H 11 8.552 8.813 -0.261 1
1 29 . 8 1 1 A 11 11 GLN HA H 11 5.425 5.241 0.184 1
1 34 . 8 1 1 A 11 11 GLN CA C 11 51.663 54.560 -2.897 1
1 35 . 8 1 1 A 11 11 GLN CB C 11 28.427 31.083 -2.656 1
1 37 . 8 1 1 A 11 11 GLN N N 11 117.519 122.066 -4.547 1
1 38 . 8 1 1 A 12 12 ILE H H 12 8.239 8.223 0.016 1
1 39 . 8 1 1 A 12 12 ILE HA H 12 4.103 4.782 -0.679 1
1 49 . 8 1 1 A 12 12 ILE CA C 12 57.134 60.226 -3.092 1
1 50 . 8 1 1 A 12 12 ILE CB C 12 39.491 39.802 -0.311 1
1 54 . 8 1 1 A 12 12 ILE N N 12 114.043 121.755 -7.712 1
1 55 . 8 1 1 A 13 13 PHE H H 13 8.538 8.761 -0.223 1
1 56 . 8 1 1 A 13 13 PHE HA H 13 5.620 5.327 0.293 1
1 59 . 8 1 1 A 13 13 PHE CA C 13 52.438 56.338 -3.900 1
1 60 . 8 1 1 A 13 13 PHE CB C 13 39.253 42.014 -2.761 1
1 61 . 8 1 1 A 13 13 PHE N N 13 117.015 119.929 -2.914 1
1 62 . 8 1 1 A 14 14 ALA H H 14 9.238 9.610 -0.372 1
1 63 . 8 1 1 A 14 14 ALA HA H 14 5.311 5.520 -0.209 1
1 67 . 8 1 1 A 14 14 ALA CA C 14 47.183 50.002 -2.819 1
1 68 . 8 1 1 A 14 14 ALA CB C 14 17.811 21.713 -3.902 1
1 69 . 8 1 1 A 14 14 ALA N N 14 123.503 126.171 -2.668 1
1 70 . 8 1 1 A 15 15 LYS H H 15 8.810 9.286 -0.476 1
1 71 . 8 1 1 A 15 15 LYS HA H 15 5.511 5.489 0.022 1
1 80 . 8 1 1 A 15 15 LYS CA C 15 51.718 54.561 -2.843 1
1 81 . 8 1 1 A 15 15 LYS CB C 15 33.635 35.067 -1.432 1
1 85 . 8 1 1 A 15 15 LYS N N 15 123.382 123.496 -0.114 1
1 86 . 8 1 1 A 16 16 THR H H 16 8.830 8.242 0.588 1
1 87 . 8 1 1 A 16 16 THR HA H 16 5.212 5.309 -0.097 1
1 92 . 8 1 1 A 16 16 THR CA C 16 57.614 59.458 -1.844 1
1 93 . 8 1 1 A 16 16 THR CB C 16 68.210 72.075 -3.865 1
1 95 . 8 1 1 A 16 16 THR N N 16 116.517 115.920 0.597 1
1 96 . 8 1 1 A 17 17 LEU H H 17 9.428 8.833 0.595 1
1 97 . 8 1 1 A 17 17 LEU HA H 17 4.286 3.995 0.291 1
1 107 . 8 1 1 A 17 17 LEU CA C 17 54.504 58.563 -4.059 1
1 108 . 8 1 1 A 17 17 LEU CB C 17 38.564 41.542 -2.978 1
1 112 . 8 1 1 A 17 17 LEU N N 17 121.786 123.764 -1.978 1
1 113 . 8 1 1 A 18 18 THR H H 18 7.546 7.875 -0.329 1
1 114 . 8 1 1 A 18 18 THR HA H 18 4.391 4.240 0.151 1
1 119 . 8 1 1 A 18 18 THR CA C 18 58.524 63.406 -4.882 1
1 120 . 8 1 1 A 18 18 THR CB C 18 66.166 70.433 -4.267 1
1 122 . 8 1 1 A 18 18 THR N N 18 105.598 108.411 -2.813 1
1 123 . 8 1 1 A 19 19 GLY H H 19 7.683 8.063 -0.380 1
1 124 . 8 1 1 A 19 19 GLY HA2 H 19 3.300 3.940 -0.640 1
1 125 . 8 1 1 A 19 19 GLY HA3 H 19 4.248 3.955 0.293 1
1 126 . 8 1 1 A 19 19 GLY CA C 19 42.947 46.043 -3.096 1
1 127 . 8 1 1 A 19 19 GLY N N 19 109.243 112.117 -2.874 1
1 128 . 8 1 1 A 20 20 LYS H H 20 7.375 8.244 -0.869 1
1 129 . 8 1 1 A 20 20 LYS HA H 20 4.331 4.716 -0.385 1
1 138 . 8 1 1 A 20 20 LYS CA C 20 53.829 55.045 -1.216 1
1 139 . 8 1 1 A 20 20 LYS CB C 20 30.385 34.664 -4.279 1
1 143 . 8 1 1 A 20 20 LYS N N 20 122.757 120.431 2.326 1
1 144 . 8 1 1 A 21 21 THR H H 21 8.637 8.951 -0.314 1
1 145 . 8 1 1 A 21 21 THR HA H 21 4.852 4.849 0.003 1
1 150 . 8 1 1 A 21 21 THR CA C 21 59.846 62.328 -2.482 1
1 151 . 8 1 1 A 21 21 THR CB C 21 67.140 70.007 -2.867 1
1 153 . 8 1 1 A 21 21 THR N N 21 121.524 123.708 -2.184 1
1 154 . 8 1 1 A 22 22 ILE H H 22 9.509 9.203 0.306 1
1 155 . 8 1 1 A 22 22 ILE HA H 22 4.349 4.895 -0.546 1
1 165 . 8 1 1 A 22 22 ILE CA C 22 57.634 60.066 -2.432 1
1 166 . 8 1 1 A 22 22 ILE CB C 22 38.334 41.615 -3.281 1
1 170 . 8 1 1 A 22 22 ILE N N 22 129.772 127.481 2.291 1
1 171 . 8 1 1 A 23 23 THR H H 23 8.838 8.727 0.111 1
1 172 . 8 1 1 A 23 23 THR HA H 23 4.653 4.616 0.037 1
1 177 . 8 1 1 A 23 23 THR CA C 23 60.194 61.633 -1.439 1
1 178 . 8 1 1 A 23 23 THR CB C 23 66.577 69.861 -3.284 1
1 180 . 8 1 1 A 23 23 THR N N 23 124.070 123.810 0.260 1
1 181 . 8 1 1 A 24 24 LEU H H 24 8.749 8.307 0.442 1
1 182 . 8 1 1 A 24 24 LEU HA H 24 4.619 4.874 -0.255 1
1 192 . 8 1 1 A 24 24 LEU CA C 24 50.257 53.378 -3.121 1
1 193 . 8 1 1 A 24 24 LEU CB C 24 42.932 45.811 -2.879 1
1 197 . 8 1 1 A 24 24 LEU N N 24 126.499 126.509 -0.010 1
1 198 . 8 1 1 A 25 25 GLU H H 25 7.990 8.718 -0.728 1
1 199 . 8 1 1 A 25 25 GLU HA H 25 4.591 4.538 0.053 1
1 204 . 8 1 1 A 25 25 GLU CA C 25 52.845 55.892 -3.047 1
1 205 . 8 1 1 A 25 25 GLU CB C 25 27.210 29.814 -2.604 1
1 207 . 8 1 1 A 25 25 GLU N N 25 121.644 124.617 -2.973 1
1 208 . 8 1 1 A 26 26 VAL H H 26 8.657 8.422 0.235 1
1 209 . 8 1 1 A 26 26 VAL HA H 26 4.403 5.080 -0.677 1
1 217 . 8 1 1 A 26 26 VAL CA C 26 56.020 59.256 -3.236 1
1 218 . 8 1 1 A 26 26 VAL CB C 26 33.631 35.035 -1.404 1
1 221 . 8 1 1 A 26 26 VAL N N 26 116.647 121.368 -4.721 1
1 222 . 8 1 1 A 27 27 GLU H H 27 7.970 8.675 -0.705 1
1 223 . 8 1 1 A 27 27 GLU HA H 27 4.447 4.614 -0.167 1
1 228 . 8 1 1 A 27 27 GLU CA C 27 51.386 54.752 -3.366 1
1 229 . 8 1 1 A 27 27 GLU CB C 27 30.905 31.651 -0.746 1
1 231 . 8 1 1 A 27 27 GLU N N 27 115.496 121.115 -5.619 1
1 232 . 8 1 1 A 28 28 SER H H 28 9.192 8.799 0.393 1
1 233 . 8 1 1 A 28 28 SER HA H 28 4.108 4.092 0.016 1
1 236 . 8 1 1 A 28 28 SER CA C 28 59.909 61.402 -1.493 1
1 237 . 8 1 1 A 28 28 SER CB C 28 60.399 62.706 -2.307 1
1 238 . 8 1 1 A 28 28 SER N N 28 117.720 118.823 -1.103 1
1 239 . 8 1 1 A 29 29 SER H H 29 7.371 7.721 -0.350 1
1 240 . 8 1 1 A 29 29 SER HA H 29 4.327 4.677 -0.350 1
1 243 . 8 1 1 A 29 29 SER CA C 29 54.805 58.011 -3.206 1
1 244 . 8 1 1 A 29 29 SER CB C 29 60.775 64.177 -3.402 1
1 245 . 8 1 1 A 29 29 SER N N 29 108.936 115.386 -6.450 1
1 246 . 8 1 1 A 30 30 ASP H H 30 7.852 7.702 0.150 1
1 247 . 8 1 1 A 30 30 ASP HA H 30 4.591 4.541 0.050 1
1 250 . 8 1 1 A 30 30 ASP CA C 30 53.040 54.722 -1.682 1
1 251 . 8 1 1 A 30 30 ASP CB C 30 37.942 41.404 -3.462 1
1 252 . 8 1 1 A 30 30 ASP N N 30 123.735 123.359 0.376 1
1 253 . 8 1 1 A 31 31 THR H H 31 7.852 8.410 -0.558 1
1 254 . 8 1 1 A 31 31 THR HA H 31 4.918 4.791 0.127 1
1 259 . 8 1 1 A 31 31 THR CA C 31 56.929 59.972 -3.043 1
1 260 . 8 1 1 A 31 31 THR CB C 31 68.674 71.626 -2.952 1
1 262 . 8 1 1 A 31 31 THR N N 31 109.181 112.908 -3.727 1
1 263 . 8 1 1 A 32 32 ILE H H 32 8.582 8.742 -0.160 1
1 264 . 8 1 1 A 32 32 ILE HA H 32 3.624 3.791 -0.167 1
1 274 . 8 1 1 A 32 32 ILE CA C 32 59.474 65.568 -6.094 1
1 275 . 8 1 1 A 32 32 ILE CB C 32 31.561 37.618 -6.057 1
1 279 . 8 1 1 A 32 32 ILE N N 32 121.833 122.823 -0.990 1
1 280 . 8 1 1 A 33 33 ASP H H 33 9.255 8.097 1.158 1
1 281 . 8 1 1 A 33 33 ASP HA H 33 4.201 4.307 -0.106 1
1 284 . 8 1 1 A 33 33 ASP CA C 33 54.679 57.879 -3.200 1
1 285 . 8 1 1 A 33 33 ASP CB C 33 37.700 41.581 -3.881 1
1 286 . 8 1 1 A 33 33 ASP N N 33 119.823 120.296 -0.473 1
1 287 . 8 1 1 A 34 34 ASN H H 34 8.026 7.692 0.334 1
1 288 . 8 1 1 A 34 34 ASN HA H 34 4.409 4.652 -0.243 1
1 291 . 8 1 1 A 34 34 ASN CA C 34 53.324 56.507 -3.183 1
1 292 . 8 1 1 A 34 34 ASN CB C 34 35.782 39.129 -3.347 1
1 293 . 8 1 1 A 34 34 ASN N N 34 119.540 117.854 1.686 1
1 294 . 8 1 1 A 35 35 VAL H H 35 8.167 8.184 -0.017 1
1 295 . 8 1 1 A 35 35 VAL HA H 35 3.249 3.469 -0.220 1
1 303 . 8 1 1 A 35 35 VAL CA C 35 65.308 67.334 -2.026 1
1 304 . 8 1 1 A 35 35 VAL CB C 35 27.965 31.387 -3.422 1
1 307 . 8 1 1 A 35 35 VAL N N 35 122.223 119.743 2.480 1
1 308 . 8 1 1 A 36 36 LYS H H 36 8.460 8.432 0.028 1
1 313 . 8 1 1 A 36 36 LYS CB C 36 30.753 32.236 -1.483 1
1 315 . 8 1 1 A 36 36 LYS N N 36 119.438 119.292 0.146 1
1 316 . 8 1 1 A 37 37 SER H H 37 8.196 8.578 -0.382 1
1 317 . 8 1 1 A 37 37 SER HA H 37 4.130 4.173 -0.043 1
1 320 . 8 1 1 A 37 37 SER CA C 37 58.528 61.330 -2.802 1
1 321 . 8 1 1 A 37 37 SER CB C 37 59.768 62.611 -2.843 1
1 322 . 8 1 1 A 37 37 SER N N 37 117.791 114.274 3.517 1
1 323 . 8 1 1 A 38 38 LYS H H 38 8.043 8.156 -0.113 1
1 324 . 8 1 1 A 38 38 LYS HA H 38 4.095 4.012 0.083 1
1 325 . 8 1 1 A 38 38 LYS CA C 38 57.377 59.625 -2.248 1
1 326 . 8 1 1 A 38 38 LYS N N 38 124.094 121.114 2.980 1
1 327 . 8 1 1 A 39 39 ILE H H 39 8.254 8.412 -0.158 1
1 328 . 8 1 1 A 39 39 ILE HA H 39 3.439 3.835 -0.396 1
1 338 . 8 1 1 A 39 39 ILE CA C 39 63.977 63.518 0.459 1
1 339 . 8 1 1 A 39 39 ILE CB C 39 33.935 37.422 -3.487 1
1 343 . 8 1 1 A 39 39 ILE N N 39 122.107 119.530 2.577 1
1 344 . 8 1 1 A 40 40 GLN H H 40 8.379 8.288 0.091 1
1 345 . 8 1 1 A 40 40 GLN HA H 40 3.746 4.204 -0.458 1
1 350 . 8 1 1 A 40 40 GLN CA C 40 57.472 58.128 -0.656 1
1 351 . 8 1 1 A 40 40 GLN CB C 40 25.072 28.119 -3.047 1
1 353 . 8 1 1 A 40 40 GLN N N 40 123.725 119.890 3.835 1
1 354 . 8 1 1 A 41 41 ASP H H 41 8.210 7.859 0.351 1
1 355 . 8 1 1 A 41 41 ASP HA H 41 4.247 4.377 -0.130 1
1 358 . 8 1 1 A 41 41 ASP CA C 41 54.646 56.533 -1.887 1
1 359 . 8 1 1 A 41 41 ASP CB C 41 38.136 40.753 -2.617 1
1 360 . 8 1 1 A 41 41 ASP N N 41 120.564 120.603 -0.039 1
1 361 . 8 1 1 A 42 42 LYS H H 42 7.381 8.004 -0.623 1
1 362 . 8 1 1 A 42 42 LYS HA H 42 4.246 4.312 -0.066 1
1 369 . 8 1 1 A 42 42 LYS CA C 42 55.579 57.873 -2.294 1
1 370 . 8 1 1 A 42 42 LYS CB C 42 31.406 33.562 -2.156 1
1 373 . 8 1 1 A 42 42 LYS N N 42 115.674 116.469 -0.795 1
1 374 . 8 1 1 A 43 43 GLU H H 43 8.537 8.726 -0.189 1
1 375 . 8 1 1 A 43 43 GLU HA H 43 4.522 4.532 -0.010 1
1 380 . 8 1 1 A 43 43 GLU CA C 43 52.772 55.669 -2.897 1
1 381 . 8 1 1 A 43 43 GLU CB C 43 30.535 31.088 -0.553 1
1 383 . 8 1 1 A 43 43 GLU N N 43 114.355 116.152 -1.797 1
1 384 . 8 1 1 A 44 44 GLY H H 44 8.611 8.305 0.306 1
1 385 . 8 1 1 A 44 44 GLY HA2 H 44 4.067 3.968 0.099 1
1 386 . 8 1 1 A 44 44 GLY HA3 H 44 3.819 3.969 -0.150 1
1 387 . 8 1 1 A 44 44 GLY CA C 44 43.205 45.386 -2.181 1
1 388 . 8 1 1 A 44 44 GLY N N 44 109.406 108.422 0.984 1
1 389 . 8 1 1 A 45 45 ILE H H 45 6.092 8.033 -1.941 1
1 390 . 8 1 1 A 45 45 ILE HA H 45 4.324 4.126 0.198 1
1 400 . 8 1 1 A 45 45 ILE CA C 45 55.211 60.157 -4.946 1
1 401 . 8 1 1 A 45 45 ILE CB C 45 37.903 38.258 -0.355 1
1 405 . 8 1 1 A 45 45 ILE N N 45 120.791 122.483 -1.692 1
1 406 . 8 1 1 A 46 46 PRO HA H 46 4.547 4.665 -0.118 1
1 413 . 8 1 1 A 46 46 PRO CA C 46 58.971 61.849 -2.878 1
1 414 . 8 1 1 A 46 46 PRO CB C 46 29.142 32.348 -3.206 1
1 417 . 8 1 1 A 47 47 PRO HA H 47 4.062 4.190 -0.128 1
1 424 . 8 1 1 A 47 47 PRO CA C 47 63.476 65.788 -2.312 1
1 425 . 8 1 1 A 47 47 PRO CB C 47 30.113 32.109 -1.996 1
1 428 . 8 1 1 A 48 48 ASP H H 48 8.418 8.554 -0.136 1
1 429 . 8 1 1 A 48 48 ASP HA H 48 4.346 4.378 -0.032 1
1 432 . 8 1 1 A 48 48 ASP CA C 48 52.838 56.875 -4.037 1
1 433 . 8 1 1 A 48 48 ASP CB C 48 36.926 41.644 -4.718 1
1 434 . 8 1 1 A 48 48 ASP N N 48 113.462 117.116 -3.654 1
1 435 . 8 1 1 A 49 49 GLN H H 49 7.822 7.996 -0.174 1
1 436 . 8 1 1 A 49 49 GLN HA H 49 4.283 4.266 0.017 1
1 439 . 8 1 1 A 49 49 GLN CA C 49 52.770 57.272 -4.502 1
1 441 . 8 1 1 A 49 49 GLN N N 49 117.377 117.778 -0.401 1
1 442 . 8 1 1 A 50 50 GLN H H 50 7.451 7.397 0.054 1
1 443 . 8 1 1 A 50 50 GLN HA H 50 4.260 4.613 -0.353 1
1 448 . 8 1 1 A 50 50 GLN CA C 50 53.725 55.850 -2.125 1
1 449 . 8 1 1 A 50 50 GLN CB C 50 29.142 29.834 -0.692 1
1 451 . 8 1 1 A 50 50 GLN N N 50 117.526 118.816 -1.290 1
1 452 . 8 1 1 A 51 51 ARG H H 51 8.534 8.756 -0.222 1
1 453 . 8 1 1 A 51 51 ARG HA H 51 4.486 5.047 -0.561 1
1 460 . 8 1 1 A 51 51 ARG CA C 51 52.492 54.448 -1.956 1
1 461 . 8 1 1 A 51 51 ARG CB C 51 29.096 33.755 -4.659 1
1 464 . 8 1 1 A 51 51 ARG N N 51 121.655 125.621 -3.966 1
1 465 . 8 1 1 A 52 52 LEU H H 52 8.683 8.995 -0.312 1
1 466 . 8 1 1 A 52 52 LEU HA H 52 5.255 5.029 0.226 1
1 476 . 8 1 1 A 52 52 LEU CA C 52 50.618 53.652 -3.034 1
1 477 . 8 1 1 A 52 52 LEU CB C 52 43.007 43.323 -0.316 1
1 481 . 8 1 1 A 52 52 LEU N N 52 122.929 126.502 -3.573 1
1 482 . 8 1 1 A 53 53 ILE H H 53 9.286 8.942 0.344 1
1 483 . 8 1 1 A 53 53 ILE HA H 53 5.096 5.060 0.036 1
1 492 . 8 1 1 A 53 53 ILE CA C 53 56.795 60.325 -3.530 1
1 496 . 8 1 1 A 53 53 ILE N N 53 124.718 125.161 -0.443 1
1 497 . 8 1 1 A 54 54 TRP H H 54 8.871 9.154 -0.283 1
1 499 . 8 1 1 A 54 54 TRP N N 54 127.412 128.144 -0.732 1
1 501 . 8 1 1 A 55 55 ALA H H 55 8.401 8.363 0.038 1
1 502 . 8 1 1 A 55 55 ALA HA H 55 3.183 3.393 -0.210 1
1 506 . 8 1 1 A 55 55 ALA CA C 55 49.712 52.612 -2.900 1
1 507 . 8 1 1 A 55 55 ALA CB C 55 13.252 16.857 -3.605 1
1 508 . 8 1 1 A 55 55 ALA N N 55 128.894 129.839 -0.945 1
1 509 . 8 1 1 A 56 56 GLY H H 56 8.248 8.397 -0.149 1
1 510 . 8 1 1 A 56 56 GLY HA2 H 56 3.968 3.733 0.235 1
1 511 . 8 1 1 A 56 56 GLY HA3 H 56 3.916 3.752 0.164 1
1 512 . 8 1 1 A 56 56 GLY CA C 56 43.142 45.586 -2.444 1
1 513 . 8 1 1 A 56 56 GLY N N 56 101.499 102.474 -0.975 1
1 514 . 8 1 1 A 57 57 LYS H H 57 8.028 7.305 0.723 1
1 515 . 8 1 1 A 57 57 LYS HA H 57 4.609 4.825 -0.216 1
1 522 . 8 1 1 A 57 57 LYS CA C 57 51.928 54.610 -2.682 1
1 523 . 8 1 1 A 57 57 LYS CB C 57 32.613 35.434 -2.821 1
1 526 . 8 1 1 A 57 57 LYS N N 57 118.995 120.640 -1.645 1
1 527 . 8 1 1 A 58 58 GLN H H 58 8.607 8.311 0.296 1
1 528 . 8 1 1 A 58 58 GLN HA H 58 4.617 4.615 0.002 1
1 533 . 8 1 1 A 58 58 GLN CA C 58 53.261 55.895 -2.634 1
1 534 . 8 1 1 A 58 58 GLN CB C 58 26.613 29.231 -2.618 1
1 536 . 8 1 1 A 58 58 GLN N N 58 119.825 124.711 -4.886 1
1 537 . 8 1 1 A 59 59 LEU H H 59 8.653 9.055 -0.402 1
1 538 . 8 1 1 A 59 59 LEU HA H 59 4.138 4.339 -0.201 1
1 548 . 8 1 1 A 59 59 LEU CA C 59 51.991 55.273 -3.282 1
1 549 . 8 1 1 A 59 59 LEU CB C 59 39.006 42.114 -3.108 1
1 553 . 8 1 1 A 59 59 LEU N N 59 125.484 125.156 0.328 1
1 554 . 8 1 1 A 60 60 GLU H H 60 8.461 8.702 -0.241 1
1 555 . 8 1 1 A 60 60 GLU HA H 60 4.371 4.460 -0.089 1
1 559 . 8 1 1 A 60 60 GLU CA C 60 53.436 56.570 -3.134 1
1 560 . 8 1 1 A 60 60 GLU CB C 60 29.057 30.320 -1.263 1
1 562 . 8 1 1 A 60 60 GLU N N 60 123.237 124.048 -0.811 1
1 563 . 8 1 1 A 61 61 ASP H H 61 8.076 9.048 -0.972 1
1 564 . 8 1 1 A 61 61 ASP HA H 61 4.265 4.302 -0.037 1
1 567 . 8 1 1 A 61 61 ASP CA C 61 54.398 56.967 -2.569 1
1 568 . 8 1 1 A 61 61 ASP CB C 61 38.340 40.522 -2.182 1
1 569 . 8 1 1 A 61 61 ASP N N 61 120.701 124.371 -3.670 1
1 570 . 8 1 1 A 62 62 GLY HA2 H 62 4.104 3.984 0.120 1
1 571 . 8 1 1 A 62 62 GLY HA3 H 62 3.832 3.987 -0.155 1
1 572 . 8 1 1 A 62 62 GLY CA C 62 42.576 45.308 -2.732 1
1 573 . 8 1 1 A 63 63 ARG H H 63 7.319 8.101 -0.782 1
1 574 . 8 1 1 A 63 63 ARG HA H 63 4.595 4.437 0.158 1
1 579 . 8 1 1 A 63 63 ARG CA C 63 51.971 56.114 -4.143 1
1 582 . 8 1 1 A 63 63 ARG N N 63 119.206 121.713 -2.507 1
1 583 . 8 1 1 A 64 64 THR H H 64 8.735 8.472 0.263 1
1 584 . 8 1 1 A 64 64 THR HA H 64 5.208 5.023 0.185 1
1 589 . 8 1 1 A 64 64 THR CA C 64 57.126 59.564 -2.438 1
1 590 . 8 1 1 A 64 64 THR CB C 64 69.885 71.688 -1.803 1
1 592 . 8 1 1 A 64 64 THR N N 64 108.713 115.786 -7.073 1
1 593 . 8 1 1 A 65 65 LEU H H 65 8.241 9.458 -1.217 1
1 594 . 8 1 1 A 65 65 LEU HA H 65 4.003 3.944 0.059 1
1 604 . 8 1 1 A 65 65 LEU CA C 65 56.409 57.786 -1.377 1
1 605 . 8 1 1 A 65 65 LEU CB C 65 37.179 41.377 -4.198 1
1 609 . 8 1 1 A 65 65 LEU N N 65 118.111 122.379 -4.268 1
1 610 . 8 1 1 A 66 66 SER H H 66 8.296 8.203 0.093 1
1 611 . 8 1 1 A 66 66 SER HA H 66 4.201 4.270 -0.069 1
1 614 . 8 1 1 A 66 66 SER CA C 66 58.454 60.037 -1.583 1
1 615 . 8 1 1 A 66 66 SER CB C 66 59.969 62.855 -2.886 1
1 616 . 8 1 1 A 66 66 SER N N 66 113.148 113.281 -0.133 1
1 617 . 8 1 1 A 67 67 ASP H H 67 7.984 8.250 -0.266 1
1 618 . 8 1 1 A 67 67 ASP HA H 67 4.187 4.274 -0.087 1
1 621 . 8 1 1 A 67 67 ASP CA C 67 54.744 57.302 -2.558 1
1 622 . 8 1 1 A 67 67 ASP CB C 67 37.794 41.730 -3.936 1
1 623 . 8 1 1 A 67 67 ASP N N 67 124.130 123.617 0.513 1
1 624 . 8 1 1 A 68 68 TYR H H 68 7.177 7.688 -0.511 1
1 625 . 8 1 1 A 68 68 TYR N N 68 115.334 120.129 -4.795 1
1 626 . 8 1 1 A 69 69 ASN H H 69 8.111 8.178 -0.067 1
1 627 . 8 1 1 A 69 69 ASN HA H 69 4.253 4.493 -0.240 1
1 630 . 8 1 1 A 69 69 ASN CA C 69 51.386 54.200 -2.814 1
1 631 . 8 1 1 A 69 69 ASN CB C 69 34.867 36.303 -1.436 1
1 632 . 8 1 1 A 69 69 ASN N N 69 116.867 117.499 -0.632 1
1 633 . 8 1 1 A 70 70 ILE H H 70 7.460 7.352 0.108 1
1 634 . 8 1 1 A 70 70 ILE HA H 70 3.210 4.013 -0.803 1
1 644 . 8 1 1 A 70 70 ILE CA C 70 60.157 62.215 -2.058 1
1 645 . 8 1 1 A 70 70 ILE CB C 70 34.754 37.540 -2.786 1
1 649 . 8 1 1 A 70 70 ILE N N 70 119.821 121.988 -2.167 1
1 650 . 8 1 1 A 71 71 GLN H H 71 7.368 8.941 -1.573 1
1 651 . 8 1 1 A 71 71 GLN HA H 71 4.099 4.617 -0.518 1
1 656 . 8 1 1 A 71 71 GLN CA C 71 50.906 54.768 -3.862 1
1 657 . 8 1 1 A 71 71 GLN CB C 71 28.793 29.969 -1.176 1
1 659 . 8 1 1 A 71 71 GLN N N 71 124.287 126.077 -1.790 1
1 660 . 8 1 1 A 72 72 ARG H H 72 7.583 8.703 -1.120 1
1 661 . 8 1 1 A 72 72 ARG HA H 72 3.907 4.442 -0.535 1
1 668 . 8 1 1 A 72 72 ARG CA C 72 54.527 58.167 -3.640 1
1 669 . 8 1 1 A 72 72 ARG CB C 72 27.470 31.389 -3.919 1
1 672 . 8 1 1 A 72 72 ARG N N 72 119.007 120.828 -1.821 1
1 673 . 8 1 1 A 73 73 GLU H H 73 9.262 8.357 0.905 1
1 674 . 8 1 1 A 73 73 GLU HA H 73 3.586 4.349 -0.763 1
1 679 . 8 1 1 A 73 73 GLU CA C 73 55.703 56.716 -1.013 1
1 680 . 8 1 1 A 73 73 GLU CB C 73 23.669 29.213 -5.544 1
1 682 . 8 1 1 A 73 73 GLU N N 73 115.180 116.874 -1.694 1
1 683 . 8 1 1 A 74 74 SER H H 74 7.551 7.951 -0.400 1
1 684 . 8 1 1 A 74 74 SER HA H 74 4.613 5.202 -0.589 1
1 687 . 8 1 1 A 74 74 SER CA C 74 58.305 57.148 1.157 1
1 688 . 8 1 1 A 74 74 SER CB C 74 62.156 65.420 -3.264 1
1 689 . 8 1 1 A 74 74 SER N N 74 115.104 116.592 -1.488 1
1 690 . 8 1 1 A 75 75 THR H H 75 8.785 8.936 -0.151 1
1 691 . 8 1 1 A 75 75 THR HA H 75 5.014 4.889 0.125 1
1 696 . 8 1 1 A 75 75 THR CA C 75 59.835 62.346 -2.511 1
1 697 . 8 1 1 A 75 75 THR CB C 75 67.258 69.150 -1.892 1
1 699 . 8 1 1 A 75 75 THR N N 75 118.401 121.101 -2.700 1
1 700 . 8 1 1 A 76 76 LEU H H 76 9.447 9.975 -0.528 1
1 701 . 8 1 1 A 76 76 LEU HA H 76 4.930 4.811 0.119 1
1 711 . 8 1 1 A 76 76 LEU CA C 76 51.107 54.248 -3.141 1
1 712 . 8 1 1 A 76 76 LEU CB C 76 40.841 41.303 -0.462 1
1 716 . 8 1 1 A 76 76 LEU N N 76 127.905 128.562 -0.657 1
1 717 . 8 1 1 A 77 77 HIS HA H 77 4.976 4.741 0.235 1
1 720 . 8 1 1 A 77 77 HIS CA C 77 53.776 57.099 -3.323 1
1 721 . 8 1 1 A 77 77 HIS CB C 77 28.438 29.684 -1.246 1
1 722 . 8 1 1 A 78 78 LEU H H 78 8.450 9.780 -1.330 1
1 723 . 8 1 1 A 78 78 LEU HA H 78 5.085 5.133 -0.048 1
1 733 . 8 1 1 A 78 78 LEU CA C 78 50.896 53.462 -2.566 1
1 734 . 8 1 1 A 78 78 LEU CB C 78 41.916 45.583 -3.667 1
1 738 . 8 1 1 A 78 78 LEU N N 78 126.178 125.921 0.257 1
1 739 . 8 1 1 A 79 79 VAL H H 79 9.093 9.321 -0.228 1
1 740 . 8 1 1 A 79 79 VAL HA H 79 4.053 4.923 -0.870 1
1 748 . 8 1 1 A 79 79 VAL CA C 79 59.054 60.065 -1.011 1
1 749 . 8 1 1 A 79 79 VAL CB C 79 32.115 34.661 -2.546 1
1 752 . 8 1 1 A 79 79 VAL N N 79 128.372 120.429 7.943 1
1 753 . 8 1 1 A 80 80 LEU H H 80 8.000 8.948 -0.948 1
1 754 . 8 1 1 A 80 80 LEU HA H 80 5.105 4.357 0.748 1
1 764 . 8 1 1 A 80 80 LEU CA C 80 50.556 54.771 -4.215 1
1 765 . 8 1 1 A 80 80 LEU CB C 80 39.597 42.190 -2.593 1
1 769 . 8 1 1 A 80 80 LEU N N 80 126.145 127.689 -1.544 1
1 770 . 8 1 1 A 81 81 ARG H H 81 8.470 8.757 -0.287 1
1 771 . 8 1 1 A 81 81 ARG HA H 81 4.197 4.962 -0.765 1
1 778 . 8 1 1 A 81 81 ARG CA C 81 53.133 55.501 -2.368 1
1 779 . 8 1 1 A 81 81 ARG CB C 81 28.413 31.868 -3.455 1
1 782 . 8 1 1 A 81 81 ARG N N 81 121.625 123.309 -1.684 1
1 783 . 8 1 1 A 82 82 LEU H H 82 8.454 8.714 -0.260 1
1 784 . 8 1 1 A 82 82 LEU HA H 82 4.339 4.985 -0.646 1
1 794 . 8 1 1 A 82 82 LEU CA C 82 52.081 53.883 -1.802 1
1 795 . 8 1 1 A 82 82 LEU CB C 82 39.810 44.829 -5.019 1
1 799 . 8 1 1 A 82 82 LEU N N 82 123.832 123.389 0.443 1
1 800 . 8 1 1 A 83 83 ARG H H 83 8.404 8.911 -0.507 1
1 801 . 8 1 1 A 83 83 ARG HA H 83 4.308 4.637 -0.329 1
1 808 . 8 1 1 A 83 83 ARG CA C 83 53.258 55.525 -2.267 1
1 809 . 8 1 1 A 83 83 ARG CB C 83 28.160 30.650 -2.490 1
1 812 . 8 1 1 A 83 83 ARG N N 83 121.447 126.844 -5.397 1
1 813 . 8 1 1 A 84 84 GLY H H 84 8.410 7.771 0.639 1
1 814 . 8 1 1 A 84 84 GLY HA2 H 84 3.929 4.093 -0.164 1
1 815 . 8 1 1 A 84 84 GLY HA3 H 84 3.929 4.093 -0.164 1
1 816 . 8 1 1 A 84 84 GLY CA C 84 42.751 45.411 -2.660 1
1 817 . 8 1 1 A 84 84 GLY N N 84 110.030 107.994 2.036 1
1 818 . 8 1 1 A 85 85 GLY H H 85 8.295 8.690 -0.395 1
1 819 . 8 1 1 A 85 85 GLY HA2 H 85 3.950 4.080 -0.130 1
1 820 . 8 1 1 A 85 85 GLY HA3 H 85 3.950 4.081 -0.131 1
1 821 . 8 1 1 A 85 85 GLY CA C 85 42.831 44.475 -1.644 1
1 822 . 8 1 1 A 85 85 GLY N N 85 108.838 109.838 -1.000 1
1 823 . 8 1 1 A 86 86 SER H H 86 8.292 8.930 -0.638 1
1 824 . 8 1 1 A 86 86 SER HA H 86 4.405 4.138 0.267 1
1 827 . 8 1 1 A 86 86 SER CA C 86 55.965 58.832 -2.867 1
1 828 . 8 1 1 A 86 86 SER CB C 86 61.232 61.430 -0.198 1
1 829 . 8 1 1 A 86 86 SER N N 86 116.028 114.893 1.135 1
1 830 . 8 1 1 A 87 87 MET H H 87 8.470 7.913 0.557 1
1 831 . 8 1 1 A 87 87 MET HA H 87 4.447 4.536 -0.089 1
1 836 . 8 1 1 A 87 87 MET CA C 87 53.281 57.916 -4.635 1
1 837 . 8 1 1 A 87 87 MET CB C 87 29.788 31.989 -2.201 1
1 839 . 8 1 1 A 87 87 MET N N 87 121.625 117.879 3.746 1
1 840 . 8 1 1 A 88 88 GLY H H 88 8.320 8.022 0.298 1
1 841 . 8 1 1 A 88 88 GLY HA2 H 88 3.919 3.744 0.175 1
1 842 . 8 1 1 A 88 88 GLY HA3 H 88 3.896 3.744 0.152 1
1 843 . 8 1 1 A 88 88 GLY CA C 88 43.060 46.584 -3.524 1
1 844 . 8 1 1 A 88 88 GLY N N 88 109.625 107.475 2.150 1
1 845 . 8 1 1 A 89 89 GLY H H 89 8.256 8.230 0.026 1
1 846 . 8 1 1 A 89 89 GLY HA2 H 89 3.940 4.204 -0.264 1
1 847 . 8 1 1 A 89 89 GLY HA3 H 89 3.910 4.205 -0.295 1
1 848 . 8 1 1 A 89 89 GLY CA C 89 42.678 45.873 -3.195 1
1 849 . 8 1 1 A 89 89 GLY N N 89 108.982 112.494 -3.512 1
1 850 . 8 1 1 A 90 90 ALA H H 90 8.203 8.713 -0.510 1
1 851 . 8 1 1 A 90 90 ALA HA H 90 4.255 4.133 0.122 1
1 855 . 8 1 1 A 90 90 ALA CA C 90 50.763 54.151 -3.388 1
1 856 . 8 1 1 A 90 90 ALA CB C 90 16.364 19.083 -2.719 1
1 857 . 8 1 1 A 90 90 ALA N N 90 124.065 122.863 1.202 1
1 858 . 8 1 1 A 91 91 ALA H H 91 8.273 7.840 0.433 1
1 859 . 8 1 1 A 91 91 ALA HA H 91 4.204 4.868 -0.664 1
1 863 . 8 1 1 A 91 91 ALA CA C 91 51.080 50.288 0.792 1
1 864 . 8 1 1 A 91 91 ALA CB C 91 16.036 22.568 -6.532 1
1 865 . 8 1 1 A 91 91 ALA N N 91 121.985 118.312 3.673 1
1 866 . 8 1 1 A 92 92 ASP H H 92 8.022 8.814 -0.792 1
1 867 . 8 1 1 A 92 92 ASP HA H 92 4.455 4.981 -0.526 1
1 870 . 8 1 1 A 92 92 ASP CA C 92 52.664 53.855 -1.191 1
1 871 . 8 1 1 A 92 92 ASP CB C 92 37.925 42.015 -4.090 1
1 872 . 8 1 1 A 92 92 ASP N N 92 118.621 118.636 -0.015 1
1 873 . 8 1 1 A 93 93 GLU H H 93 8.282 8.567 -0.285 1
1 874 . 8 1 1 A 93 93 GLU HA H 93 3.912 4.582 -0.670 1
1 879 . 8 1 1 A 93 93 GLU CA C 93 56.947 57.611 -0.664 1
1 880 . 8 1 1 A 93 93 GLU CB C 93 27.413 31.668 -4.255 1
1 882 . 8 1 1 A 93 93 GLU N N 93 122.247 121.872 0.375 1
1 883 . 8 1 1 A 94 94 GLU H H 94 8.194 8.193 0.001 1
1 884 . 8 1 1 A 94 94 GLU HA H 94 3.940 4.447 -0.507 1
1 889 . 8 1 1 A 94 94 GLU CA C 94 56.681 58.647 -1.966 1
1 890 . 8 1 1 A 94 94 GLU CB C 94 26.127 30.961 -4.834 1
1 892 . 8 1 1 A 94 94 GLU N N 94 118.024 118.081 -0.057 1
1 893 . 8 1 1 A 95 95 GLU H H 95 7.816 8.297 -0.481 1
1 894 . 8 1 1 A 95 95 GLU HA H 95 4.121 4.153 -0.032 1
1 898 . 8 1 1 A 95 95 GLU CA C 95 56.162 58.592 -2.430 1
1 899 . 8 1 1 A 95 95 GLU CB C 95 26.403 28.220 -1.817 1
1 901 . 8 1 1 A 95 95 GLU N N 95 120.028 118.451 1.577 1
1 902 . 8 1 1 A 96 96 LEU H H 96 7.637 7.835 -0.198 1
1 903 . 8 1 1 A 96 96 LEU HA H 96 3.988 4.112 -0.124 1
1 913 . 8 1 1 A 96 96 LEU CA C 96 55.303 57.186 -1.883 1
1 914 . 8 1 1 A 96 96 LEU CB C 96 39.038 41.681 -2.643 1
1 918 . 8 1 1 A 96 96 LEU N N 96 119.866 118.267 1.599 1
1 919 . 8 1 1 A 97 97 ILE H H 97 8.044 7.668 0.376 1
1 920 . 8 1 1 A 97 97 ILE HA H 97 3.478 3.988 -0.510 1
1 930 . 8 1 1 A 97 97 ILE CA C 97 62.054 63.636 -1.582 1
1 931 . 8 1 1 A 97 97 ILE CB C 97 34.541 38.067 -3.526 1
1 935 . 8 1 1 A 97 97 ILE N N 97 119.088 119.422 -0.334 1
1 936 . 8 1 1 A 98 98 ARG H H 98 7.991 8.095 -0.104 1
1 937 . 8 1 1 A 98 98 ARG HA H 98 3.793 4.081 -0.288 1
1 944 . 8 1 1 A 98 98 ARG CA C 98 57.509 58.933 -1.424 1
1 945 . 8 1 1 A 98 98 ARG CB C 98 27.191 30.174 -2.983 1
1 948 . 8 1 1 A 98 98 ARG N N 98 119.225 120.830 -1.605 1
1 949 . 8 1 1 A 99 99 LYS H H 99 8.101 7.650 0.451 1
1 950 . 8 1 1 A 99 99 LYS HA H 99 3.968 4.091 -0.123 1
1 959 . 8 1 1 A 99 99 LYS CA C 99 56.455 59.010 -2.555 1
1 960 . 8 1 1 A 99 99 LYS CB C 99 29.531 32.324 -2.793 1
1 964 . 8 1 1 A 99 99 LYS N N 99 119.464 118.294 1.170 1
1 965 . 8 1 1 A 100 100 ALA H H 100 8.167 8.261 -0.094 1
1 966 . 8 1 1 A 100 100 ALA HA H 100 3.789 4.055 -0.266 1
1 970 . 8 1 1 A 100 100 ALA CA C 100 52.451 55.044 -2.593 1
1 971 . 8 1 1 A 100 100 ALA CB C 100 16.259 18.468 -2.209 1
1 972 . 8 1 1 A 100 100 ALA N N 100 122.398 121.234 1.164 1
1 973 . 8 1 1 A 101 101 ILE H H 101 8.777 7.816 0.961 1
1 974 . 8 1 1 A 101 101 ILE HA H 101 3.191 3.803 -0.612 1
1 984 . 8 1 1 A 101 101 ILE CA C 101 62.910 64.820 -1.910 1
1 985 . 8 1 1 A 101 101 ILE CB C 101 34.544 38.178 -3.634 1
1 989 . 8 1 1 A 101 101 ILE N N 101 120.431 118.959 1.472 1
1 990 . 8 1 1 A 102 102 GLU H H 102 7.890 7.799 0.091 1
1 991 . 8 1 1 A 102 102 GLU HA H 102 3.848 4.109 -0.261 1
1 996 . 8 1 1 A 102 102 GLU CA C 102 57.079 58.473 -1.394 1
1 997 . 8 1 1 A 102 102 GLU CB C 102 26.769 29.599 -2.830 1
1 999 . 8 1 1 A 102 102 GLU N N 102 120.248 120.489 -0.241 1
1 1000 . 8 1 1 A 103 103 LEU H H 103 8.194 8.871 -0.677 1
1 1001 . 8 1 1 A 103 103 LEU HA H 103 3.912 4.238 -0.326 1
1 1011 . 8 1 1 A 103 103 LEU CA C 103 55.078 57.509 -2.431 1
1 1012 . 8 1 1 A 103 103 LEU CB C 103 38.963 42.374 -3.411 1
1 1016 . 8 1 1 A 103 103 LEU N N 103 120.341 121.476 -1.135 1
1 1017 . 8 1 1 A 104 104 SER H H 104 8.268 8.079 0.189 1
1 1018 . 8 1 1 A 104 104 SER HA H 104 4.120 4.474 -0.354 1
1 1021 . 8 1 1 A 104 104 SER CA C 104 58.301 59.109 -0.808 1
1 1022 . 8 1 1 A 104 104 SER CB C 104 60.193 63.724 -3.531 1
1 1023 . 8 1 1 A 104 104 SER N N 104 115.150 114.314 0.836 1
1 1024 . 8 1 1 A 105 105 LEU H H 105 7.501 7.255 0.246 1
1 1025 . 8 1 1 A 105 105 LEU HA H 105 4.041 4.049 -0.008 1
1 1035 . 8 1 1 A 105 105 LEU CA C 105 53.995 56.623 -2.628 1
1 1036 . 8 1 1 A 105 105 LEU CB C 105 39.597 42.082 -2.485 1
1 1040 . 8 1 1 A 105 105 LEU N N 105 124.223 119.494 4.729 1
1 1041 . 8 1 1 A 106 106 LYS H H 106 7.542 8.173 -0.631 1
1 1042 . 8 1 1 A 106 106 LYS HA H 106 4.090 3.989 0.101 1
1 1050 . 8 1 1 A 106 106 LYS CA C 106 55.495 58.904 -3.409 1
1 1051 . 8 1 1 A 106 106 LYS CB C 106 29.941 31.872 -1.931 1
1 1055 . 8 1 1 A 106 106 LYS N N 106 120.328 119.276 1.052 1
1 1056 . 8 1 1 A 107 107 GLU H H 107 7.884 8.141 -0.257 1
1 1057 . 8 1 1 A 107 107 GLU HA H 107 4.210 4.066 0.144 1
1 1060 . 8 1 1 A 107 107 GLU CA C 107 54.509 59.537 -5.028 1
1 1061 . 8 1 1 A 107 107 GLU CB C 107 27.239 29.214 -1.975 1
1 1062 . 8 1 1 A 107 107 GLU N N 107 118.621 120.230 -1.609 1
1 1063 . 8 1 1 A 108 108 SER H H 108 7.923 8.214 -0.291 1
1 1064 . 8 1 1 A 108 108 SER HA H 108 4.385 4.142 0.243 1
1 1067 . 8 1 1 A 108 108 SER CA C 108 56.442 61.550 -5.108 1
1 1068 . 8 1 1 A 108 108 SER CB C 108 60.953 63.018 -2.065 1
1 1069 . 8 1 1 A 108 108 SER N N 108 115.670 117.103 -1.433 1
1 1070 . 8 1 1 A 109 109 ARG H H 109 8.068 7.394 0.674 1
1 1071 . 8 1 1 A 109 109 ARG HA H 109 4.307 4.033 0.274 1
1 1078 . 8 1 1 A 109 109 ARG CA C 109 53.732 58.967 -5.235 1
1 1079 . 8 1 1 A 109 109 ARG CB C 109 27.968 29.707 -1.739 1
1 1082 . 8 1 1 A 109 109 ARG N N 109 122.313 121.504 0.809 1
1 1083 . 8 1 1 A 110 110 ASN H H 110 8.292 7.825 0.467 1
1 1084 . 8 1 1 A 110 110 ASN HA H 110 4.720 4.616 0.104 1
1 1087 . 8 1 1 A 110 110 ASN CA C 110 50.750 55.321 -4.571 1
1 1088 . 8 1 1 A 110 110 ASN CB C 110 36.197 38.235 -2.038 1
1 1089 . 8 1 1 A 110 110 ASN N N 110 119.304 116.910 2.394 1
1 1090 . 8 1 1 A 111 111 SER H H 111 8.244 7.835 0.409 1
1 1091 . 8 1 1 A 111 111 SER HA H 111 4.423 4.287 0.136 1
1 1094 . 8 1 1 A 111 111 SER CA C 111 55.990 61.319 -5.329 1
1 1095 . 8 1 1 A 111 111 SER CB C 111 61.027 62.808 -1.781 1
1 1096 . 8 1 1 A 111 111 SER N N 111 116.119 115.475 0.644 1
1 1097 . 8 1 1 A 112 112 GLY H H 112 8.327 8.376 -0.049 1
1 1098 . 8 1 1 A 112 112 GLY HA2 H 112 3.944 3.781 0.163 1
1 1099 . 8 1 1 A 112 112 GLY HA3 H 112 3.912 3.793 0.119 1
1 1100 . 8 1 1 A 112 112 GLY CA C 112 42.733 47.371 -4.638 1
1 1101 . 8 1 1 A 112 112 GLY N N 112 110.442 108.220 2.222 1
1 1102 . 8 1 1 A 113 113 GLY H H 113 8.097 8.196 -0.099 1
1 1103 . 8 1 1 A 113 113 GLY HA2 H 113 3.831 3.743 0.088 1
1 1104 . 8 1 1 A 113 113 GLY HA3 H 113 3.785 3.763 0.022 1
1 1105 . 8 1 1 A 113 113 GLY CA C 113 42.435 47.176 -4.741 1
1 1106 . 8 1 1 A 113 113 GLY N N 113 108.745 108.598 0.147 1
1 2 . 9 1 1 A 3 3 HIS CB C 3 33.709 27.979 5.730 1
1 3 . 9 1 1 A 7 7 HIS H H 7 8.731 8.545 0.186 1
1 4 . 9 1 1 A 7 7 HIS HA H 7 4.564 4.350 0.214 1
1 7 . 9 1 1 A 7 7 HIS CA C 7 53.649 57.917 -4.268 1
1 8 . 9 1 1 A 7 7 HIS CB C 7 26.268 30.039 -3.771 1
1 9 . 9 1 1 A 7 7 HIS N N 7 121.126 116.321 4.805 1
1 10 . 9 1 1 A 8 8 GLY H H 8 8.540 7.855 0.685 1
1 11 . 9 1 1 A 8 8 GLY HA2 H 8 3.973 3.612 0.361 1
1 12 . 9 1 1 A 8 8 GLY HA3 H 8 3.811 3.714 0.097 1
1 13 . 9 1 1 A 8 8 GLY CA C 8 42.618 46.566 -3.948 1
1 14 . 9 1 1 A 8 8 GLY N N 8 110.662 107.962 2.700 1
1 15 . 9 1 1 A 9 9 GLU H H 9 8.239 7.476 0.763 1
1 16 . 9 1 1 A 9 9 GLU HA H 9 4.568 4.188 0.380 1
1 18 . 9 1 1 A 9 9 GLU CA C 9 53.605 56.366 -2.761 1
1 19 . 9 1 1 A 9 9 GLU CB C 9 28.019 30.083 -2.064 1
1 20 . 9 1 1 A 9 9 GLU N N 9 121.669 119.899 1.770 1
1 21 . 9 1 1 A 10 10 PHE H H 10 8.785 7.083 1.702 1
1 22 . 9 1 1 A 10 10 PHE HA H 10 4.850 5.084 -0.234 1
1 25 . 9 1 1 A 10 10 PHE CA C 10 52.630 56.326 -3.696 1
1 26 . 9 1 1 A 10 10 PHE CB C 10 37.906 41.607 -3.701 1
1 27 . 9 1 1 A 10 10 PHE N N 10 118.401 117.606 0.795 1
1 28 . 9 1 1 A 11 11 GLN H H 11 8.552 9.280 -0.728 1
1 29 . 9 1 1 A 11 11 GLN HA H 11 5.425 5.152 0.273 1
1 34 . 9 1 1 A 11 11 GLN CA C 11 51.663 54.071 -2.408 1
1 35 . 9 1 1 A 11 11 GLN CB C 11 28.427 30.780 -2.353 1
1 37 . 9 1 1 A 11 11 GLN N N 11 117.519 120.091 -2.572 1
1 38 . 9 1 1 A 12 12 ILE H H 12 8.239 8.258 -0.019 1
1 39 . 9 1 1 A 12 12 ILE HA H 12 4.103 4.725 -0.622 1
1 49 . 9 1 1 A 12 12 ILE CA C 12 57.134 59.505 -2.371 1
1 50 . 9 1 1 A 12 12 ILE CB C 12 39.491 39.870 -0.379 1
1 54 . 9 1 1 A 12 12 ILE N N 12 114.043 121.137 -7.094 1
1 55 . 9 1 1 A 13 13 PHE H H 13 8.538 8.686 -0.148 1
1 56 . 9 1 1 A 13 13 PHE HA H 13 5.620 5.332 0.288 1
1 59 . 9 1 1 A 13 13 PHE CA C 13 52.438 56.410 -3.972 1
1 60 . 9 1 1 A 13 13 PHE CB C 13 39.253 42.658 -3.405 1
1 61 . 9 1 1 A 13 13 PHE N N 13 117.015 119.568 -2.553 1
1 62 . 9 1 1 A 14 14 ALA H H 14 9.238 9.667 -0.429 1
1 63 . 9 1 1 A 14 14 ALA HA H 14 5.311 5.688 -0.377 1
1 67 . 9 1 1 A 14 14 ALA CA C 14 47.183 50.103 -2.920 1
1 68 . 9 1 1 A 14 14 ALA CB C 14 17.811 23.102 -5.291 1
1 69 . 9 1 1 A 14 14 ALA N N 14 123.503 123.922 -0.419 1
1 70 . 9 1 1 A 15 15 LYS H H 15 8.810 9.043 -0.233 1
1 71 . 9 1 1 A 15 15 LYS HA H 15 5.511 5.314 0.197 1
1 80 . 9 1 1 A 15 15 LYS CA C 15 51.718 54.536 -2.818 1
1 81 . 9 1 1 A 15 15 LYS CB C 15 33.635 35.414 -1.779 1
1 85 . 9 1 1 A 15 15 LYS N N 15 123.382 122.166 1.216 1
1 86 . 9 1 1 A 16 16 THR H H 16 8.830 8.747 0.083 1
1 87 . 9 1 1 A 16 16 THR HA H 16 5.212 4.889 0.323 1
1 92 . 9 1 1 A 16 16 THR CA C 16 57.614 61.267 -3.653 1
1 93 . 9 1 1 A 16 16 THR CB C 16 68.210 70.773 -2.563 1
1 95 . 9 1 1 A 16 16 THR N N 16 116.517 116.905 -0.388 1
1 96 . 9 1 1 A 17 17 LEU H H 17 9.428 8.778 0.650 1
1 97 . 9 1 1 A 17 17 LEU HA H 17 4.286 4.202 0.084 1
1 107 . 9 1 1 A 17 17 LEU CA C 17 54.504 57.313 -2.809 1
1 108 . 9 1 1 A 17 17 LEU CB C 17 38.564 42.059 -3.495 1
1 112 . 9 1 1 A 17 17 LEU N N 17 121.786 123.635 -1.849 1
1 113 . 9 1 1 A 18 18 THR H H 18 7.546 7.745 -0.199 1
1 114 . 9 1 1 A 18 18 THR HA H 18 4.391 4.409 -0.018 1
1 119 . 9 1 1 A 18 18 THR CA C 18 58.524 62.608 -4.084 1
1 120 . 9 1 1 A 18 18 THR CB C 18 66.166 70.648 -4.482 1
1 122 . 9 1 1 A 18 18 THR N N 18 105.598 108.109 -2.511 1
1 123 . 9 1 1 A 19 19 GLY H H 19 7.683 8.261 -0.578 1
1 124 . 9 1 1 A 19 19 GLY HA2 H 19 3.300 3.988 -0.688 1
1 125 . 9 1 1 A 19 19 GLY HA3 H 19 4.248 4.005 0.243 1
1 126 . 9 1 1 A 19 19 GLY CA C 19 42.947 45.648 -2.701 1
1 127 . 9 1 1 A 19 19 GLY N N 19 109.243 112.112 -2.869 1
1 128 . 9 1 1 A 20 20 LYS H H 20 7.375 7.627 -0.252 1
1 129 . 9 1 1 A 20 20 LYS HA H 20 4.331 4.676 -0.345 1
1 138 . 9 1 1 A 20 20 LYS CA C 20 53.829 55.055 -1.226 1
1 139 . 9 1 1 A 20 20 LYS CB C 20 30.385 34.536 -4.151 1
1 143 . 9 1 1 A 20 20 LYS N N 20 122.757 120.793 1.964 1
1 144 . 9 1 1 A 21 21 THR H H 21 8.637 8.694 -0.057 1
1 145 . 9 1 1 A 21 21 THR HA H 21 4.852 5.002 -0.150 1
1 150 . 9 1 1 A 21 21 THR CA C 21 59.846 60.888 -1.042 1
1 151 . 9 1 1 A 21 21 THR CB C 21 67.140 70.056 -2.916 1
1 153 . 9 1 1 A 21 21 THR N N 21 121.524 116.447 5.077 1
1 154 . 9 1 1 A 22 22 ILE H H 22 9.509 9.255 0.254 1
1 155 . 9 1 1 A 22 22 ILE HA H 22 4.349 4.910 -0.561 1
1 165 . 9 1 1 A 22 22 ILE CA C 22 57.634 60.162 -2.528 1
1 166 . 9 1 1 A 22 22 ILE CB C 22 38.334 41.761 -3.427 1
1 170 . 9 1 1 A 22 22 ILE N N 22 129.772 126.266 3.506 1
1 171 . 9 1 1 A 23 23 THR H H 23 8.838 8.885 -0.047 1
1 172 . 9 1 1 A 23 23 THR HA H 23 4.653 4.774 -0.121 1
1 177 . 9 1 1 A 23 23 THR CA C 23 60.194 61.801 -1.607 1
1 178 . 9 1 1 A 23 23 THR CB C 23 66.577 70.108 -3.531 1
1 180 . 9 1 1 A 23 23 THR N N 23 124.070 124.076 -0.006 1
1 181 . 9 1 1 A 24 24 LEU H H 24 8.749 8.588 0.161 1
1 182 . 9 1 1 A 24 24 LEU HA H 24 4.619 5.056 -0.437 1
1 192 . 9 1 1 A 24 24 LEU CA C 24 50.257 52.756 -2.499 1
1 193 . 9 1 1 A 24 24 LEU CB C 24 42.932 45.610 -2.678 1
1 197 . 9 1 1 A 24 24 LEU N N 24 126.499 123.444 3.055 1
1 198 . 9 1 1 A 25 25 GLU H H 25 7.990 8.565 -0.575 1
1 199 . 9 1 1 A 25 25 GLU HA H 25 4.591 4.650 -0.059 1
1 204 . 9 1 1 A 25 25 GLU CA C 25 52.845 56.163 -3.318 1
1 205 . 9 1 1 A 25 25 GLU CB C 25 27.210 30.209 -2.999 1
1 207 . 9 1 1 A 25 25 GLU N N 25 121.644 120.740 0.904 1
1 208 . 9 1 1 A 26 26 VAL H H 26 8.657 8.304 0.353 1
1 209 . 9 1 1 A 26 26 VAL HA H 26 4.403 4.953 -0.550 1
1 217 . 9 1 1 A 26 26 VAL CA C 26 56.020 58.736 -2.716 1
1 218 . 9 1 1 A 26 26 VAL CB C 26 33.631 35.399 -1.768 1
1 221 . 9 1 1 A 26 26 VAL N N 26 116.647 117.622 -0.975 1
1 222 . 9 1 1 A 27 27 GLU H H 27 7.970 9.236 -1.266 1
1 223 . 9 1 1 A 27 27 GLU HA H 27 4.447 4.508 -0.061 1
1 228 . 9 1 1 A 27 27 GLU CA C 27 51.386 55.955 -4.569 1
1 229 . 9 1 1 A 27 27 GLU CB C 27 30.905 30.614 0.291 1
1 231 . 9 1 1 A 27 27 GLU N N 27 115.496 121.341 -5.845 1
1 232 . 9 1 1 A 28 28 SER H H 28 9.192 9.003 0.189 1
1 233 . 9 1 1 A 28 28 SER HA H 28 4.108 4.112 -0.004 1
1 236 . 9 1 1 A 28 28 SER CA C 28 59.909 60.867 -0.958 1
1 237 . 9 1 1 A 28 28 SER CB C 28 60.399 62.608 -2.209 1
1 238 . 9 1 1 A 28 28 SER N N 28 117.720 118.559 -0.839 1
1 239 . 9 1 1 A 29 29 SER H H 29 7.371 7.677 -0.306 1
1 240 . 9 1 1 A 29 29 SER HA H 29 4.327 4.491 -0.164 1
1 243 . 9 1 1 A 29 29 SER CA C 29 54.805 57.102 -2.297 1
1 244 . 9 1 1 A 29 29 SER CB C 29 60.775 64.344 -3.569 1
1 245 . 9 1 1 A 29 29 SER N N 29 108.936 110.227 -1.291 1
1 246 . 9 1 1 A 30 30 ASP H H 30 7.852 7.517 0.335 1
1 247 . 9 1 1 A 30 30 ASP HA H 30 4.591 4.532 0.059 1
1 250 . 9 1 1 A 30 30 ASP CA C 30 53.040 54.993 -1.953 1
1 251 . 9 1 1 A 30 30 ASP CB C 30 37.942 41.526 -3.584 1
1 252 . 9 1 1 A 30 30 ASP N N 30 123.735 123.873 -0.138 1
1 253 . 9 1 1 A 31 31 THR H H 31 7.852 8.270 -0.418 1
1 254 . 9 1 1 A 31 31 THR HA H 31 4.918 4.970 -0.052 1
1 259 . 9 1 1 A 31 31 THR CA C 31 56.929 59.622 -2.693 1
1 260 . 9 1 1 A 31 31 THR CB C 31 68.674 72.159 -3.485 1
1 262 . 9 1 1 A 31 31 THR N N 31 109.181 111.910 -2.729 1
1 263 . 9 1 1 A 32 32 ILE H H 32 8.582 8.837 -0.255 1
1 264 . 9 1 1 A 32 32 ILE HA H 32 3.624 3.814 -0.190 1
1 274 . 9 1 1 A 32 32 ILE CA C 32 59.474 65.382 -5.908 1
1 275 . 9 1 1 A 32 32 ILE CB C 32 31.561 37.713 -6.152 1
1 279 . 9 1 1 A 32 32 ILE N N 32 121.833 123.130 -1.297 1
1 280 . 9 1 1 A 33 33 ASP H H 33 9.255 8.456 0.799 1
1 281 . 9 1 1 A 33 33 ASP HA H 33 4.201 4.278 -0.077 1
1 284 . 9 1 1 A 33 33 ASP CA C 33 54.679 57.518 -2.839 1
1 285 . 9 1 1 A 33 33 ASP CB C 33 37.700 40.122 -2.422 1
1 286 . 9 1 1 A 33 33 ASP N N 33 119.823 120.864 -1.041 1
1 287 . 9 1 1 A 34 34 ASN H H 34 8.026 7.491 0.535 1
1 288 . 9 1 1 A 34 34 ASN HA H 34 4.409 4.494 -0.085 1
1 291 . 9 1 1 A 34 34 ASN CA C 34 53.324 56.328 -3.004 1
1 292 . 9 1 1 A 34 34 ASN CB C 34 35.782 38.195 -2.413 1
1 293 . 9 1 1 A 34 34 ASN N N 34 119.540 117.669 1.871 1
1 294 . 9 1 1 A 35 35 VAL H H 35 8.167 8.114 0.053 1
1 295 . 9 1 1 A 35 35 VAL HA H 35 3.249 3.453 -0.204 1
1 303 . 9 1 1 A 35 35 VAL CA C 35 65.308 67.180 -1.872 1
1 304 . 9 1 1 A 35 35 VAL CB C 35 27.965 31.509 -3.544 1
1 307 . 9 1 1 A 35 35 VAL N N 35 122.223 120.581 1.642 1
1 308 . 9 1 1 A 36 36 LYS H H 36 8.460 8.699 -0.239 1
1 313 . 9 1 1 A 36 36 LYS CB C 36 30.753 32.224 -1.471 1
1 315 . 9 1 1 A 36 36 LYS N N 36 119.438 119.297 0.141 1
1 316 . 9 1 1 A 37 37 SER H H 37 8.196 8.063 0.133 1
1 317 . 9 1 1 A 37 37 SER HA H 37 4.130 4.066 0.064 1
1 320 . 9 1 1 A 37 37 SER CA C 37 58.528 61.707 -3.179 1
1 321 . 9 1 1 A 37 37 SER CB C 37 59.768 62.994 -3.226 1
1 322 . 9 1 1 A 37 37 SER N N 37 117.791 113.965 3.826 1
1 323 . 9 1 1 A 38 38 LYS H H 38 8.043 8.185 -0.142 1
1 324 . 9 1 1 A 38 38 LYS HA H 38 4.095 4.036 0.059 1
1 325 . 9 1 1 A 38 38 LYS CA C 38 57.377 58.947 -1.570 1
1 326 . 9 1 1 A 38 38 LYS N N 38 124.094 120.618 3.476 1
1 327 . 9 1 1 A 39 39 ILE H H 39 8.254 8.097 0.157 1
1 328 . 9 1 1 A 39 39 ILE HA H 39 3.439 3.752 -0.313 1
1 338 . 9 1 1 A 39 39 ILE CA C 39 63.977 64.668 -0.691 1
1 339 . 9 1 1 A 39 39 ILE CB C 39 33.935 37.672 -3.737 1
1 343 . 9 1 1 A 39 39 ILE N N 39 122.107 120.358 1.749 1
1 344 . 9 1 1 A 40 40 GLN H H 40 8.379 8.315 0.064 1
1 345 . 9 1 1 A 40 40 GLN HA H 40 3.746 4.033 -0.287 1
1 350 . 9 1 1 A 40 40 GLN CA C 40 57.472 58.104 -0.632 1
1 351 . 9 1 1 A 40 40 GLN CB C 40 25.072 28.331 -3.259 1
1 353 . 9 1 1 A 40 40 GLN N N 40 123.725 120.650 3.075 1
1 354 . 9 1 1 A 41 41 ASP H H 41 8.210 8.000 0.210 1
1 355 . 9 1 1 A 41 41 ASP HA H 41 4.247 4.381 -0.134 1
1 358 . 9 1 1 A 41 41 ASP CA C 41 54.646 56.699 -2.053 1
1 359 . 9 1 1 A 41 41 ASP CB C 41 38.136 40.350 -2.214 1
1 360 . 9 1 1 A 41 41 ASP N N 41 120.564 120.765 -0.201 1
1 361 . 9 1 1 A 42 42 LYS H H 42 7.381 8.206 -0.825 1
1 362 . 9 1 1 A 42 42 LYS HA H 42 4.246 4.322 -0.076 1
1 369 . 9 1 1 A 42 42 LYS CA C 42 55.579 57.878 -2.299 1
1 370 . 9 1 1 A 42 42 LYS CB C 42 31.406 33.538 -2.132 1
1 373 . 9 1 1 A 42 42 LYS N N 42 115.674 117.891 -2.217 1
1 374 . 9 1 1 A 43 43 GLU H H 43 8.537 8.462 0.075 1
1 375 . 9 1 1 A 43 43 GLU HA H 43 4.522 4.565 -0.043 1
1 380 . 9 1 1 A 43 43 GLU CA C 43 52.772 55.551 -2.779 1
1 381 . 9 1 1 A 43 43 GLU CB C 43 30.535 31.169 -0.634 1
1 383 . 9 1 1 A 43 43 GLU N N 43 114.355 116.121 -1.766 1
1 384 . 9 1 1 A 44 44 GLY H H 44 8.611 8.473 0.138 1
1 385 . 9 1 1 A 44 44 GLY HA2 H 44 4.067 3.968 0.099 1
1 386 . 9 1 1 A 44 44 GLY HA3 H 44 3.819 3.969 -0.150 1
1 387 . 9 1 1 A 44 44 GLY CA C 44 43.205 45.425 -2.220 1
1 388 . 9 1 1 A 44 44 GLY N N 44 109.406 108.858 0.548 1
1 389 . 9 1 1 A 45 45 ILE H H 45 6.092 7.901 -1.809 1
1 390 . 9 1 1 A 45 45 ILE HA H 45 4.324 4.087 0.237 1
1 400 . 9 1 1 A 45 45 ILE CA C 45 55.211 60.211 -5.000 1
1 401 . 9 1 1 A 45 45 ILE CB C 45 37.903 38.058 -0.155 1
1 405 . 9 1 1 A 45 45 ILE N N 45 120.791 122.493 -1.702 1
1 406 . 9 1 1 A 46 46 PRO HA H 46 4.547 4.647 -0.100 1
1 413 . 9 1 1 A 46 46 PRO CA C 46 58.971 62.052 -3.081 1
1 414 . 9 1 1 A 46 46 PRO CB C 46 29.142 31.917 -2.775 1
1 417 . 9 1 1 A 47 47 PRO HA H 47 4.062 4.174 -0.112 1
1 424 . 9 1 1 A 47 47 PRO CA C 47 63.476 65.810 -2.334 1
1 425 . 9 1 1 A 47 47 PRO CB C 47 30.113 32.060 -1.947 1
1 428 . 9 1 1 A 48 48 ASP H H 48 8.418 8.384 0.034 1
1 429 . 9 1 1 A 48 48 ASP HA H 48 4.346 4.358 -0.012 1
1 432 . 9 1 1 A 48 48 ASP CA C 48 52.838 57.220 -4.382 1
1 433 . 9 1 1 A 48 48 ASP CB C 48 36.926 40.268 -3.342 1
1 434 . 9 1 1 A 48 48 ASP N N 48 113.462 117.627 -4.165 1
1 435 . 9 1 1 A 49 49 GLN H H 49 7.822 8.041 -0.219 1
1 436 . 9 1 1 A 49 49 GLN HA H 49 4.283 4.050 0.233 1
1 439 . 9 1 1 A 49 49 GLN CA C 49 52.770 57.973 -5.203 1
1 441 . 9 1 1 A 49 49 GLN N N 49 117.377 119.133 -1.756 1
1 442 . 9 1 1 A 50 50 GLN H H 50 7.451 7.495 -0.044 1
1 443 . 9 1 1 A 50 50 GLN HA H 50 4.260 4.697 -0.437 1
1 448 . 9 1 1 A 50 50 GLN CA C 50 53.725 55.047 -1.322 1
1 449 . 9 1 1 A 50 50 GLN CB C 50 29.142 30.920 -1.778 1
1 451 . 9 1 1 A 50 50 GLN N N 50 117.526 118.658 -1.132 1
1 452 . 9 1 1 A 51 51 ARG H H 51 8.534 8.404 0.130 1
1 453 . 9 1 1 A 51 51 ARG HA H 51 4.486 4.827 -0.341 1
1 460 . 9 1 1 A 51 51 ARG CA C 51 52.492 55.778 -3.286 1
1 461 . 9 1 1 A 51 51 ARG CB C 51 29.096 34.243 -5.147 1
1 464 . 9 1 1 A 51 51 ARG N N 51 121.655 121.071 0.584 1
1 465 . 9 1 1 A 52 52 LEU H H 52 8.683 8.918 -0.235 1
1 466 . 9 1 1 A 52 52 LEU HA H 52 5.255 5.084 0.171 1
1 476 . 9 1 1 A 52 52 LEU CA C 52 50.618 53.992 -3.374 1
1 477 . 9 1 1 A 52 52 LEU CB C 52 43.007 45.138 -2.131 1
1 481 . 9 1 1 A 52 52 LEU N N 52 122.929 126.002 -3.073 1
1 482 . 9 1 1 A 53 53 ILE H H 53 9.286 8.943 0.343 1
1 483 . 9 1 1 A 53 53 ILE HA H 53 5.096 5.035 0.061 1
1 492 . 9 1 1 A 53 53 ILE CA C 53 56.795 60.310 -3.515 1
1 496 . 9 1 1 A 53 53 ILE N N 53 124.718 125.411 -0.693 1
1 497 . 9 1 1 A 54 54 TRP H H 54 8.871 9.329 -0.458 1
1 499 . 9 1 1 A 54 54 TRP N N 54 127.412 128.101 -0.689 1
1 501 . 9 1 1 A 55 55 ALA H H 55 8.401 8.655 -0.254 1
1 502 . 9 1 1 A 55 55 ALA HA H 55 3.183 3.549 -0.366 1
1 506 . 9 1 1 A 55 55 ALA CA C 55 49.712 52.735 -3.023 1
1 507 . 9 1 1 A 55 55 ALA CB C 55 13.252 16.948 -3.696 1
1 508 . 9 1 1 A 55 55 ALA N N 55 128.894 130.328 -1.434 1
1 509 . 9 1 1 A 56 56 GLY H H 56 8.248 8.461 -0.213 1
1 510 . 9 1 1 A 56 56 GLY HA2 H 56 3.968 3.737 0.231 1
1 511 . 9 1 1 A 56 56 GLY HA3 H 56 3.916 3.752 0.164 1
1 512 . 9 1 1 A 56 56 GLY CA C 56 43.142 45.608 -2.466 1
1 513 . 9 1 1 A 56 56 GLY N N 56 101.499 102.533 -1.034 1
1 514 . 9 1 1 A 57 57 LYS H H 57 8.028 7.334 0.694 1
1 515 . 9 1 1 A 57 57 LYS HA H 57 4.609 4.830 -0.221 1
1 522 . 9 1 1 A 57 57 LYS CA C 57 51.928 54.681 -2.753 1
1 523 . 9 1 1 A 57 57 LYS CB C 57 32.613 35.491 -2.878 1
1 526 . 9 1 1 A 57 57 LYS N N 57 118.995 120.838 -1.843 1
1 527 . 9 1 1 A 58 58 GLN H H 58 8.607 8.414 0.193 1
1 528 . 9 1 1 A 58 58 GLN HA H 58 4.617 4.366 0.251 1
1 533 . 9 1 1 A 58 58 GLN CA C 58 53.261 56.142 -2.881 1
1 534 . 9 1 1 A 58 58 GLN CB C 58 26.613 28.854 -2.241 1
1 536 . 9 1 1 A 58 58 GLN N N 58 119.825 123.406 -3.581 1
1 537 . 9 1 1 A 59 59 LEU H H 59 8.653 9.141 -0.488 1
1 538 . 9 1 1 A 59 59 LEU HA H 59 4.138 4.294 -0.156 1
1 548 . 9 1 1 A 59 59 LEU CA C 59 51.991 55.589 -3.598 1
1 549 . 9 1 1 A 59 59 LEU CB C 59 39.006 41.736 -2.730 1
1 553 . 9 1 1 A 59 59 LEU N N 59 125.484 125.695 -0.211 1
1 554 . 9 1 1 A 60 60 GLU H H 60 8.461 8.910 -0.449 1
1 555 . 9 1 1 A 60 60 GLU HA H 60 4.371 4.341 0.030 1
1 559 . 9 1 1 A 60 60 GLU CA C 60 53.436 56.429 -2.993 1
1 560 . 9 1 1 A 60 60 GLU CB C 60 29.057 29.996 -0.939 1
1 562 . 9 1 1 A 60 60 GLU N N 60 123.237 124.206 -0.969 1
1 563 . 9 1 1 A 61 61 ASP H H 61 8.076 8.971 -0.895 1
1 564 . 9 1 1 A 61 61 ASP HA H 61 4.265 4.313 -0.048 1
1 567 . 9 1 1 A 61 61 ASP CA C 61 54.398 56.414 -2.016 1
1 568 . 9 1 1 A 61 61 ASP CB C 61 38.340 40.062 -1.722 1
1 569 . 9 1 1 A 61 61 ASP N N 61 120.701 123.669 -2.968 1
1 570 . 9 1 1 A 62 62 GLY HA2 H 62 4.104 3.962 0.142 1
1 571 . 9 1 1 A 62 62 GLY HA3 H 62 3.832 3.965 -0.133 1
1 572 . 9 1 1 A 62 62 GLY CA C 62 42.576 45.415 -2.839 1
1 573 . 9 1 1 A 63 63 ARG H H 63 7.319 8.402 -1.083 1
1 574 . 9 1 1 A 63 63 ARG HA H 63 4.595 4.581 0.014 1
1 579 . 9 1 1 A 63 63 ARG CA C 63 51.971 55.970 -3.999 1
1 582 . 9 1 1 A 63 63 ARG N N 63 119.206 122.174 -2.968 1
1 583 . 9 1 1 A 64 64 THR H H 64 8.735 8.668 0.067 1
1 584 . 9 1 1 A 64 64 THR HA H 64 5.208 5.016 0.192 1
1 589 . 9 1 1 A 64 64 THR CA C 64 57.126 59.546 -2.420 1
1 590 . 9 1 1 A 64 64 THR CB C 64 69.885 71.977 -2.092 1
1 592 . 9 1 1 A 64 64 THR N N 64 108.713 116.711 -7.998 1
1 593 . 9 1 1 A 65 65 LEU H H 65 8.241 9.042 -0.801 1
1 594 . 9 1 1 A 65 65 LEU HA H 65 4.003 3.897 0.106 1
1 604 . 9 1 1 A 65 65 LEU CA C 65 56.409 57.490 -1.081 1
1 605 . 9 1 1 A 65 65 LEU CB C 65 37.179 41.526 -4.347 1
1 609 . 9 1 1 A 65 65 LEU N N 65 118.111 122.358 -4.247 1
1 610 . 9 1 1 A 66 66 SER H H 66 8.296 8.251 0.045 1
1 611 . 9 1 1 A 66 66 SER HA H 66 4.201 4.227 -0.026 1
1 614 . 9 1 1 A 66 66 SER CA C 66 58.454 60.589 -2.135 1
1 615 . 9 1 1 A 66 66 SER CB C 66 59.969 62.799 -2.830 1
1 616 . 9 1 1 A 66 66 SER N N 66 113.148 113.276 -0.128 1
1 617 . 9 1 1 A 67 67 ASP H H 67 7.984 8.307 -0.323 1
1 618 . 9 1 1 A 67 67 ASP HA H 67 4.187 4.267 -0.080 1
1 621 . 9 1 1 A 67 67 ASP CA C 67 54.744 57.225 -2.481 1
1 622 . 9 1 1 A 67 67 ASP CB C 67 37.794 41.664 -3.870 1
1 623 . 9 1 1 A 67 67 ASP N N 67 124.130 123.706 0.424 1
1 624 . 9 1 1 A 68 68 TYR H H 68 7.177 7.684 -0.507 1
1 625 . 9 1 1 A 68 68 TYR N N 68 115.334 120.758 -5.424 1
1 626 . 9 1 1 A 69 69 ASN H H 69 8.111 8.017 0.094 1
1 627 . 9 1 1 A 69 69 ASN HA H 69 4.253 4.296 -0.043 1
1 630 . 9 1 1 A 69 69 ASN CA C 69 51.386 54.257 -2.871 1
1 631 . 9 1 1 A 69 69 ASN CB C 69 34.867 36.380 -1.513 1
1 632 . 9 1 1 A 69 69 ASN N N 69 116.867 116.757 0.110 1
1 633 . 9 1 1 A 70 70 ILE H H 70 7.460 7.790 -0.330 1
1 634 . 9 1 1 A 70 70 ILE HA H 70 3.210 4.028 -0.818 1
1 644 . 9 1 1 A 70 70 ILE CA C 70 60.157 62.069 -1.912 1
1 645 . 9 1 1 A 70 70 ILE CB C 70 34.754 37.695 -2.941 1
1 649 . 9 1 1 A 70 70 ILE N N 70 119.821 119.009 0.812 1
1 650 . 9 1 1 A 71 71 GLN H H 71 7.368 8.486 -1.118 1
1 651 . 9 1 1 A 71 71 GLN HA H 71 4.099 4.332 -0.233 1
1 656 . 9 1 1 A 71 71 GLN CA C 71 50.906 54.544 -3.638 1
1 657 . 9 1 1 A 71 71 GLN CB C 71 28.793 29.934 -1.141 1
1 659 . 9 1 1 A 71 71 GLN N N 71 124.287 127.732 -3.445 1
1 660 . 9 1 1 A 72 72 ARG H H 72 7.583 8.649 -1.066 1
1 661 . 9 1 1 A 72 72 ARG HA H 72 3.907 4.416 -0.509 1
1 668 . 9 1 1 A 72 72 ARG CA C 72 54.527 57.456 -2.929 1
1 669 . 9 1 1 A 72 72 ARG CB C 72 27.470 31.740 -4.270 1
1 672 . 9 1 1 A 72 72 ARG N N 72 119.007 120.773 -1.766 1
1 673 . 9 1 1 A 73 73 GLU H H 73 9.262 7.797 1.465 1
1 674 . 9 1 1 A 73 73 GLU HA H 73 3.586 4.696 -1.110 1
1 679 . 9 1 1 A 73 73 GLU CA C 73 55.703 56.164 -0.461 1
1 680 . 9 1 1 A 73 73 GLU CB C 73 23.669 28.015 -4.346 1
1 682 . 9 1 1 A 73 73 GLU N N 73 115.180 118.578 -3.398 1
1 683 . 9 1 1 A 74 74 SER H H 74 7.551 7.821 -0.270 1
1 684 . 9 1 1 A 74 74 SER HA H 74 4.613 5.309 -0.696 1
1 687 . 9 1 1 A 74 74 SER CA C 74 58.305 57.310 0.995 1
1 688 . 9 1 1 A 74 74 SER CB C 74 62.156 66.118 -3.962 1
1 689 . 9 1 1 A 74 74 SER N N 74 115.104 116.281 -1.177 1
1 690 . 9 1 1 A 75 75 THR H H 75 8.785 8.917 -0.132 1
1 691 . 9 1 1 A 75 75 THR HA H 75 5.014 4.838 0.176 1
1 696 . 9 1 1 A 75 75 THR CA C 75 59.835 62.116 -2.281 1
1 697 . 9 1 1 A 75 75 THR CB C 75 67.258 68.925 -1.667 1
1 699 . 9 1 1 A 75 75 THR N N 75 118.401 120.381 -1.980 1
1 700 . 9 1 1 A 76 76 LEU H H 76 9.447 9.869 -0.422 1
1 701 . 9 1 1 A 76 76 LEU HA H 76 4.930 4.776 0.154 1
1 711 . 9 1 1 A 76 76 LEU CA C 76 51.107 54.284 -3.177 1
1 712 . 9 1 1 A 76 76 LEU CB C 76 40.841 41.210 -0.369 1
1 716 . 9 1 1 A 76 76 LEU N N 76 127.905 128.073 -0.168 1
1 717 . 9 1 1 A 77 77 HIS HA H 77 4.976 4.641 0.335 1
1 720 . 9 1 1 A 77 77 HIS CA C 77 53.776 57.134 -3.358 1
1 721 . 9 1 1 A 77 77 HIS CB C 77 28.438 29.581 -1.143 1
1 722 . 9 1 1 A 78 78 LEU H H 78 8.450 9.507 -1.057 1
1 723 . 9 1 1 A 78 78 LEU HA H 78 5.085 5.033 0.052 1
1 733 . 9 1 1 A 78 78 LEU CA C 78 50.896 53.724 -2.828 1
1 734 . 9 1 1 A 78 78 LEU CB C 78 41.916 45.153 -3.237 1
1 738 . 9 1 1 A 78 78 LEU N N 78 126.178 126.448 -0.270 1
1 739 . 9 1 1 A 79 79 VAL H H 79 9.093 9.716 -0.623 1
1 740 . 9 1 1 A 79 79 VAL HA H 79 4.053 4.976 -0.923 1
1 748 . 9 1 1 A 79 79 VAL CA C 79 59.054 60.855 -1.801 1
1 749 . 9 1 1 A 79 79 VAL CB C 79 32.115 35.312 -3.197 1
1 752 . 9 1 1 A 79 79 VAL N N 79 128.372 125.843 2.529 1
1 753 . 9 1 1 A 80 80 LEU H H 80 8.000 8.976 -0.976 1
1 754 . 9 1 1 A 80 80 LEU HA H 80 5.105 4.909 0.196 1
1 764 . 9 1 1 A 80 80 LEU CA C 80 50.556 53.386 -2.830 1
1 765 . 9 1 1 A 80 80 LEU CB C 80 39.597 45.270 -5.673 1
1 769 . 9 1 1 A 80 80 LEU N N 80 126.145 126.795 -0.650 1
1 770 . 9 1 1 A 81 81 ARG H H 81 8.470 8.034 0.436 1
1 771 . 9 1 1 A 81 81 ARG HA H 81 4.197 4.582 -0.385 1
1 778 . 9 1 1 A 81 81 ARG CA C 81 53.133 55.402 -2.269 1
1 779 . 9 1 1 A 81 81 ARG CB C 81 28.413 31.163 -2.750 1
1 782 . 9 1 1 A 81 81 ARG N N 81 121.625 124.901 -3.276 1
1 783 . 9 1 1 A 82 82 LEU H H 82 8.454 8.548 -0.094 1
1 784 . 9 1 1 A 82 82 LEU HA H 82 4.339 4.920 -0.581 1
1 794 . 9 1 1 A 82 82 LEU CA C 82 52.081 53.385 -1.304 1
1 795 . 9 1 1 A 82 82 LEU CB C 82 39.810 45.100 -5.290 1
1 799 . 9 1 1 A 82 82 LEU N N 82 123.832 122.277 1.555 1
1 800 . 9 1 1 A 83 83 ARG H H 83 8.404 8.950 -0.546 1
1 801 . 9 1 1 A 83 83 ARG HA H 83 4.308 3.994 0.314 1
1 808 . 9 1 1 A 83 83 ARG CA C 83 53.258 59.762 -6.504 1
1 809 . 9 1 1 A 83 83 ARG CB C 83 28.160 30.066 -1.906 1
1 812 . 9 1 1 A 83 83 ARG N N 83 121.447 127.136 -5.689 1
1 813 . 9 1 1 A 84 84 GLY H H 84 8.410 8.186 0.224 1
1 814 . 9 1 1 A 84 84 GLY HA2 H 84 3.929 3.744 0.185 1
1 815 . 9 1 1 A 84 84 GLY HA3 H 84 3.929 3.744 0.185 1
1 816 . 9 1 1 A 84 84 GLY CA C 84 42.751 46.559 -3.808 1
1 817 . 9 1 1 A 84 84 GLY N N 84 110.030 106.966 3.064 1
1 818 . 9 1 1 A 85 85 GLY H H 85 8.295 7.617 0.678 1
1 819 . 9 1 1 A 85 85 GLY HA2 H 85 3.950 4.064 -0.114 1
1 820 . 9 1 1 A 85 85 GLY HA3 H 85 3.950 4.065 -0.115 1
1 821 . 9 1 1 A 85 85 GLY CA C 85 42.831 46.112 -3.281 1
1 822 . 9 1 1 A 85 85 GLY N N 85 108.838 106.154 2.684 1
1 823 . 9 1 1 A 86 86 SER H H 86 8.292 8.144 0.148 1
1 824 . 9 1 1 A 86 86 SER HA H 86 4.405 4.649 -0.244 1
1 827 . 9 1 1 A 86 86 SER CA C 86 55.965 56.735 -0.770 1
1 828 . 9 1 1 A 86 86 SER CB C 86 61.232 63.124 -1.892 1
1 829 . 9 1 1 A 86 86 SER N N 86 116.028 115.876 0.152 1
1 830 . 9 1 1 A 87 87 MET H H 87 8.470 8.676 -0.206 1
1 831 . 9 1 1 A 87 87 MET HA H 87 4.447 4.323 0.124 1
1 836 . 9 1 1 A 87 87 MET CA C 87 53.281 56.336 -3.055 1
1 837 . 9 1 1 A 87 87 MET CB C 87 29.788 33.087 -3.299 1
1 839 . 9 1 1 A 87 87 MET N N 87 121.625 126.261 -4.636 1
1 840 . 9 1 1 A 88 88 GLY H H 88 8.320 8.185 0.135 1
1 841 . 9 1 1 A 88 88 GLY HA2 H 88 3.919 3.959 -0.040 1
1 842 . 9 1 1 A 88 88 GLY HA3 H 88 3.896 3.960 -0.064 1
1 843 . 9 1 1 A 88 88 GLY CA C 88 43.060 45.434 -2.374 1
1 844 . 9 1 1 A 88 88 GLY N N 88 109.625 107.285 2.340 1
1 845 . 9 1 1 A 89 89 GLY H H 89 8.256 7.696 0.560 1
1 846 . 9 1 1 A 89 89 GLY HA2 H 89 3.940 4.057 -0.117 1
1 847 . 9 1 1 A 89 89 GLY HA3 H 89 3.910 4.058 -0.148 1
1 848 . 9 1 1 A 89 89 GLY CA C 89 42.678 44.379 -1.701 1
1 849 . 9 1 1 A 89 89 GLY N N 89 108.982 108.627 0.355 1
1 850 . 9 1 1 A 90 90 ALA H H 90 8.203 8.528 -0.325 1
1 851 . 9 1 1 A 90 90 ALA HA H 90 4.255 4.125 0.130 1
1 855 . 9 1 1 A 90 90 ALA CA C 90 50.763 54.587 -3.824 1
1 856 . 9 1 1 A 90 90 ALA CB C 90 16.364 18.876 -2.512 1
1 857 . 9 1 1 A 90 90 ALA N N 90 124.065 122.003 2.062 1
1 858 . 9 1 1 A 91 91 ALA H H 91 8.273 7.899 0.374 1
1 859 . 9 1 1 A 91 91 ALA HA H 91 4.204 4.653 -0.449 1
1 863 . 9 1 1 A 91 91 ALA CA C 91 51.080 50.545 0.535 1
1 864 . 9 1 1 A 91 91 ALA CB C 91 16.036 20.497 -4.461 1
1 865 . 9 1 1 A 91 91 ALA N N 91 121.985 119.422 2.563 1
1 866 . 9 1 1 A 92 92 ASP H H 92 8.022 9.028 -1.006 1
1 867 . 9 1 1 A 92 92 ASP HA H 92 4.455 5.038 -0.583 1
1 870 . 9 1 1 A 92 92 ASP CA C 92 52.664 53.443 -0.779 1
1 871 . 9 1 1 A 92 92 ASP CB C 92 37.925 42.272 -4.347 1
1 872 . 9 1 1 A 92 92 ASP N N 92 118.621 121.486 -2.865 1
1 873 . 9 1 1 A 93 93 GLU H H 93 8.282 8.436 -0.154 1
1 874 . 9 1 1 A 93 93 GLU HA H 93 3.912 4.665 -0.753 1
1 879 . 9 1 1 A 93 93 GLU CA C 93 56.947 55.141 1.806 1
1 880 . 9 1 1 A 93 93 GLU CB C 93 27.413 30.207 -2.794 1
1 882 . 9 1 1 A 93 93 GLU N N 93 122.247 121.912 0.335 1
1 883 . 9 1 1 A 94 94 GLU H H 94 8.194 8.360 -0.166 1
1 884 . 9 1 1 A 94 94 GLU HA H 94 3.940 4.340 -0.400 1
1 889 . 9 1 1 A 94 94 GLU CA C 94 56.681 57.858 -1.177 1
1 890 . 9 1 1 A 94 94 GLU CB C 94 26.127 31.451 -5.324 1
1 892 . 9 1 1 A 94 94 GLU N N 94 118.024 124.308 -6.284 1
1 893 . 9 1 1 A 95 95 GLU H H 95 7.816 8.587 -0.771 1
1 894 . 9 1 1 A 95 95 GLU HA H 95 4.121 4.124 -0.003 1
1 898 . 9 1 1 A 95 95 GLU CA C 95 56.162 58.521 -2.359 1
1 899 . 9 1 1 A 95 95 GLU CB C 95 26.403 28.705 -2.302 1
1 901 . 9 1 1 A 95 95 GLU N N 95 120.028 119.503 0.525 1
1 902 . 9 1 1 A 96 96 LEU H H 96 7.637 7.768 -0.131 1
1 903 . 9 1 1 A 96 96 LEU HA H 96 3.988 4.032 -0.044 1
1 913 . 9 1 1 A 96 96 LEU CA C 96 55.303 57.440 -2.137 1
1 914 . 9 1 1 A 96 96 LEU CB C 96 39.038 41.345 -2.307 1
1 918 . 9 1 1 A 96 96 LEU N N 96 119.866 118.510 1.356 1
1 919 . 9 1 1 A 97 97 ILE H H 97 8.044 7.507 0.537 1
1 920 . 9 1 1 A 97 97 ILE HA H 97 3.478 3.975 -0.497 1
1 930 . 9 1 1 A 97 97 ILE CA C 97 62.054 63.633 -1.579 1
1 931 . 9 1 1 A 97 97 ILE CB C 97 34.541 37.991 -3.450 1
1 935 . 9 1 1 A 97 97 ILE N N 97 119.088 119.565 -0.477 1
1 936 . 9 1 1 A 98 98 ARG H H 98 7.991 8.341 -0.350 1
1 937 . 9 1 1 A 98 98 ARG HA H 98 3.793 4.025 -0.232 1
1 944 . 9 1 1 A 98 98 ARG CA C 98 57.509 58.924 -1.415 1
1 945 . 9 1 1 A 98 98 ARG CB C 98 27.191 30.177 -2.986 1
1 948 . 9 1 1 A 98 98 ARG N N 98 119.225 120.593 -1.368 1
1 949 . 9 1 1 A 99 99 LYS H H 99 8.101 7.807 0.294 1
1 950 . 9 1 1 A 99 99 LYS HA H 99 3.968 4.061 -0.093 1
1 959 . 9 1 1 A 99 99 LYS CA C 99 56.455 59.080 -2.625 1
1 960 . 9 1 1 A 99 99 LYS CB C 99 29.531 32.025 -2.494 1
1 964 . 9 1 1 A 99 99 LYS N N 99 119.464 118.255 1.209 1
1 965 . 9 1 1 A 100 100 ALA H H 100 8.167 7.866 0.301 1
1 966 . 9 1 1 A 100 100 ALA HA H 100 3.789 4.078 -0.289 1
1 970 . 9 1 1 A 100 100 ALA CA C 100 52.451 54.296 -1.845 1
1 971 . 9 1 1 A 100 100 ALA CB C 100 16.259 18.204 -1.945 1
1 972 . 9 1 1 A 100 100 ALA N N 100 122.398 121.328 1.070 1
1 973 . 9 1 1 A 101 101 ILE H H 101 8.777 7.408 1.369 1
1 974 . 9 1 1 A 101 101 ILE HA H 101 3.191 3.799 -0.608 1
1 984 . 9 1 1 A 101 101 ILE CA C 101 62.910 64.153 -1.243 1
1 985 . 9 1 1 A 101 101 ILE CB C 101 34.544 37.496 -2.952 1
1 989 . 9 1 1 A 101 101 ILE N N 101 120.431 116.903 3.528 1
1 990 . 9 1 1 A 102 102 GLU H H 102 7.890 7.576 0.314 1
1 991 . 9 1 1 A 102 102 GLU HA H 102 3.848 4.210 -0.362 1
1 996 . 9 1 1 A 102 102 GLU CA C 102 57.079 57.675 -0.596 1
1 997 . 9 1 1 A 102 102 GLU CB C 102 26.769 29.641 -2.872 1
1 999 . 9 1 1 A 102 102 GLU N N 102 120.248 122.195 -1.947 1
1 1000 . 9 1 1 A 103 103 LEU H H 103 8.194 7.592 0.602 1
1 1001 . 9 1 1 A 103 103 LEU HA H 103 3.912 4.299 -0.387 1
1 1011 . 9 1 1 A 103 103 LEU CA C 103 55.078 56.193 -1.115 1
1 1012 . 9 1 1 A 103 103 LEU CB C 103 38.963 42.483 -3.520 1
1 1016 . 9 1 1 A 103 103 LEU N N 103 120.341 118.658 1.683 1
1 1017 . 9 1 1 A 104 104 SER H H 104 8.268 8.019 0.249 1
1 1018 . 9 1 1 A 104 104 SER HA H 104 4.120 4.369 -0.249 1
1 1021 . 9 1 1 A 104 104 SER CA C 104 58.301 58.512 -0.211 1
1 1022 . 9 1 1 A 104 104 SER CB C 104 60.193 63.449 -3.256 1
1 1023 . 9 1 1 A 104 104 SER N N 104 115.150 114.738 0.412 1
1 1024 . 9 1 1 A 105 105 LEU H H 105 7.501 7.535 -0.034 1
1 1025 . 9 1 1 A 105 105 LEU HA H 105 4.041 4.014 0.027 1
1 1035 . 9 1 1 A 105 105 LEU CA C 105 53.995 56.919 -2.924 1
1 1036 . 9 1 1 A 105 105 LEU CB C 105 39.597 41.694 -2.097 1
1 1040 . 9 1 1 A 105 105 LEU N N 105 124.223 119.738 4.485 1
1 1041 . 9 1 1 A 106 106 LYS H H 106 7.542 7.957 -0.415 1
1 1042 . 9 1 1 A 106 106 LYS HA H 106 4.090 3.949 0.141 1
1 1050 . 9 1 1 A 106 106 LYS CA C 106 55.495 58.945 -3.450 1
1 1051 . 9 1 1 A 106 106 LYS CB C 106 29.941 31.734 -1.793 1
1 1055 . 9 1 1 A 106 106 LYS N N 106 120.328 118.360 1.968 1
1 1056 . 9 1 1 A 107 107 GLU H H 107 7.884 8.316 -0.432 1
1 1057 . 9 1 1 A 107 107 GLU HA H 107 4.210 4.138 0.072 1
1 1060 . 9 1 1 A 107 107 GLU CA C 107 54.509 59.288 -4.779 1
1 1061 . 9 1 1 A 107 107 GLU CB C 107 27.239 29.273 -2.034 1
1 1062 . 9 1 1 A 107 107 GLU N N 107 118.621 120.145 -1.524 1
1 1063 . 9 1 1 A 108 108 SER H H 108 7.923 7.881 0.042 1
1 1064 . 9 1 1 A 108 108 SER HA H 108 4.385 4.224 0.161 1
1 1067 . 9 1 1 A 108 108 SER CA C 108 56.442 61.300 -4.858 1
1 1068 . 9 1 1 A 108 108 SER CB C 108 60.953 63.153 -2.200 1
1 1069 . 9 1 1 A 108 108 SER N N 108 115.670 116.986 -1.316 1
1 1070 . 9 1 1 A 109 109 ARG H H 109 8.068 7.321 0.747 1
1 1071 . 9 1 1 A 109 109 ARG HA H 109 4.307 4.012 0.295 1
1 1078 . 9 1 1 A 109 109 ARG CA C 109 53.732 58.408 -4.676 1
1 1079 . 9 1 1 A 109 109 ARG CB C 109 27.968 29.354 -1.386 1
1 1082 . 9 1 1 A 109 109 ARG N N 109 122.313 121.446 0.867 1
1 1083 . 9 1 1 A 110 110 ASN H H 110 8.292 7.925 0.367 1
1 1084 . 9 1 1 A 110 110 ASN HA H 110 4.720 4.397 0.323 1
1 1087 . 9 1 1 A 110 110 ASN CA C 110 50.750 56.112 -5.362 1
1 1088 . 9 1 1 A 110 110 ASN CB C 110 36.197 38.360 -2.163 1
1 1089 . 9 1 1 A 110 110 ASN N N 110 119.304 118.587 0.717 1
1 1090 . 9 1 1 A 111 111 SER H H 111 8.244 8.153 0.091 1
1 1091 . 9 1 1 A 111 111 SER HA H 111 4.423 3.929 0.494 1
1 1094 . 9 1 1 A 111 111 SER CA C 111 55.990 60.586 -4.596 1
1 1095 . 9 1 1 A 111 111 SER CB C 111 61.027 62.561 -1.534 1
1 1096 . 9 1 1 A 111 111 SER N N 111 116.119 114.113 2.006 1
1 1097 . 9 1 1 A 112 112 GLY H H 112 8.327 8.096 0.231 1
1 1098 . 9 1 1 A 112 112 GLY HA2 H 112 3.944 3.758 0.186 1
1 1099 . 9 1 1 A 112 112 GLY HA3 H 112 3.912 3.761 0.151 1
1 1100 . 9 1 1 A 112 112 GLY CA C 112 42.733 46.774 -4.041 1
1 1101 . 9 1 1 A 112 112 GLY N N 112 110.442 109.930 0.512 1
1 1102 . 9 1 1 A 113 113 GLY H H 113 8.097 7.869 0.228 1
1 1103 . 9 1 1 A 113 113 GLY HA2 H 113 3.831 3.710 0.121 1
1 1104 . 9 1 1 A 113 113 GLY HA3 H 113 3.785 3.823 -0.038 1
1 1105 . 9 1 1 A 113 113 GLY CA C 113 42.435 46.750 -4.315 1
1 1106 . 9 1 1 A 113 113 GLY N N 113 108.745 108.954 -0.209 1
1 2 . 10 1 1 A 3 3 HIS CB C 3 33.709 28.511 5.198 1
1 3 . 10 1 1 A 7 7 HIS H H 7 8.731 8.750 -0.019 1
1 4 . 10 1 1 A 7 7 HIS HA H 7 4.564 4.962 -0.398 1
1 7 . 10 1 1 A 7 7 HIS CA C 7 53.649 54.635 -0.986 1
1 8 . 10 1 1 A 7 7 HIS CB C 7 26.268 34.359 -8.091 1
1 9 . 10 1 1 A 7 7 HIS N N 7 121.126 116.102 5.024 1
1 10 . 10 1 1 A 8 8 GLY H H 8 8.540 8.731 -0.191 1
1 11 . 10 1 1 A 8 8 GLY HA2 H 8 3.973 4.000 -0.027 1
1 12 . 10 1 1 A 8 8 GLY HA3 H 8 3.811 4.010 -0.199 1
1 13 . 10 1 1 A 8 8 GLY CA C 8 42.618 46.879 -4.261 1
1 14 . 10 1 1 A 8 8 GLY N N 8 110.662 109.635 1.027 1
1 15 . 10 1 1 A 9 9 GLU H H 9 8.239 7.879 0.360 1
1 16 . 10 1 1 A 9 9 GLU HA H 9 4.568 4.863 -0.295 1
1 18 . 10 1 1 A 9 9 GLU CA C 9 53.605 56.497 -2.892 1
1 19 . 10 1 1 A 9 9 GLU CB C 9 28.019 32.124 -4.105 1
1 20 . 10 1 1 A 9 9 GLU N N 9 121.669 118.322 3.347 1
1 21 . 10 1 1 A 10 10 PHE H H 10 8.785 9.531 -0.746 1
1 22 . 10 1 1 A 10 10 PHE HA H 10 4.850 5.015 -0.165 1
1 25 . 10 1 1 A 10 10 PHE CA C 10 52.630 56.986 -4.356 1
1 26 . 10 1 1 A 10 10 PHE CB C 10 37.906 42.759 -4.853 1
1 27 . 10 1 1 A 10 10 PHE N N 10 118.401 125.505 -7.104 1
1 28 . 10 1 1 A 11 11 GLN H H 11 8.552 8.483 0.069 1
1 29 . 10 1 1 A 11 11 GLN HA H 11 5.425 4.324 1.101 1
1 34 . 10 1 1 A 11 11 GLN CA C 11 51.663 56.428 -4.765 1
1 35 . 10 1 1 A 11 11 GLN CB C 11 28.427 28.775 -0.348 1
1 37 . 10 1 1 A 11 11 GLN N N 11 117.519 121.149 -3.630 1
1 38 . 10 1 1 A 12 12 ILE H H 12 8.239 8.050 0.189 1
1 39 . 10 1 1 A 12 12 ILE HA H 12 4.103 4.643 -0.540 1
1 49 . 10 1 1 A 12 12 ILE CA C 12 57.134 59.474 -2.340 1
1 50 . 10 1 1 A 12 12 ILE CB C 12 39.491 39.313 0.178 1
1 54 . 10 1 1 A 12 12 ILE N N 12 114.043 121.037 -6.994 1
1 55 . 10 1 1 A 13 13 PHE H H 13 8.538 8.679 -0.141 1
1 56 . 10 1 1 A 13 13 PHE HA H 13 5.620 5.351 0.269 1
1 59 . 10 1 1 A 13 13 PHE CA C 13 52.438 56.484 -4.046 1
1 60 . 10 1 1 A 13 13 PHE CB C 13 39.253 43.106 -3.853 1
1 61 . 10 1 1 A 13 13 PHE N N 13 117.015 119.505 -2.490 1
1 62 . 10 1 1 A 14 14 ALA H H 14 9.238 9.342 -0.104 1
1 63 . 10 1 1 A 14 14 ALA HA H 14 5.311 5.493 -0.182 1
1 67 . 10 1 1 A 14 14 ALA CA C 14 47.183 50.068 -2.885 1
1 68 . 10 1 1 A 14 14 ALA CB C 14 17.811 23.263 -5.452 1
1 69 . 10 1 1 A 14 14 ALA N N 14 123.503 123.056 0.447 1
1 70 . 10 1 1 A 15 15 LYS H H 15 8.810 9.413 -0.603 1
1 71 . 10 1 1 A 15 15 LYS HA H 15 5.511 5.371 0.140 1
1 80 . 10 1 1 A 15 15 LYS CA C 15 51.718 54.668 -2.950 1
1 81 . 10 1 1 A 15 15 LYS CB C 15 33.635 35.775 -2.140 1
1 85 . 10 1 1 A 15 15 LYS N N 15 123.382 122.174 1.208 1
1 86 . 10 1 1 A 16 16 THR H H 16 8.830 8.626 0.204 1
1 87 . 10 1 1 A 16 16 THR HA H 16 5.212 4.804 0.408 1
1 92 . 10 1 1 A 16 16 THR CA C 16 57.614 60.810 -3.196 1
1 93 . 10 1 1 A 16 16 THR CB C 16 68.210 71.022 -2.812 1
1 95 . 10 1 1 A 16 16 THR N N 16 116.517 115.867 0.650 1
1 96 . 10 1 1 A 17 17 LEU H H 17 9.428 8.790 0.638 1
1 97 . 10 1 1 A 17 17 LEU HA H 17 4.286 4.128 0.158 1
1 107 . 10 1 1 A 17 17 LEU CA C 17 54.504 58.495 -3.991 1
1 108 . 10 1 1 A 17 17 LEU CB C 17 38.564 41.424 -2.860 1
1 112 . 10 1 1 A 17 17 LEU N N 17 121.786 123.270 -1.484 1
1 113 . 10 1 1 A 18 18 THR H H 18 7.546 7.877 -0.331 1
1 114 . 10 1 1 A 18 18 THR HA H 18 4.391 4.243 0.148 1
1 119 . 10 1 1 A 18 18 THR CA C 18 58.524 63.444 -4.920 1
1 120 . 10 1 1 A 18 18 THR CB C 18 66.166 70.396 -4.230 1
1 122 . 10 1 1 A 18 18 THR N N 18 105.598 108.737 -3.139 1
1 123 . 10 1 1 A 19 19 GLY H H 19 7.683 7.753 -0.070 1
1 124 . 10 1 1 A 19 19 GLY HA2 H 19 3.300 3.926 -0.626 1
1 125 . 10 1 1 A 19 19 GLY HA3 H 19 4.248 3.954 0.294 1
1 126 . 10 1 1 A 19 19 GLY CA C 19 42.947 45.745 -2.798 1
1 127 . 10 1 1 A 19 19 GLY N N 19 109.243 111.890 -2.647 1
1 128 . 10 1 1 A 20 20 LYS H H 20 7.375 7.874 -0.499 1
1 129 . 10 1 1 A 20 20 LYS HA H 20 4.331 4.623 -0.292 1
1 138 . 10 1 1 A 20 20 LYS CA C 20 53.829 55.150 -1.321 1
1 139 . 10 1 1 A 20 20 LYS CB C 20 30.385 33.886 -3.501 1
1 143 . 10 1 1 A 20 20 LYS N N 20 122.757 121.249 1.508 1
1 144 . 10 1 1 A 21 21 THR H H 21 8.637 8.605 0.032 1
1 145 . 10 1 1 A 21 21 THR HA H 21 4.852 5.024 -0.172 1
1 150 . 10 1 1 A 21 21 THR CA C 21 59.846 60.920 -1.074 1
1 151 . 10 1 1 A 21 21 THR CB C 21 67.140 69.899 -2.759 1
1 153 . 10 1 1 A 21 21 THR N N 21 121.524 117.149 4.375 1
1 154 . 10 1 1 A 22 22 ILE H H 22 9.509 9.139 0.370 1
1 155 . 10 1 1 A 22 22 ILE HA H 22 4.349 4.811 -0.462 1
1 165 . 10 1 1 A 22 22 ILE CA C 22 57.634 60.126 -2.492 1
1 166 . 10 1 1 A 22 22 ILE CB C 22 38.334 41.758 -3.424 1
1 170 . 10 1 1 A 22 22 ILE N N 22 129.772 125.347 4.425 1
1 171 . 10 1 1 A 23 23 THR H H 23 8.838 8.885 -0.047 1
1 172 . 10 1 1 A 23 23 THR HA H 23 4.653 4.677 -0.024 1
1 177 . 10 1 1 A 23 23 THR CA C 23 60.194 61.713 -1.519 1
1 178 . 10 1 1 A 23 23 THR CB C 23 66.577 69.846 -3.269 1
1 180 . 10 1 1 A 23 23 THR N N 23 124.070 123.844 0.226 1
1 181 . 10 1 1 A 24 24 LEU H H 24 8.749 8.534 0.215 1
1 182 . 10 1 1 A 24 24 LEU HA H 24 4.619 5.031 -0.412 1
1 192 . 10 1 1 A 24 24 LEU CA C 24 50.257 52.738 -2.481 1
1 193 . 10 1 1 A 24 24 LEU CB C 24 42.932 45.624 -2.692 1
1 197 . 10 1 1 A 24 24 LEU N N 24 126.499 123.427 3.072 1
1 198 . 10 1 1 A 25 25 GLU H H 25 7.990 8.638 -0.648 1
1 199 . 10 1 1 A 25 25 GLU HA H 25 4.591 4.541 0.050 1
1 204 . 10 1 1 A 25 25 GLU CA C 25 52.845 56.087 -3.242 1
1 205 . 10 1 1 A 25 25 GLU CB C 25 27.210 30.223 -3.013 1
1 207 . 10 1 1 A 25 25 GLU N N 25 121.644 122.856 -1.212 1
1 208 . 10 1 1 A 26 26 VAL H H 26 8.657 8.781 -0.124 1
1 209 . 10 1 1 A 26 26 VAL HA H 26 4.403 5.015 -0.612 1
1 217 . 10 1 1 A 26 26 VAL CA C 26 56.020 59.100 -3.080 1
1 218 . 10 1 1 A 26 26 VAL CB C 26 33.631 36.207 -2.576 1
1 221 . 10 1 1 A 26 26 VAL N N 26 116.647 120.199 -3.552 1
1 222 . 10 1 1 A 27 27 GLU H H 27 7.970 8.403 -0.433 1
1 223 . 10 1 1 A 27 27 GLU HA H 27 4.447 4.681 -0.234 1
1 228 . 10 1 1 A 27 27 GLU CA C 27 51.386 54.485 -3.099 1
1 229 . 10 1 1 A 27 27 GLU CB C 27 30.905 31.968 -1.063 1
1 231 . 10 1 1 A 27 27 GLU N N 27 115.496 120.976 -5.480 1
1 232 . 10 1 1 A 28 28 SER H H 28 9.192 8.886 0.306 1
1 233 . 10 1 1 A 28 28 SER HA H 28 4.108 4.341 -0.233 1
1 236 . 10 1 1 A 28 28 SER CA C 28 59.909 61.407 -1.498 1
1 237 . 10 1 1 A 28 28 SER CB C 28 60.399 62.896 -2.497 1
1 238 . 10 1 1 A 28 28 SER N N 28 117.720 119.146 -1.426 1
1 239 . 10 1 1 A 29 29 SER H H 29 7.371 7.740 -0.369 1
1 240 . 10 1 1 A 29 29 SER HA H 29 4.327 4.533 -0.206 1
1 243 . 10 1 1 A 29 29 SER CA C 29 54.805 57.200 -2.395 1
1 244 . 10 1 1 A 29 29 SER CB C 29 60.775 64.170 -3.395 1
1 245 . 10 1 1 A 29 29 SER N N 29 108.936 112.203 -3.267 1
1 246 . 10 1 1 A 30 30 ASP H H 30 7.852 7.706 0.146 1
1 247 . 10 1 1 A 30 30 ASP HA H 30 4.591 4.562 0.029 1
1 250 . 10 1 1 A 30 30 ASP CA C 30 53.040 54.643 -1.603 1
1 251 . 10 1 1 A 30 30 ASP CB C 30 37.942 41.499 -3.557 1
1 252 . 10 1 1 A 30 30 ASP N N 30 123.735 124.064 -0.329 1
1 253 . 10 1 1 A 31 31 THR H H 31 7.852 8.415 -0.563 1
1 254 . 10 1 1 A 31 31 THR HA H 31 4.918 4.921 -0.003 1
1 259 . 10 1 1 A 31 31 THR CA C 31 56.929 59.969 -3.040 1
1 260 . 10 1 1 A 31 31 THR CB C 31 68.674 71.547 -2.873 1
1 262 . 10 1 1 A 31 31 THR N N 31 109.181 112.752 -3.571 1
1 263 . 10 1 1 A 32 32 ILE H H 32 8.582 9.024 -0.442 1
1 264 . 10 1 1 A 32 32 ILE HA H 32 3.624 3.793 -0.169 1
1 274 . 10 1 1 A 32 32 ILE CA C 32 59.474 65.311 -5.837 1
1 275 . 10 1 1 A 32 32 ILE CB C 32 31.561 37.535 -5.974 1
1 279 . 10 1 1 A 32 32 ILE N N 32 121.833 122.701 -0.868 1
1 280 . 10 1 1 A 33 33 ASP H H 33 9.255 8.060 1.195 1
1 281 . 10 1 1 A 33 33 ASP HA H 33 4.201 4.280 -0.079 1
1 284 . 10 1 1 A 33 33 ASP CA C 33 54.679 57.473 -2.794 1
1 285 . 10 1 1 A 33 33 ASP CB C 33 37.700 39.966 -2.266 1
1 286 . 10 1 1 A 33 33 ASP N N 33 119.823 121.045 -1.222 1
1 287 . 10 1 1 A 34 34 ASN H H 34 8.026 7.629 0.397 1
1 288 . 10 1 1 A 34 34 ASN HA H 34 4.409 4.451 -0.042 1
1 291 . 10 1 1 A 34 34 ASN CA C 34 53.324 56.347 -3.023 1
1 292 . 10 1 1 A 34 34 ASN CB C 34 35.782 38.837 -3.055 1
1 293 . 10 1 1 A 34 34 ASN N N 34 119.540 117.697 1.843 1
1 294 . 10 1 1 A 35 35 VAL H H 35 8.167 8.080 0.087 1
1 295 . 10 1 1 A 35 35 VAL HA H 35 3.249 3.436 -0.187 1
1 303 . 10 1 1 A 35 35 VAL CA C 35 65.308 67.332 -2.024 1
1 304 . 10 1 1 A 35 35 VAL CB C 35 27.965 31.475 -3.510 1
1 307 . 10 1 1 A 35 35 VAL N N 35 122.223 120.158 2.065 1
1 308 . 10 1 1 A 36 36 LYS H H 36 8.460 8.506 -0.046 1
1 313 . 10 1 1 A 36 36 LYS CB C 36 30.753 32.307 -1.554 1
1 315 . 10 1 1 A 36 36 LYS N N 36 119.438 119.293 0.145 1
1 316 . 10 1 1 A 37 37 SER H H 37 8.196 8.640 -0.444 1
1 317 . 10 1 1 A 37 37 SER HA H 37 4.130 4.092 0.038 1
1 320 . 10 1 1 A 37 37 SER CA C 37 58.528 62.272 -3.744 1
1 321 . 10 1 1 A 37 37 SER CB C 37 59.768 62.711 -2.943 1
1 322 . 10 1 1 A 37 37 SER N N 37 117.791 116.491 1.300 1
1 323 . 10 1 1 A 38 38 LYS H H 38 8.043 8.363 -0.320 1
1 324 . 10 1 1 A 38 38 LYS HA H 38 4.095 4.003 0.092 1
1 325 . 10 1 1 A 38 38 LYS CA C 38 57.377 59.355 -1.978 1
1 326 . 10 1 1 A 38 38 LYS N N 38 124.094 121.454 2.640 1
1 327 . 10 1 1 A 39 39 ILE H H 39 8.254 8.134 0.120 1
1 328 . 10 1 1 A 39 39 ILE HA H 39 3.439 3.749 -0.310 1
1 338 . 10 1 1 A 39 39 ILE CA C 39 63.977 64.336 -0.359 1
1 339 . 10 1 1 A 39 39 ILE CB C 39 33.935 37.316 -3.381 1
1 343 . 10 1 1 A 39 39 ILE N N 39 122.107 119.167 2.940 1
1 344 . 10 1 1 A 40 40 GLN H H 40 8.379 8.313 0.066 1
1 345 . 10 1 1 A 40 40 GLN HA H 40 3.746 4.029 -0.283 1
1 350 . 10 1 1 A 40 40 GLN CA C 40 57.472 58.026 -0.554 1
1 351 . 10 1 1 A 40 40 GLN CB C 40 25.072 28.343 -3.271 1
1 353 . 10 1 1 A 40 40 GLN N N 40 123.725 119.980 3.745 1
1 354 . 10 1 1 A 41 41 ASP H H 41 8.210 7.893 0.317 1
1 355 . 10 1 1 A 41 41 ASP HA H 41 4.247 4.388 -0.141 1
1 358 . 10 1 1 A 41 41 ASP CA C 41 54.646 56.516 -1.870 1
1 359 . 10 1 1 A 41 41 ASP CB C 41 38.136 40.841 -2.705 1
1 360 . 10 1 1 A 41 41 ASP N N 41 120.564 120.373 0.191 1
1 361 . 10 1 1 A 42 42 LYS H H 42 7.381 7.938 -0.557 1
1 362 . 10 1 1 A 42 42 LYS HA H 42 4.246 4.294 -0.048 1
1 369 . 10 1 1 A 42 42 LYS CA C 42 55.579 57.848 -2.269 1
1 370 . 10 1 1 A 42 42 LYS CB C 42 31.406 33.470 -2.064 1
1 373 . 10 1 1 A 42 42 LYS N N 42 115.674 117.288 -1.614 1
1 374 . 10 1 1 A 43 43 GLU H H 43 8.537 8.821 -0.284 1
1 375 . 10 1 1 A 43 43 GLU HA H 43 4.522 4.555 -0.033 1
1 380 . 10 1 1 A 43 43 GLU CA C 43 52.772 55.562 -2.790 1
1 381 . 10 1 1 A 43 43 GLU CB C 43 30.535 30.963 -0.428 1
1 383 . 10 1 1 A 43 43 GLU N N 43 114.355 116.115 -1.760 1
1 384 . 10 1 1 A 44 44 GLY H H 44 8.611 8.414 0.197 1
1 385 . 10 1 1 A 44 44 GLY HA2 H 44 4.067 3.966 0.101 1
1 386 . 10 1 1 A 44 44 GLY HA3 H 44 3.819 3.967 -0.148 1
1 387 . 10 1 1 A 44 44 GLY CA C 44 43.205 45.308 -2.103 1
1 388 . 10 1 1 A 44 44 GLY N N 44 109.406 108.957 0.449 1
1 389 . 10 1 1 A 45 45 ILE H H 45 6.092 8.143 -2.051 1
1 390 . 10 1 1 A 45 45 ILE HA H 45 4.324 4.123 0.201 1
1 400 . 10 1 1 A 45 45 ILE CA C 45 55.211 60.213 -5.002 1
1 401 . 10 1 1 A 45 45 ILE CB C 45 37.903 38.417 -0.514 1
1 405 . 10 1 1 A 45 45 ILE N N 45 120.791 122.441 -1.650 1
1 406 . 10 1 1 A 46 46 PRO HA H 46 4.547 4.571 -0.024 1
1 413 . 10 1 1 A 46 46 PRO CA C 46 58.971 61.923 -2.952 1
1 414 . 10 1 1 A 46 46 PRO CB C 46 29.142 32.223 -3.081 1
1 417 . 10 1 1 A 47 47 PRO HA H 47 4.062 4.124 -0.062 1
1 424 . 10 1 1 A 47 47 PRO CA C 47 63.476 65.881 -2.405 1
1 425 . 10 1 1 A 47 47 PRO CB C 47 30.113 31.992 -1.879 1
1 428 . 10 1 1 A 48 48 ASP H H 48 8.418 8.752 -0.334 1
1 429 . 10 1 1 A 48 48 ASP HA H 48 4.346 4.391 -0.045 1
1 432 . 10 1 1 A 48 48 ASP CA C 48 52.838 56.823 -3.985 1
1 433 . 10 1 1 A 48 48 ASP CB C 48 36.926 39.840 -2.914 1
1 434 . 10 1 1 A 48 48 ASP N N 48 113.462 116.242 -2.780 1
1 435 . 10 1 1 A 49 49 GLN H H 49 7.822 7.765 0.057 1
1 436 . 10 1 1 A 49 49 GLN HA H 49 4.283 4.079 0.204 1
1 439 . 10 1 1 A 49 49 GLN CA C 49 52.770 57.798 -5.028 1
1 441 . 10 1 1 A 49 49 GLN N N 49 117.377 118.279 -0.902 1
1 442 . 10 1 1 A 50 50 GLN H H 50 7.451 7.427 0.024 1
1 443 . 10 1 1 A 50 50 GLN HA H 50 4.260 4.981 -0.721 1
1 448 . 10 1 1 A 50 50 GLN CA C 50 53.725 53.886 -0.161 1
1 449 . 10 1 1 A 50 50 GLN CB C 50 29.142 31.579 -2.437 1
1 451 . 10 1 1 A 50 50 GLN N N 50 117.526 115.526 2.000 1
1 452 . 10 1 1 A 51 51 ARG H H 51 8.534 8.813 -0.279 1
1 453 . 10 1 1 A 51 51 ARG HA H 51 4.486 5.090 -0.604 1
1 460 . 10 1 1 A 51 51 ARG CA C 51 52.492 54.373 -1.881 1
1 461 . 10 1 1 A 51 51 ARG CB C 51 29.096 34.170 -5.074 1
1 464 . 10 1 1 A 51 51 ARG N N 51 121.655 119.076 2.579 1
1 465 . 10 1 1 A 52 52 LEU H H 52 8.683 8.736 -0.053 1
1 466 . 10 1 1 A 52 52 LEU HA H 52 5.255 5.080 0.175 1
1 476 . 10 1 1 A 52 52 LEU CA C 52 50.618 53.745 -3.127 1
1 477 . 10 1 1 A 52 52 LEU CB C 52 43.007 43.245 -0.238 1
1 481 . 10 1 1 A 52 52 LEU N N 52 122.929 121.314 1.615 1
1 482 . 10 1 1 A 53 53 ILE H H 53 9.286 8.988 0.298 1
1 483 . 10 1 1 A 53 53 ILE HA H 53 5.096 4.902 0.194 1
1 492 . 10 1 1 A 53 53 ILE CA C 53 56.795 60.543 -3.748 1
1 496 . 10 1 1 A 53 53 ILE N N 53 124.718 125.492 -0.774 1
1 497 . 10 1 1 A 54 54 TRP H H 54 8.871 8.819 0.052 1
1 499 . 10 1 1 A 54 54 TRP N N 54 127.412 128.269 -0.857 1
1 501 . 10 1 1 A 55 55 ALA H H 55 8.401 8.612 -0.211 1
1 502 . 10 1 1 A 55 55 ALA HA H 55 3.183 3.274 -0.091 1
1 506 . 10 1 1 A 55 55 ALA CA C 55 49.712 52.525 -2.813 1
1 507 . 10 1 1 A 55 55 ALA CB C 55 13.252 16.858 -3.606 1
1 508 . 10 1 1 A 55 55 ALA N N 55 128.894 129.942 -1.048 1
1 509 . 10 1 1 A 56 56 GLY H H 56 8.248 8.402 -0.154 1
1 510 . 10 1 1 A 56 56 GLY HA2 H 56 3.968 3.713 0.255 1
1 511 . 10 1 1 A 56 56 GLY HA3 H 56 3.916 3.729 0.187 1
1 512 . 10 1 1 A 56 56 GLY CA C 56 43.142 45.521 -2.379 1
1 513 . 10 1 1 A 56 56 GLY N N 56 101.499 102.456 -0.957 1
1 514 . 10 1 1 A 57 57 LYS H H 57 8.028 7.295 0.733 1
1 515 . 10 1 1 A 57 57 LYS HA H 57 4.609 4.654 -0.045 1
1 522 . 10 1 1 A 57 57 LYS CA C 57 51.928 54.694 -2.766 1
1 523 . 10 1 1 A 57 57 LYS CB C 57 32.613 35.083 -2.470 1
1 526 . 10 1 1 A 57 57 LYS N N 57 118.995 121.139 -2.144 1
1 527 . 10 1 1 A 58 58 GLN H H 58 8.607 8.459 0.148 1
1 528 . 10 1 1 A 58 58 GLN HA H 58 4.617 4.525 0.092 1
1 533 . 10 1 1 A 58 58 GLN CA C 58 53.261 55.844 -2.583 1
1 534 . 10 1 1 A 58 58 GLN CB C 58 26.613 29.210 -2.597 1
1 536 . 10 1 1 A 58 58 GLN N N 58 119.825 126.098 -6.273 1
1 537 . 10 1 1 A 59 59 LEU H H 59 8.653 9.008 -0.355 1
1 538 . 10 1 1 A 59 59 LEU HA H 59 4.138 4.360 -0.222 1
1 548 . 10 1 1 A 59 59 LEU CA C 59 51.991 54.654 -2.663 1
1 549 . 10 1 1 A 59 59 LEU CB C 59 39.006 42.459 -3.453 1
1 553 . 10 1 1 A 59 59 LEU N N 59 125.484 124.610 0.874 1
1 554 . 10 1 1 A 60 60 GLU H H 60 8.461 8.560 -0.099 1
1 555 . 10 1 1 A 60 60 GLU HA H 60 4.371 4.739 -0.368 1
1 559 . 10 1 1 A 60 60 GLU CA C 60 53.436 55.747 -2.311 1
1 560 . 10 1 1 A 60 60 GLU CB C 60 29.057 30.939 -1.882 1
1 562 . 10 1 1 A 60 60 GLU N N 60 123.237 121.366 1.871 1
1 563 . 10 1 1 A 61 61 ASP H H 61 8.076 8.879 -0.803 1
1 564 . 10 1 1 A 61 61 ASP HA H 61 4.265 4.380 -0.115 1
1 567 . 10 1 1 A 61 61 ASP CA C 61 54.398 56.099 -1.701 1
1 568 . 10 1 1 A 61 61 ASP CB C 61 38.340 39.867 -1.527 1
1 569 . 10 1 1 A 61 61 ASP N N 61 120.701 122.979 -2.278 1
1 570 . 10 1 1 A 62 62 GLY HA2 H 62 4.104 3.975 0.129 1
1 571 . 10 1 1 A 62 62 GLY HA3 H 62 3.832 3.975 -0.143 1
1 572 . 10 1 1 A 62 62 GLY CA C 62 42.576 45.317 -2.741 1
1 573 . 10 1 1 A 63 63 ARG H H 63 7.319 8.257 -0.938 1
1 574 . 10 1 1 A 63 63 ARG HA H 63 4.595 4.375 0.220 1
1 579 . 10 1 1 A 63 63 ARG CA C 63 51.971 56.486 -4.515 1
1 582 . 10 1 1 A 63 63 ARG N N 63 119.206 120.775 -1.569 1
1 583 . 10 1 1 A 64 64 THR H H 64 8.735 8.459 0.276 1
1 584 . 10 1 1 A 64 64 THR HA H 64 5.208 5.050 0.158 1
1 589 . 10 1 1 A 64 64 THR CA C 64 57.126 59.572 -2.446 1
1 590 . 10 1 1 A 64 64 THR CB C 64 69.885 71.830 -1.945 1
1 592 . 10 1 1 A 64 64 THR N N 64 108.713 112.890 -4.177 1
1 593 . 10 1 1 A 65 65 LEU H H 65 8.241 9.541 -1.300 1
1 594 . 10 1 1 A 65 65 LEU HA H 65 4.003 3.992 0.011 1
1 604 . 10 1 1 A 65 65 LEU CA C 65 56.409 57.858 -1.449 1
1 605 . 10 1 1 A 65 65 LEU CB C 65 37.179 41.507 -4.328 1
1 609 . 10 1 1 A 65 65 LEU N N 65 118.111 122.942 -4.831 1
1 610 . 10 1 1 A 66 66 SER H H 66 8.296 8.069 0.227 1
1 611 . 10 1 1 A 66 66 SER HA H 66 4.201 4.331 -0.130 1
1 614 . 10 1 1 A 66 66 SER CA C 66 58.454 60.919 -2.465 1
1 615 . 10 1 1 A 66 66 SER CB C 66 59.969 62.871 -2.902 1
1 616 . 10 1 1 A 66 66 SER N N 66 113.148 114.159 -1.011 1
1 617 . 10 1 1 A 67 67 ASP H H 67 7.984 8.435 -0.451 1
1 618 . 10 1 1 A 67 67 ASP HA H 67 4.187 4.456 -0.269 1
1 621 . 10 1 1 A 67 67 ASP CA C 67 54.744 56.714 -1.970 1
1 622 . 10 1 1 A 67 67 ASP CB C 67 37.794 40.957 -3.163 1
1 623 . 10 1 1 A 67 67 ASP N N 67 124.130 120.985 3.145 1
1 624 . 10 1 1 A 68 68 TYR H H 68 7.177 7.741 -0.564 1
1 625 . 10 1 1 A 68 68 TYR N N 68 115.334 120.208 -4.874 1
1 626 . 10 1 1 A 69 69 ASN H H 69 8.111 7.853 0.258 1
1 627 . 10 1 1 A 69 69 ASN HA H 69 4.253 4.378 -0.125 1
1 630 . 10 1 1 A 69 69 ASN CA C 69 51.386 54.357 -2.971 1
1 631 . 10 1 1 A 69 69 ASN CB C 69 34.867 37.448 -2.581 1
1 632 . 10 1 1 A 69 69 ASN N N 69 116.867 118.727 -1.860 1
1 633 . 10 1 1 A 70 70 ILE H H 70 7.460 8.130 -0.670 1
1 634 . 10 1 1 A 70 70 ILE HA H 70 3.210 4.075 -0.865 1
1 644 . 10 1 1 A 70 70 ILE CA C 70 60.157 62.287 -2.130 1
1 645 . 10 1 1 A 70 70 ILE CB C 70 34.754 37.737 -2.983 1
1 649 . 10 1 1 A 70 70 ILE N N 70 119.821 120.008 -0.187 1
1 650 . 10 1 1 A 71 71 GLN H H 71 7.368 8.690 -1.322 1
1 651 . 10 1 1 A 71 71 GLN HA H 71 4.099 4.753 -0.654 1
1 656 . 10 1 1 A 71 71 GLN CA C 71 50.906 54.249 -3.343 1
1 657 . 10 1 1 A 71 71 GLN CB C 71 28.793 31.533 -2.740 1
1 659 . 10 1 1 A 71 71 GLN N N 71 124.287 126.801 -2.514 1
1 660 . 10 1 1 A 72 72 ARG H H 72 7.583 9.088 -1.505 1
1 661 . 10 1 1 A 72 72 ARG HA H 72 3.907 4.142 -0.235 1
1 668 . 10 1 1 A 72 72 ARG CA C 72 54.527 59.238 -4.711 1
1 669 . 10 1 1 A 72 72 ARG CB C 72 27.470 30.071 -2.601 1
1 672 . 10 1 1 A 72 72 ARG N N 72 119.007 121.730 -2.723 1
1 673 . 10 1 1 A 73 73 GLU H H 73 9.262 8.610 0.652 1
1 674 . 10 1 1 A 73 73 GLU HA H 73 3.586 4.169 -0.583 1
1 679 . 10 1 1 A 73 73 GLU CA C 73 55.703 56.911 -1.208 1
1 680 . 10 1 1 A 73 73 GLU CB C 73 23.669 28.798 -5.129 1
1 682 . 10 1 1 A 73 73 GLU N N 73 115.180 117.287 -2.107 1
1 683 . 10 1 1 A 74 74 SER H H 74 7.551 8.081 -0.530 1
1 684 . 10 1 1 A 74 74 SER HA H 74 4.613 4.997 -0.384 1
1 687 . 10 1 1 A 74 74 SER CA C 74 58.305 57.294 1.011 1
1 688 . 10 1 1 A 74 74 SER CB C 74 62.156 65.129 -2.973 1
1 689 . 10 1 1 A 74 74 SER N N 74 115.104 116.617 -1.513 1
1 690 . 10 1 1 A 75 75 THR H H 75 8.785 8.841 -0.056 1
1 691 . 10 1 1 A 75 75 THR HA H 75 5.014 4.925 0.089 1
1 696 . 10 1 1 A 75 75 THR CA C 75 59.835 62.241 -2.406 1
1 697 . 10 1 1 A 75 75 THR CB C 75 67.258 69.060 -1.802 1
1 699 . 10 1 1 A 75 75 THR N N 75 118.401 121.839 -3.438 1
1 700 . 10 1 1 A 76 76 LEU H H 76 9.447 9.861 -0.414 1
1 701 . 10 1 1 A 76 76 LEU HA H 76 4.930 4.589 0.341 1
1 711 . 10 1 1 A 76 76 LEU CA C 76 51.107 54.149 -3.042 1
1 712 . 10 1 1 A 76 76 LEU CB C 76 40.841 42.933 -2.092 1
1 716 . 10 1 1 A 76 76 LEU N N 76 127.905 128.198 -0.293 1
1 717 . 10 1 1 A 77 77 HIS HA H 77 4.976 5.666 -0.690 1
1 720 . 10 1 1 A 77 77 HIS CA C 77 53.776 53.373 0.403 1
1 721 . 10 1 1 A 77 77 HIS CB C 77 28.438 32.693 -4.255 1
1 722 . 10 1 1 A 78 78 LEU H H 78 8.450 8.974 -0.524 1
1 723 . 10 1 1 A 78 78 LEU HA H 78 5.085 5.018 0.067 1
1 733 . 10 1 1 A 78 78 LEU CA C 78 50.896 53.870 -2.974 1
1 734 . 10 1 1 A 78 78 LEU CB C 78 41.916 44.932 -3.016 1
1 738 . 10 1 1 A 78 78 LEU N N 78 126.178 129.603 -3.425 1
1 739 . 10 1 1 A 79 79 VAL H H 79 9.093 9.636 -0.543 1
1 740 . 10 1 1 A 79 79 VAL HA H 79 4.053 4.714 -0.661 1
1 748 . 10 1 1 A 79 79 VAL CA C 79 59.054 61.595 -2.541 1
1 749 . 10 1 1 A 79 79 VAL CB C 79 32.115 32.868 -0.753 1
1 752 . 10 1 1 A 79 79 VAL N N 79 128.372 126.775 1.597 1
1 753 . 10 1 1 A 80 80 LEU H H 80 8.000 9.053 -1.053 1
1 754 . 10 1 1 A 80 80 LEU HA H 80 5.105 4.984 0.121 1
1 764 . 10 1 1 A 80 80 LEU CA C 80 50.556 53.674 -3.118 1
1 765 . 10 1 1 A 80 80 LEU CB C 80 39.597 43.278 -3.681 1
1 769 . 10 1 1 A 80 80 LEU N N 80 126.145 128.752 -2.607 1
1 770 . 10 1 1 A 81 81 ARG H H 81 8.470 8.586 -0.116 1
1 771 . 10 1 1 A 81 81 ARG HA H 81 4.197 4.462 -0.265 1
1 778 . 10 1 1 A 81 81 ARG CA C 81 53.133 55.910 -2.777 1
1 779 . 10 1 1 A 81 81 ARG CB C 81 28.413 31.726 -3.313 1
1 782 . 10 1 1 A 81 81 ARG N N 81 121.625 126.105 -4.480 1
1 783 . 10 1 1 A 82 82 LEU H H 82 8.454 8.080 0.374 1
1 784 . 10 1 1 A 82 82 LEU HA H 82 4.339 4.783 -0.444 1
1 794 . 10 1 1 A 82 82 LEU CA C 82 52.081 54.012 -1.931 1
1 795 . 10 1 1 A 82 82 LEU CB C 82 39.810 44.110 -4.300 1
1 799 . 10 1 1 A 82 82 LEU N N 82 123.832 120.981 2.851 1
1 800 . 10 1 1 A 83 83 ARG H H 83 8.404 9.047 -0.643 1
1 801 . 10 1 1 A 83 83 ARG HA H 83 4.308 4.419 -0.111 1
1 808 . 10 1 1 A 83 83 ARG CA C 83 53.258 56.925 -3.667 1
1 809 . 10 1 1 A 83 83 ARG CB C 83 28.160 31.976 -3.816 1
1 812 . 10 1 1 A 83 83 ARG N N 83 121.447 127.371 -5.924 1
1 813 . 10 1 1 A 84 84 GLY H H 84 8.410 7.440 0.970 1
1 814 . 10 1 1 A 84 84 GLY HA2 H 84 3.929 4.082 -0.153 1
1 815 . 10 1 1 A 84 84 GLY HA3 H 84 3.929 4.082 -0.153 1
1 816 . 10 1 1 A 84 84 GLY CA C 84 42.751 45.314 -2.563 1
1 817 . 10 1 1 A 84 84 GLY N N 84 110.030 106.309 3.721 1
1 818 . 10 1 1 A 85 85 GLY H H 85 8.295 8.805 -0.510 1
1 819 . 10 1 1 A 85 85 GLY HA2 H 85 3.950 3.933 0.017 1
1 820 . 10 1 1 A 85 85 GLY HA3 H 85 3.950 3.933 0.017 1
1 821 . 10 1 1 A 85 85 GLY CA C 85 42.831 46.178 -3.347 1
1 822 . 10 1 1 A 85 85 GLY N N 85 108.838 110.143 -1.305 1
1 823 . 10 1 1 A 86 86 SER H H 86 8.292 8.128 0.164 1
1 824 . 10 1 1 A 86 86 SER HA H 86 4.405 4.744 -0.339 1
1 827 . 10 1 1 A 86 86 SER CA C 86 55.965 57.284 -1.319 1
1 828 . 10 1 1 A 86 86 SER CB C 86 61.232 64.624 -3.392 1
1 829 . 10 1 1 A 86 86 SER N N 86 116.028 114.541 1.487 1
1 830 . 10 1 1 A 87 87 MET H H 87 8.470 7.931 0.539 1
1 831 . 10 1 1 A 87 87 MET HA H 87 4.447 4.105 0.342 1
1 836 . 10 1 1 A 87 87 MET CA C 87 53.281 57.590 -4.309 1
1 837 . 10 1 1 A 87 87 MET CB C 87 29.788 32.166 -2.378 1
1 839 . 10 1 1 A 87 87 MET N N 87 121.625 122.584 -0.959 1
1 840 . 10 1 1 A 88 88 GLY H H 88 8.320 8.109 0.211 1
1 841 . 10 1 1 A 88 88 GLY HA2 H 88 3.919 3.827 0.092 1
1 842 . 10 1 1 A 88 88 GLY HA3 H 88 3.896 3.829 0.067 1
1 843 . 10 1 1 A 88 88 GLY CA C 88 43.060 47.287 -4.227 1
1 844 . 10 1 1 A 88 88 GLY N N 88 109.625 107.269 2.356 1
1 845 . 10 1 1 A 89 89 GLY H H 89 8.256 8.209 0.047 1
1 846 . 10 1 1 A 89 89 GLY HA2 H 89 3.940 3.995 -0.055 1
1 847 . 10 1 1 A 89 89 GLY HA3 H 89 3.910 3.995 -0.085 1
1 848 . 10 1 1 A 89 89 GLY CA C 89 42.678 45.474 -2.796 1
1 849 . 10 1 1 A 89 89 GLY N N 89 108.982 112.068 -3.086 1
1 850 . 10 1 1 A 90 90 ALA H H 90 8.203 8.279 -0.076 1
1 851 . 10 1 1 A 90 90 ALA HA H 90 4.255 4.138 0.117 1
1 855 . 10 1 1 A 90 90 ALA CA C 90 50.763 54.794 -4.031 1
1 856 . 10 1 1 A 90 90 ALA CB C 90 16.364 18.943 -2.579 1
1 857 . 10 1 1 A 90 90 ALA N N 90 124.065 123.741 0.324 1
1 858 . 10 1 1 A 91 91 ALA H H 91 8.273 7.937 0.336 1
1 859 . 10 1 1 A 91 91 ALA HA H 91 4.204 4.395 -0.191 1
1 863 . 10 1 1 A 91 91 ALA CA C 91 51.080 51.617 -0.537 1
1 864 . 10 1 1 A 91 91 ALA CB C 91 16.036 19.910 -3.874 1
1 865 . 10 1 1 A 91 91 ALA N N 91 121.985 119.489 2.496 1
1 866 . 10 1 1 A 92 92 ASP H H 92 8.022 8.745 -0.723 1
1 867 . 10 1 1 A 92 92 ASP HA H 92 4.455 4.947 -0.492 1
1 870 . 10 1 1 A 92 92 ASP CA C 92 52.664 53.061 -0.397 1
1 871 . 10 1 1 A 92 92 ASP CB C 92 37.925 41.724 -3.799 1
1 872 . 10 1 1 A 92 92 ASP N N 92 118.621 122.648 -4.027 1
1 873 . 10 1 1 A 93 93 GLU H H 93 8.282 8.245 0.037 1
1 874 . 10 1 1 A 93 93 GLU HA H 93 3.912 3.983 -0.071 1
1 879 . 10 1 1 A 93 93 GLU CA C 93 56.947 57.376 -0.429 1
1 880 . 10 1 1 A 93 93 GLU CB C 93 27.413 28.449 -1.036 1
1 882 . 10 1 1 A 93 93 GLU N N 93 122.247 117.916 4.331 1
1 883 . 10 1 1 A 94 94 GLU H H 94 8.194 8.087 0.107 1
1 884 . 10 1 1 A 94 94 GLU HA H 94 3.940 4.490 -0.550 1
1 889 . 10 1 1 A 94 94 GLU CA C 94 56.681 57.497 -0.816 1
1 890 . 10 1 1 A 94 94 GLU CB C 94 26.127 31.733 -5.606 1
1 892 . 10 1 1 A 94 94 GLU N N 94 118.024 117.149 0.875 1
1 893 . 10 1 1 A 95 95 GLU H H 95 7.816 8.614 -0.798 1
1 894 . 10 1 1 A 95 95 GLU HA H 95 4.121 4.139 -0.018 1
1 898 . 10 1 1 A 95 95 GLU CA C 95 56.162 58.646 -2.484 1
1 899 . 10 1 1 A 95 95 GLU CB C 95 26.403 28.771 -2.368 1
1 901 . 10 1 1 A 95 95 GLU N N 95 120.028 119.751 0.277 1
1 902 . 10 1 1 A 96 96 LEU H H 96 7.637 7.753 -0.116 1
1 903 . 10 1 1 A 96 96 LEU HA H 96 3.988 4.067 -0.079 1
1 913 . 10 1 1 A 96 96 LEU CA C 96 55.303 57.465 -2.162 1
1 914 . 10 1 1 A 96 96 LEU CB C 96 39.038 41.535 -2.497 1
1 918 . 10 1 1 A 96 96 LEU N N 96 119.866 118.510 1.356 1
1 919 . 10 1 1 A 97 97 ILE H H 97 8.044 7.232 0.812 1
1 920 . 10 1 1 A 97 97 ILE HA H 97 3.478 3.986 -0.508 1
1 930 . 10 1 1 A 97 97 ILE CA C 97 62.054 63.782 -1.728 1
1 931 . 10 1 1 A 97 97 ILE CB C 97 34.541 38.069 -3.528 1
1 935 . 10 1 1 A 97 97 ILE N N 97 119.088 119.635 -0.547 1
1 936 . 10 1 1 A 98 98 ARG H H 98 7.991 8.349 -0.358 1
1 937 . 10 1 1 A 98 98 ARG HA H 98 3.793 4.010 -0.217 1
1 944 . 10 1 1 A 98 98 ARG CA C 98 57.509 58.816 -1.307 1
1 945 . 10 1 1 A 98 98 ARG CB C 98 27.191 29.995 -2.804 1
1 948 . 10 1 1 A 98 98 ARG N N 98 119.225 120.805 -1.580 1
1 949 . 10 1 1 A 99 99 LYS H H 99 8.101 8.368 -0.267 1
1 950 . 10 1 1 A 99 99 LYS HA H 99 3.968 4.071 -0.103 1
1 959 . 10 1 1 A 99 99 LYS CA C 99 56.455 59.147 -2.692 1
1 960 . 10 1 1 A 99 99 LYS CB C 99 29.531 31.981 -2.450 1
1 964 . 10 1 1 A 99 99 LYS N N 99 119.464 118.406 1.058 1
1 965 . 10 1 1 A 100 100 ALA H H 100 8.167 7.878 0.289 1
1 966 . 10 1 1 A 100 100 ALA HA H 100 3.789 4.135 -0.346 1
1 970 . 10 1 1 A 100 100 ALA CA C 100 52.451 54.417 -1.966 1
1 971 . 10 1 1 A 100 100 ALA CB C 100 16.259 18.177 -1.918 1
1 972 . 10 1 1 A 100 100 ALA N N 100 122.398 121.072 1.326 1
1 973 . 10 1 1 A 101 101 ILE H H 101 8.777 7.914 0.863 1
1 974 . 10 1 1 A 101 101 ILE HA H 101 3.191 3.644 -0.453 1
1 984 . 10 1 1 A 101 101 ILE CA C 101 62.910 64.863 -1.953 1
1 985 . 10 1 1 A 101 101 ILE CB C 101 34.544 37.081 -2.537 1
1 989 . 10 1 1 A 101 101 ILE N N 101 120.431 118.981 1.450 1
1 990 . 10 1 1 A 102 102 GLU H H 102 7.890 7.711 0.179 1
1 991 . 10 1 1 A 102 102 GLU HA H 102 3.848 4.284 -0.436 1
1 996 . 10 1 1 A 102 102 GLU CA C 102 57.079 57.491 -0.412 1
1 997 . 10 1 1 A 102 102 GLU CB C 102 26.769 30.209 -3.440 1
1 999 . 10 1 1 A 102 102 GLU N N 102 120.248 119.975 0.273 1
1 1000 . 10 1 1 A 103 103 LEU H H 103 8.194 7.865 0.329 1
1 1001 . 10 1 1 A 103 103 LEU HA H 103 3.912 4.284 -0.372 1
1 1011 . 10 1 1 A 103 103 LEU CA C 103 55.078 57.057 -1.979 1
1 1012 . 10 1 1 A 103 103 LEU CB C 103 38.963 42.108 -3.145 1
1 1016 . 10 1 1 A 103 103 LEU N N 103 120.341 119.670 0.671 1
1 1017 . 10 1 1 A 104 104 SER H H 104 8.268 8.108 0.160 1
1 1018 . 10 1 1 A 104 104 SER HA H 104 4.120 4.503 -0.383 1
1 1021 . 10 1 1 A 104 104 SER CA C 104 58.301 59.697 -1.396 1
1 1022 . 10 1 1 A 104 104 SER CB C 104 60.193 63.635 -3.442 1
1 1023 . 10 1 1 A 104 104 SER N N 104 115.150 113.097 2.053 1
1 1024 . 10 1 1 A 105 105 LEU H H 105 7.501 7.829 -0.328 1
1 1025 . 10 1 1 A 105 105 LEU HA H 105 4.041 4.139 -0.098 1
1 1035 . 10 1 1 A 105 105 LEU CA C 105 53.995 57.053 -3.058 1
1 1036 . 10 1 1 A 105 105 LEU CB C 105 39.597 42.114 -2.517 1
1 1040 . 10 1 1 A 105 105 LEU N N 105 124.223 122.137 2.086 1
1 1041 . 10 1 1 A 106 106 LYS H H 106 7.542 8.306 -0.764 1
1 1042 . 10 1 1 A 106 106 LYS HA H 106 4.090 4.063 0.027 1
1 1050 . 10 1 1 A 106 106 LYS CA C 106 55.495 59.430 -3.935 1
1 1051 . 10 1 1 A 106 106 LYS CB C 106 29.941 32.198 -2.257 1
1 1055 . 10 1 1 A 106 106 LYS N N 106 120.328 120.108 0.220 1
1 1056 . 10 1 1 A 107 107 GLU H H 107 7.884 8.029 -0.145 1
1 1057 . 10 1 1 A 107 107 GLU HA H 107 4.210 4.084 0.126 1
1 1060 . 10 1 1 A 107 107 GLU CA C 107 54.509 59.434 -4.925 1
1 1061 . 10 1 1 A 107 107 GLU CB C 107 27.239 29.179 -1.940 1
1 1062 . 10 1 1 A 107 107 GLU N N 107 118.621 120.816 -2.195 1
1 1063 . 10 1 1 A 108 108 SER H H 108 7.923 7.729 0.194 1
1 1064 . 10 1 1 A 108 108 SER HA H 108 4.385 4.168 0.217 1
1 1067 . 10 1 1 A 108 108 SER CA C 108 56.442 61.675 -5.233 1
1 1068 . 10 1 1 A 108 108 SER CB C 108 60.953 63.114 -2.161 1
1 1069 . 10 1 1 A 108 108 SER N N 108 115.670 116.948 -1.278 1
1 1070 . 10 1 1 A 109 109 ARG H H 109 8.068 7.840 0.228 1
1 1071 . 10 1 1 A 109 109 ARG HA H 109 4.307 4.124 0.183 1
1 1078 . 10 1 1 A 109 109 ARG CA C 109 53.732 58.846 -5.114 1
1 1079 . 10 1 1 A 109 109 ARG CB C 109 27.968 29.708 -1.740 1
1 1082 . 10 1 1 A 109 109 ARG N N 109 122.313 122.079 0.234 1
1 1083 . 10 1 1 A 110 110 ASN H H 110 8.292 8.108 0.184 1
1 1084 . 10 1 1 A 110 110 ASN HA H 110 4.720 4.482 0.238 1
1 1087 . 10 1 1 A 110 110 ASN CA C 110 50.750 55.670 -4.920 1
1 1088 . 10 1 1 A 110 110 ASN CB C 110 36.197 38.284 -2.087 1
1 1089 . 10 1 1 A 110 110 ASN N N 110 119.304 118.260 1.044 1
1 1090 . 10 1 1 A 111 111 SER H H 111 8.244 7.881 0.363 1
1 1091 . 10 1 1 A 111 111 SER HA H 111 4.423 3.906 0.517 1
1 1094 . 10 1 1 A 111 111 SER CA C 111 55.990 60.298 -4.308 1
1 1095 . 10 1 1 A 111 111 SER CB C 111 61.027 62.844 -1.817 1
1 1096 . 10 1 1 A 111 111 SER N N 111 116.119 114.952 1.167 1
1 1097 . 10 1 1 A 112 112 GLY H H 112 8.327 8.206 0.121 1
1 1098 . 10 1 1 A 112 112 GLY HA2 H 112 3.944 3.779 0.165 1
1 1099 . 10 1 1 A 112 112 GLY HA3 H 112 3.912 3.826 0.086 1
1 1100 . 10 1 1 A 112 112 GLY CA C 112 42.733 46.845 -4.112 1
1 1101 . 10 1 1 A 112 112 GLY N N 112 110.442 107.700 2.742 1
1 1102 . 10 1 1 A 113 113 GLY H H 113 8.097 7.698 0.399 1
1 1103 . 10 1 1 A 113 113 GLY HA2 H 113 3.831 3.581 0.250 1
1 1104 . 10 1 1 A 113 113 GLY HA3 H 113 3.785 3.590 0.195 1
1 1105 . 10 1 1 A 113 113 GLY CA C 113 42.435 47.270 -4.835 1
1 1106 . 10 1 1 A 113 113 GLY N N 113 108.745 109.296 -0.551 1
1 2 . 11 1 1 A 3 3 HIS CB C 3 33.709 30.663 3.046 1
1 3 . 11 1 1 A 7 7 HIS H H 7 8.731 8.153 0.578 1
1 4 . 11 1 1 A 7 7 HIS HA H 7 4.564 4.683 -0.119 1
1 7 . 11 1 1 A 7 7 HIS CA C 7 53.649 56.265 -2.616 1
1 8 . 11 1 1 A 7 7 HIS CB C 7 26.268 32.113 -5.845 1
1 9 . 11 1 1 A 7 7 HIS N N 7 121.126 117.898 3.228 1
1 10 . 11 1 1 A 8 8 GLY H H 8 8.540 8.012 0.528 1
1 11 . 11 1 1 A 8 8 GLY HA2 H 8 3.973 3.550 0.423 1
1 12 . 11 1 1 A 8 8 GLY HA3 H 8 3.811 3.687 0.124 1
1 13 . 11 1 1 A 8 8 GLY CA C 8 42.618 45.577 -2.959 1
1 14 . 11 1 1 A 8 8 GLY N N 8 110.662 109.102 1.560 1
1 15 . 11 1 1 A 9 9 GLU H H 9 8.239 7.735 0.504 1
1 16 . 11 1 1 A 9 9 GLU HA H 9 4.568 4.701 -0.133 1
1 18 . 11 1 1 A 9 9 GLU CA C 9 53.605 55.654 -2.049 1
1 19 . 11 1 1 A 9 9 GLU CB C 9 28.019 29.500 -1.481 1
1 20 . 11 1 1 A 9 9 GLU N N 9 121.669 115.483 6.186 1
1 21 . 11 1 1 A 10 10 PHE H H 10 8.785 9.020 -0.235 1
1 22 . 11 1 1 A 10 10 PHE HA H 10 4.850 4.895 -0.045 1
1 25 . 11 1 1 A 10 10 PHE CA C 10 52.630 56.820 -4.190 1
1 26 . 11 1 1 A 10 10 PHE CB C 10 37.906 43.470 -5.564 1
1 27 . 11 1 1 A 10 10 PHE N N 10 118.401 121.758 -3.357 1
1 28 . 11 1 1 A 11 11 GLN H H 11 8.552 7.911 0.641 1
1 29 . 11 1 1 A 11 11 GLN HA H 11 5.425 4.276 1.149 1
1 34 . 11 1 1 A 11 11 GLN CA C 11 51.663 56.327 -4.664 1
1 35 . 11 1 1 A 11 11 GLN CB C 11 28.427 29.759 -1.332 1
1 37 . 11 1 1 A 11 11 GLN N N 11 117.519 119.633 -2.114 1
1 38 . 11 1 1 A 12 12 ILE H H 12 8.239 8.329 -0.090 1
1 39 . 11 1 1 A 12 12 ILE HA H 12 4.103 5.327 -1.224 1
1 49 . 11 1 1 A 12 12 ILE CA C 12 57.134 59.366 -2.232 1
1 50 . 11 1 1 A 12 12 ILE CB C 12 39.491 42.345 -2.854 1
1 54 . 11 1 1 A 12 12 ILE N N 12 114.043 117.503 -3.460 1
1 55 . 11 1 1 A 13 13 PHE H H 13 8.538 8.475 0.063 1
1 56 . 11 1 1 A 13 13 PHE HA H 13 5.620 5.290 0.330 1
1 59 . 11 1 1 A 13 13 PHE CA C 13 52.438 56.731 -4.293 1
1 60 . 11 1 1 A 13 13 PHE CB C 13 39.253 41.000 -1.747 1
1 61 . 11 1 1 A 13 13 PHE N N 13 117.015 119.859 -2.844 1
1 62 . 11 1 1 A 14 14 ALA H H 14 9.238 9.566 -0.328 1
1 63 . 11 1 1 A 14 14 ALA HA H 14 5.311 5.299 0.012 1
1 67 . 11 1 1 A 14 14 ALA CA C 14 47.183 49.990 -2.807 1
1 68 . 11 1 1 A 14 14 ALA CB C 14 17.811 21.700 -3.889 1
1 69 . 11 1 1 A 14 14 ALA N N 14 123.503 126.501 -2.998 1
1 70 . 11 1 1 A 15 15 LYS H H 15 8.810 9.445 -0.635 1
1 71 . 11 1 1 A 15 15 LYS HA H 15 5.511 5.336 0.175 1
1 80 . 11 1 1 A 15 15 LYS CA C 15 51.718 54.402 -2.684 1
1 81 . 11 1 1 A 15 15 LYS CB C 15 33.635 34.596 -0.961 1
1 85 . 11 1 1 A 15 15 LYS N N 15 123.382 123.301 0.081 1
1 86 . 11 1 1 A 16 16 THR H H 16 8.830 8.775 0.055 1
1 87 . 11 1 1 A 16 16 THR HA H 16 5.212 4.941 0.271 1
1 92 . 11 1 1 A 16 16 THR CA C 16 57.614 61.177 -3.563 1
1 93 . 11 1 1 A 16 16 THR CB C 16 68.210 70.918 -2.708 1
1 95 . 11 1 1 A 16 16 THR N N 16 116.517 116.724 -0.207 1
1 96 . 11 1 1 A 17 17 LEU H H 17 9.428 8.457 0.971 1
1 97 . 11 1 1 A 17 17 LEU HA H 17 4.286 4.044 0.242 1
1 107 . 11 1 1 A 17 17 LEU CA C 17 54.504 58.589 -4.085 1
1 108 . 11 1 1 A 17 17 LEU CB C 17 38.564 41.315 -2.751 1
1 112 . 11 1 1 A 17 17 LEU N N 17 121.786 123.567 -1.781 1
1 113 . 11 1 1 A 18 18 THR H H 18 7.546 7.851 -0.305 1
1 114 . 11 1 1 A 18 18 THR HA H 18 4.391 4.235 0.156 1
1 119 . 11 1 1 A 18 18 THR CA C 18 58.524 63.559 -5.035 1
1 120 . 11 1 1 A 18 18 THR CB C 18 66.166 70.394 -4.228 1
1 122 . 11 1 1 A 18 18 THR N N 18 105.598 108.959 -3.361 1
1 123 . 11 1 1 A 19 19 GLY H H 19 7.683 8.086 -0.403 1
1 124 . 11 1 1 A 19 19 GLY HA2 H 19 3.300 3.989 -0.689 1
1 125 . 11 1 1 A 19 19 GLY HA3 H 19 4.248 4.002 0.246 1
1 126 . 11 1 1 A 19 19 GLY CA C 19 42.947 46.094 -3.147 1
1 127 . 11 1 1 A 19 19 GLY N N 19 109.243 111.997 -2.754 1
1 128 . 11 1 1 A 20 20 LYS H H 20 7.375 7.839 -0.464 1
1 129 . 11 1 1 A 20 20 LYS HA H 20 4.331 4.708 -0.377 1
1 138 . 11 1 1 A 20 20 LYS CA C 20 53.829 55.057 -1.228 1
1 139 . 11 1 1 A 20 20 LYS CB C 20 30.385 34.609 -4.224 1
1 143 . 11 1 1 A 20 20 LYS N N 20 122.757 120.468 2.289 1
1 144 . 11 1 1 A 21 21 THR H H 21 8.637 8.846 -0.209 1
1 145 . 11 1 1 A 21 21 THR HA H 21 4.852 4.660 0.192 1
1 150 . 11 1 1 A 21 21 THR CA C 21 59.846 62.565 -2.719 1
1 151 . 11 1 1 A 21 21 THR CB C 21 67.140 69.149 -2.009 1
1 153 . 11 1 1 A 21 21 THR N N 21 121.524 123.250 -1.726 1
1 154 . 11 1 1 A 22 22 ILE H H 22 9.509 9.119 0.390 1
1 155 . 11 1 1 A 22 22 ILE HA H 22 4.349 4.822 -0.473 1
1 165 . 11 1 1 A 22 22 ILE CA C 22 57.634 60.026 -2.392 1
1 166 . 11 1 1 A 22 22 ILE CB C 22 38.334 42.028 -3.694 1
1 170 . 11 1 1 A 22 22 ILE N N 22 129.772 127.011 2.761 1
1 171 . 11 1 1 A 23 23 THR H H 23 8.838 8.915 -0.077 1
1 172 . 11 1 1 A 23 23 THR HA H 23 4.653 5.261 -0.608 1
1 177 . 11 1 1 A 23 23 THR CA C 23 60.194 60.126 0.068 1
1 178 . 11 1 1 A 23 23 THR CB C 23 66.577 70.263 -3.686 1
1 180 . 11 1 1 A 23 23 THR N N 23 124.070 118.954 5.116 1
1 181 . 11 1 1 A 24 24 LEU H H 24 8.749 8.405 0.344 1
1 182 . 11 1 1 A 24 24 LEU HA H 24 4.619 5.116 -0.497 1
1 192 . 11 1 1 A 24 24 LEU CA C 24 50.257 52.813 -2.556 1
1 193 . 11 1 1 A 24 24 LEU CB C 24 42.932 45.666 -2.734 1
1 197 . 11 1 1 A 24 24 LEU N N 24 126.499 122.251 4.248 1
1 198 . 11 1 1 A 25 25 GLU H H 25 7.990 8.459 -0.469 1
1 199 . 11 1 1 A 25 25 GLU HA H 25 4.591 4.513 0.078 1
1 204 . 11 1 1 A 25 25 GLU CA C 25 52.845 55.956 -3.111 1
1 205 . 11 1 1 A 25 25 GLU CB C 25 27.210 30.039 -2.829 1
1 207 . 11 1 1 A 25 25 GLU N N 25 121.644 120.504 1.140 1
1 208 . 11 1 1 A 26 26 VAL H H 26 8.657 8.528 0.129 1
1 209 . 11 1 1 A 26 26 VAL HA H 26 4.403 4.865 -0.462 1
1 217 . 11 1 1 A 26 26 VAL CA C 26 56.020 58.613 -2.593 1
1 218 . 11 1 1 A 26 26 VAL CB C 26 33.631 35.520 -1.889 1
1 221 . 11 1 1 A 26 26 VAL N N 26 116.647 117.241 -0.594 1
1 222 . 11 1 1 A 27 27 GLU H H 27 7.970 9.044 -1.074 1
1 223 . 11 1 1 A 27 27 GLU HA H 27 4.447 4.388 0.059 1
1 228 . 11 1 1 A 27 27 GLU CA C 27 51.386 56.405 -5.019 1
1 229 . 11 1 1 A 27 27 GLU CB C 27 30.905 30.635 0.270 1
1 231 . 11 1 1 A 27 27 GLU N N 27 115.496 122.946 -7.450 1
1 232 . 11 1 1 A 28 28 SER H H 28 9.192 8.663 0.529 1
1 233 . 11 1 1 A 28 28 SER HA H 28 4.108 4.155 -0.047 1
1 236 . 11 1 1 A 28 28 SER CA C 28 59.909 61.083 -1.174 1
1 237 . 11 1 1 A 28 28 SER CB C 28 60.399 62.824 -2.425 1
1 238 . 11 1 1 A 28 28 SER N N 28 117.720 117.220 0.500 1
1 239 . 11 1 1 A 29 29 SER H H 29 7.371 7.711 -0.340 1
1 240 . 11 1 1 A 29 29 SER HA H 29 4.327 4.478 -0.151 1
1 243 . 11 1 1 A 29 29 SER CA C 29 54.805 57.297 -2.492 1
1 244 . 11 1 1 A 29 29 SER CB C 29 60.775 64.165 -3.390 1
1 245 . 11 1 1 A 29 29 SER N N 29 108.936 109.904 -0.968 1
1 246 . 11 1 1 A 30 30 ASP H H 30 7.852 7.608 0.244 1
1 247 . 11 1 1 A 30 30 ASP HA H 30 4.591 4.528 0.063 1
1 250 . 11 1 1 A 30 30 ASP CA C 30 53.040 54.720 -1.680 1
1 251 . 11 1 1 A 30 30 ASP CB C 30 37.942 41.405 -3.463 1
1 252 . 11 1 1 A 30 30 ASP N N 30 123.735 123.998 -0.263 1
1 253 . 11 1 1 A 31 31 THR H H 31 7.852 8.478 -0.626 1
1 254 . 11 1 1 A 31 31 THR HA H 31 4.918 4.886 0.032 1
1 259 . 11 1 1 A 31 31 THR CA C 31 56.929 60.205 -3.276 1
1 260 . 11 1 1 A 31 31 THR CB C 31 68.674 71.342 -2.668 1
1 262 . 11 1 1 A 31 31 THR N N 31 109.181 112.869 -3.688 1
1 263 . 11 1 1 A 32 32 ILE H H 32 8.582 8.835 -0.253 1
1 264 . 11 1 1 A 32 32 ILE HA H 32 3.624 3.776 -0.152 1
1 274 . 11 1 1 A 32 32 ILE CA C 32 59.474 65.534 -6.060 1
1 275 . 11 1 1 A 32 32 ILE CB C 32 31.561 37.502 -5.941 1
1 279 . 11 1 1 A 32 32 ILE N N 32 121.833 122.848 -1.015 1
1 280 . 11 1 1 A 33 33 ASP H H 33 9.255 8.248 1.007 1
1 281 . 11 1 1 A 33 33 ASP HA H 33 4.201 4.420 -0.219 1
1 284 . 11 1 1 A 33 33 ASP CA C 33 54.679 57.748 -3.069 1
1 285 . 11 1 1 A 33 33 ASP CB C 33 37.700 41.987 -4.287 1
1 286 . 11 1 1 A 33 33 ASP N N 33 119.823 120.716 -0.893 1
1 287 . 11 1 1 A 34 34 ASN H H 34 8.026 8.012 0.014 1
1 288 . 11 1 1 A 34 34 ASN HA H 34 4.409 4.684 -0.275 1
1 291 . 11 1 1 A 34 34 ASN CA C 34 53.324 56.228 -2.904 1
1 292 . 11 1 1 A 34 34 ASN CB C 34 35.782 38.707 -2.925 1
1 293 . 11 1 1 A 34 34 ASN N N 34 119.540 118.026 1.514 1
1 294 . 11 1 1 A 35 35 VAL H H 35 8.167 7.995 0.172 1
1 295 . 11 1 1 A 35 35 VAL HA H 35 3.249 3.454 -0.205 1
1 303 . 11 1 1 A 35 35 VAL CA C 35 65.308 67.242 -1.934 1
1 304 . 11 1 1 A 35 35 VAL CB C 35 27.965 31.512 -3.547 1
1 307 . 11 1 1 A 35 35 VAL N N 35 122.223 120.197 2.026 1
1 308 . 11 1 1 A 36 36 LYS H H 36 8.460 8.324 0.136 1
1 313 . 11 1 1 A 36 36 LYS CB C 36 30.753 32.242 -1.489 1
1 315 . 11 1 1 A 36 36 LYS N N 36 119.438 119.288 0.150 1
1 316 . 11 1 1 A 37 37 SER H H 37 8.196 8.588 -0.392 1
1 317 . 11 1 1 A 37 37 SER HA H 37 4.130 4.170 -0.040 1
1 320 . 11 1 1 A 37 37 SER CA C 37 58.528 61.163 -2.635 1
1 321 . 11 1 1 A 37 37 SER CB C 37 59.768 62.596 -2.828 1
1 322 . 11 1 1 A 37 37 SER N N 37 117.791 114.205 3.586 1
1 323 . 11 1 1 A 38 38 LYS H H 38 8.043 8.117 -0.074 1
1 324 . 11 1 1 A 38 38 LYS HA H 38 4.095 3.971 0.124 1
1 325 . 11 1 1 A 38 38 LYS CA C 38 57.377 59.149 -1.772 1
1 326 . 11 1 1 A 38 38 LYS N N 38 124.094 121.033 3.061 1
1 327 . 11 1 1 A 39 39 ILE H H 39 8.254 8.151 0.103 1
1 328 . 11 1 1 A 39 39 ILE HA H 39 3.439 3.769 -0.330 1
1 338 . 11 1 1 A 39 39 ILE CA C 39 63.977 64.551 -0.574 1
1 339 . 11 1 1 A 39 39 ILE CB C 39 33.935 37.362 -3.427 1
1 343 . 11 1 1 A 39 39 ILE N N 39 122.107 119.601 2.506 1
1 344 . 11 1 1 A 40 40 GLN H H 40 8.379 8.344 0.035 1
1 345 . 11 1 1 A 40 40 GLN HA H 40 3.746 4.176 -0.430 1
1 350 . 11 1 1 A 40 40 GLN CA C 40 57.472 58.145 -0.673 1
1 351 . 11 1 1 A 40 40 GLN CB C 40 25.072 28.018 -2.946 1
1 353 . 11 1 1 A 40 40 GLN N N 40 123.725 119.450 4.275 1
1 354 . 11 1 1 A 41 41 ASP H H 41 8.210 7.893 0.317 1
1 355 . 11 1 1 A 41 41 ASP HA H 41 4.247 4.385 -0.138 1
1 358 . 11 1 1 A 41 41 ASP CA C 41 54.646 56.514 -1.868 1
1 359 . 11 1 1 A 41 41 ASP CB C 41 38.136 40.854 -2.718 1
1 360 . 11 1 1 A 41 41 ASP N N 41 120.564 120.544 0.020 1
1 361 . 11 1 1 A 42 42 LYS H H 42 7.381 7.983 -0.602 1
1 362 . 11 1 1 A 42 42 LYS HA H 42 4.246 4.291 -0.045 1
1 369 . 11 1 1 A 42 42 LYS CA C 42 55.579 57.867 -2.288 1
1 370 . 11 1 1 A 42 42 LYS CB C 42 31.406 33.455 -2.049 1
1 373 . 11 1 1 A 42 42 LYS N N 42 115.674 116.495 -0.821 1
1 374 . 11 1 1 A 43 43 GLU H H 43 8.537 8.622 -0.085 1
1 375 . 11 1 1 A 43 43 GLU HA H 43 4.522 4.509 0.013 1
1 380 . 11 1 1 A 43 43 GLU CA C 43 52.772 55.747 -2.975 1
1 381 . 11 1 1 A 43 43 GLU CB C 43 30.535 30.927 -0.392 1
1 383 . 11 1 1 A 43 43 GLU N N 43 114.355 116.138 -1.783 1
1 384 . 11 1 1 A 44 44 GLY H H 44 8.611 8.407 0.204 1
1 385 . 11 1 1 A 44 44 GLY HA2 H 44 4.067 3.962 0.105 1
1 386 . 11 1 1 A 44 44 GLY HA3 H 44 3.819 3.964 -0.145 1
1 387 . 11 1 1 A 44 44 GLY CA C 44 43.205 45.482 -2.277 1
1 388 . 11 1 1 A 44 44 GLY N N 44 109.406 108.448 0.958 1
1 389 . 11 1 1 A 45 45 ILE H H 45 6.092 8.053 -1.961 1
1 390 . 11 1 1 A 45 45 ILE HA H 45 4.324 4.120 0.204 1
1 400 . 11 1 1 A 45 45 ILE CA C 45 55.211 60.099 -4.888 1
1 401 . 11 1 1 A 45 45 ILE CB C 45 37.903 38.472 -0.569 1
1 405 . 11 1 1 A 45 45 ILE N N 45 120.791 122.473 -1.682 1
1 406 . 11 1 1 A 46 46 PRO HA H 46 4.547 4.550 -0.003 1
1 413 . 11 1 1 A 46 46 PRO CA C 46 58.971 61.994 -3.023 1
1 414 . 11 1 1 A 46 46 PRO CB C 46 29.142 32.391 -3.249 1
1 417 . 11 1 1 A 47 47 PRO HA H 47 4.062 4.176 -0.114 1
1 424 . 11 1 1 A 47 47 PRO CA C 47 63.476 65.788 -2.312 1
1 425 . 11 1 1 A 47 47 PRO CB C 47 30.113 31.921 -1.808 1
1 428 . 11 1 1 A 48 48 ASP H H 48 8.418 8.923 -0.505 1
1 429 . 11 1 1 A 48 48 ASP HA H 48 4.346 4.364 -0.018 1
1 432 . 11 1 1 A 48 48 ASP CA C 48 52.838 56.982 -4.144 1
1 433 . 11 1 1 A 48 48 ASP CB C 48 36.926 39.791 -2.865 1
1 434 . 11 1 1 A 48 48 ASP N N 48 113.462 117.168 -3.706 1
1 435 . 11 1 1 A 49 49 GLN H H 49 7.822 7.766 0.056 1
1 436 . 11 1 1 A 49 49 GLN HA H 49 4.283 4.062 0.221 1
1 439 . 11 1 1 A 49 49 GLN CA C 49 52.770 57.775 -5.005 1
1 441 . 11 1 1 A 49 49 GLN N N 49 117.377 118.181 -0.804 1
1 442 . 11 1 1 A 50 50 GLN H H 50 7.451 7.451 0.000 1
1 443 . 11 1 1 A 50 50 GLN HA H 50 4.260 4.734 -0.474 1
1 448 . 11 1 1 A 50 50 GLN CA C 50 53.725 54.384 -0.659 1
1 449 . 11 1 1 A 50 50 GLN CB C 50 29.142 31.840 -2.698 1
1 451 . 11 1 1 A 50 50 GLN N N 50 117.526 117.829 -0.303 1
1 452 . 11 1 1 A 51 51 ARG H H 51 8.534 8.142 0.392 1
1 453 . 11 1 1 A 51 51 ARG HA H 51 4.486 5.183 -0.697 1
1 460 . 11 1 1 A 51 51 ARG CA C 51 52.492 54.208 -1.716 1
1 461 . 11 1 1 A 51 51 ARG CB C 51 29.096 34.842 -5.746 1
1 464 . 11 1 1 A 51 51 ARG N N 51 121.655 119.419 2.236 1
1 465 . 11 1 1 A 52 52 LEU H H 52 8.683 8.907 -0.224 1
1 466 . 11 1 1 A 52 52 LEU HA H 52 5.255 4.953 0.302 1
1 476 . 11 1 1 A 52 52 LEU CA C 52 50.618 53.949 -3.331 1
1 477 . 11 1 1 A 52 52 LEU CB C 52 43.007 44.156 -1.149 1
1 481 . 11 1 1 A 52 52 LEU N N 52 122.929 121.362 1.567 1
1 482 . 11 1 1 A 53 53 ILE H H 53 9.286 9.285 0.001 1
1 483 . 11 1 1 A 53 53 ILE HA H 53 5.096 4.958 0.138 1
1 492 . 11 1 1 A 53 53 ILE CA C 53 56.795 60.450 -3.655 1
1 496 . 11 1 1 A 53 53 ILE N N 53 124.718 126.102 -1.384 1
1 497 . 11 1 1 A 54 54 TRP H H 54 8.871 9.179 -0.308 1
1 499 . 11 1 1 A 54 54 TRP N N 54 127.412 128.447 -1.035 1
1 501 . 11 1 1 A 55 55 ALA H H 55 8.401 8.579 -0.178 1
1 502 . 11 1 1 A 55 55 ALA HA H 55 3.183 3.479 -0.296 1
1 506 . 11 1 1 A 55 55 ALA CA C 55 49.712 52.634 -2.922 1
1 507 . 11 1 1 A 55 55 ALA CB C 55 13.252 16.776 -3.524 1
1 508 . 11 1 1 A 55 55 ALA N N 55 128.894 130.331 -1.437 1
1 509 . 11 1 1 A 56 56 GLY H H 56 8.248 8.406 -0.158 1
1 510 . 11 1 1 A 56 56 GLY HA2 H 56 3.968 3.720 0.248 1
1 511 . 11 1 1 A 56 56 GLY HA3 H 56 3.916 3.738 0.178 1
1 512 . 11 1 1 A 56 56 GLY CA C 56 43.142 45.575 -2.433 1
1 513 . 11 1 1 A 56 56 GLY N N 56 101.499 102.535 -1.036 1
1 514 . 11 1 1 A 57 57 LYS H H 57 8.028 7.676 0.352 1
1 515 . 11 1 1 A 57 57 LYS HA H 57 4.609 4.731 -0.122 1
1 522 . 11 1 1 A 57 57 LYS CA C 57 51.928 54.207 -2.279 1
1 523 . 11 1 1 A 57 57 LYS CB C 57 32.613 35.112 -2.499 1
1 526 . 11 1 1 A 57 57 LYS N N 57 118.995 120.579 -1.584 1
1 527 . 11 1 1 A 58 58 GLN H H 58 8.607 8.433 0.174 1
1 528 . 11 1 1 A 58 58 GLN HA H 58 4.617 4.619 -0.002 1
1 533 . 11 1 1 A 58 58 GLN CA C 58 53.261 55.851 -2.590 1
1 534 . 11 1 1 A 58 58 GLN CB C 58 26.613 29.280 -2.667 1
1 536 . 11 1 1 A 58 58 GLN N N 58 119.825 122.226 -2.401 1
1 537 . 11 1 1 A 59 59 LEU H H 59 8.653 9.158 -0.505 1
1 538 . 11 1 1 A 59 59 LEU HA H 59 4.138 4.412 -0.274 1
1 548 . 11 1 1 A 59 59 LEU CA C 59 51.991 54.514 -2.523 1
1 549 . 11 1 1 A 59 59 LEU CB C 59 39.006 42.207 -3.201 1
1 553 . 11 1 1 A 59 59 LEU N N 59 125.484 125.236 0.248 1
1 554 . 11 1 1 A 60 60 GLU H H 60 8.461 8.983 -0.522 1
1 555 . 11 1 1 A 60 60 GLU HA H 60 4.371 4.484 -0.113 1
1 559 . 11 1 1 A 60 60 GLU CA C 60 53.436 56.029 -2.593 1
1 560 . 11 1 1 A 60 60 GLU CB C 60 29.057 30.822 -1.765 1
1 562 . 11 1 1 A 60 60 GLU N N 60 123.237 122.575 0.662 1
1 563 . 11 1 1 A 61 61 ASP H H 61 8.076 8.782 -0.706 1
1 564 . 11 1 1 A 61 61 ASP HA H 61 4.265 4.357 -0.092 1
1 567 . 11 1 1 A 61 61 ASP CA C 61 54.398 56.763 -2.365 1
1 568 . 11 1 1 A 61 61 ASP CB C 61 38.340 40.522 -2.182 1
1 569 . 11 1 1 A 61 61 ASP N N 61 120.701 123.617 -2.916 1
1 570 . 11 1 1 A 62 62 GLY HA2 H 62 4.104 3.979 0.125 1
1 571 . 11 1 1 A 62 62 GLY HA3 H 62 3.832 3.982 -0.150 1
1 572 . 11 1 1 A 62 62 GLY CA C 62 42.576 45.253 -2.677 1
1 573 . 11 1 1 A 63 63 ARG H H 63 7.319 8.344 -1.025 1
1 574 . 11 1 1 A 63 63 ARG HA H 63 4.595 4.459 0.136 1
1 579 . 11 1 1 A 63 63 ARG CA C 63 51.971 55.830 -3.859 1
1 582 . 11 1 1 A 63 63 ARG N N 63 119.206 120.619 -1.413 1
1 583 . 11 1 1 A 64 64 THR H H 64 8.735 8.531 0.204 1
1 584 . 11 1 1 A 64 64 THR HA H 64 5.208 4.976 0.232 1
1 589 . 11 1 1 A 64 64 THR CA C 64 57.126 59.554 -2.428 1
1 590 . 11 1 1 A 64 64 THR CB C 64 69.885 71.633 -1.748 1
1 592 . 11 1 1 A 64 64 THR N N 64 108.713 111.284 -2.571 1
1 593 . 11 1 1 A 65 65 LEU H H 65 8.241 9.323 -1.082 1
1 594 . 11 1 1 A 65 65 LEU HA H 65 4.003 3.914 0.089 1
1 604 . 11 1 1 A 65 65 LEU CA C 65 56.409 57.718 -1.309 1
1 605 . 11 1 1 A 65 65 LEU CB C 65 37.179 41.405 -4.226 1
1 609 . 11 1 1 A 65 65 LEU N N 65 118.111 122.388 -4.277 1
1 610 . 11 1 1 A 66 66 SER H H 66 8.296 8.204 0.092 1
1 611 . 11 1 1 A 66 66 SER HA H 66 4.201 4.281 -0.080 1
1 614 . 11 1 1 A 66 66 SER CA C 66 58.454 60.017 -1.563 1
1 615 . 11 1 1 A 66 66 SER CB C 66 59.969 62.860 -2.891 1
1 616 . 11 1 1 A 66 66 SER N N 66 113.148 113.257 -0.109 1
1 617 . 11 1 1 A 67 67 ASP H H 67 7.984 8.317 -0.333 1
1 618 . 11 1 1 A 67 67 ASP HA H 67 4.187 4.256 -0.069 1
1 621 . 11 1 1 A 67 67 ASP CA C 67 54.744 57.193 -2.449 1
1 622 . 11 1 1 A 67 67 ASP CB C 67 37.794 41.636 -3.842 1
1 623 . 11 1 1 A 67 67 ASP N N 67 124.130 123.878 0.252 1
1 624 . 11 1 1 A 68 68 TYR H H 68 7.177 7.594 -0.417 1
1 625 . 11 1 1 A 68 68 TYR N N 68 115.334 117.964 -2.630 1
1 626 . 11 1 1 A 69 69 ASN H H 69 8.111 8.140 -0.029 1
1 627 . 11 1 1 A 69 69 ASN HA H 69 4.253 4.371 -0.118 1
1 630 . 11 1 1 A 69 69 ASN CA C 69 51.386 54.175 -2.789 1
1 631 . 11 1 1 A 69 69 ASN CB C 69 34.867 37.325 -2.458 1
1 632 . 11 1 1 A 69 69 ASN N N 69 116.867 116.578 0.289 1
1 633 . 11 1 1 A 70 70 ILE H H 70 7.460 7.907 -0.447 1
1 634 . 11 1 1 A 70 70 ILE HA H 70 3.210 3.841 -0.631 1
1 644 . 11 1 1 A 70 70 ILE CA C 70 60.157 61.838 -1.681 1
1 645 . 11 1 1 A 70 70 ILE CB C 70 34.754 37.231 -2.477 1
1 649 . 11 1 1 A 70 70 ILE N N 70 119.821 119.734 0.087 1
1 650 . 11 1 1 A 71 71 GLN H H 71 7.368 8.613 -1.245 1
1 651 . 11 1 1 A 71 71 GLN HA H 71 4.099 4.338 -0.239 1
1 656 . 11 1 1 A 71 71 GLN CA C 71 50.906 55.840 -4.934 1
1 657 . 11 1 1 A 71 71 GLN CB C 71 28.793 29.584 -0.791 1
1 659 . 11 1 1 A 71 71 GLN N N 71 124.287 127.915 -3.628 1
1 660 . 11 1 1 A 72 72 ARG H H 72 7.583 8.698 -1.115 1
1 661 . 11 1 1 A 72 72 ARG HA H 72 3.907 4.055 -0.148 1
1 668 . 11 1 1 A 72 72 ARG CA C 72 54.527 59.243 -4.716 1
1 669 . 11 1 1 A 72 72 ARG CB C 72 27.470 30.086 -2.616 1
1 672 . 11 1 1 A 72 72 ARG N N 72 119.007 120.130 -1.123 1
1 673 . 11 1 1 A 73 73 GLU H H 73 9.262 7.710 1.552 1
1 674 . 11 1 1 A 73 73 GLU HA H 73 3.586 4.625 -1.039 1
1 679 . 11 1 1 A 73 73 GLU CA C 73 55.703 56.132 -0.429 1
1 680 . 11 1 1 A 73 73 GLU CB C 73 23.669 28.003 -4.334 1
1 682 . 11 1 1 A 73 73 GLU N N 73 115.180 118.165 -2.985 1
1 683 . 11 1 1 A 74 74 SER H H 74 7.551 8.123 -0.572 1
1 684 . 11 1 1 A 74 74 SER HA H 74 4.613 5.065 -0.452 1
1 687 . 11 1 1 A 74 74 SER CA C 74 58.305 56.346 1.959 1
1 688 . 11 1 1 A 74 74 SER CB C 74 62.156 64.831 -2.675 1
1 689 . 11 1 1 A 74 74 SER N N 74 115.104 117.499 -2.395 1
1 690 . 11 1 1 A 75 75 THR H H 75 8.785 8.921 -0.136 1
1 691 . 11 1 1 A 75 75 THR HA H 75 5.014 4.800 0.214 1
1 696 . 11 1 1 A 75 75 THR CA C 75 59.835 62.542 -2.707 1
1 697 . 11 1 1 A 75 75 THR CB C 75 67.258 68.780 -1.522 1
1 699 . 11 1 1 A 75 75 THR N N 75 118.401 122.097 -3.696 1
1 700 . 11 1 1 A 76 76 LEU H H 76 9.447 10.061 -0.614 1
1 701 . 11 1 1 A 76 76 LEU HA H 76 4.930 4.896 0.034 1
1 711 . 11 1 1 A 76 76 LEU CA C 76 51.107 54.148 -3.041 1
1 712 . 11 1 1 A 76 76 LEU CB C 76 40.841 42.905 -2.064 1
1 716 . 11 1 1 A 76 76 LEU N N 76 127.905 128.116 -0.211 1
1 717 . 11 1 1 A 77 77 HIS HA H 77 4.976 5.495 -0.519 1
1 720 . 11 1 1 A 77 77 HIS CA C 77 53.776 54.152 -0.376 1
1 721 . 11 1 1 A 77 77 HIS CB C 77 28.438 32.215 -3.777 1
1 722 . 11 1 1 A 78 78 LEU H H 78 8.450 9.316 -0.866 1
1 723 . 11 1 1 A 78 78 LEU HA H 78 5.085 5.154 -0.069 1
1 733 . 11 1 1 A 78 78 LEU CA C 78 50.896 53.495 -2.599 1
1 734 . 11 1 1 A 78 78 LEU CB C 78 41.916 45.500 -3.584 1
1 738 . 11 1 1 A 78 78 LEU N N 78 126.178 125.533 0.645 1
1 739 . 11 1 1 A 79 79 VAL H H 79 9.093 8.969 0.124 1
1 740 . 11 1 1 A 79 79 VAL HA H 79 4.053 5.040 -0.987 1
1 748 . 11 1 1 A 79 79 VAL CA C 79 59.054 59.890 -0.836 1
1 749 . 11 1 1 A 79 79 VAL CB C 79 32.115 34.218 -2.103 1
1 752 . 11 1 1 A 79 79 VAL N N 79 128.372 120.342 8.030 1
1 753 . 11 1 1 A 80 80 LEU H H 80 8.000 9.016 -1.016 1
1 754 . 11 1 1 A 80 80 LEU HA H 80 5.105 5.088 0.017 1
1 764 . 11 1 1 A 80 80 LEU CA C 80 50.556 52.998 -2.442 1
1 765 . 11 1 1 A 80 80 LEU CB C 80 39.597 43.217 -3.620 1
1 769 . 11 1 1 A 80 80 LEU N N 80 126.145 127.003 -0.858 1
1 770 . 11 1 1 A 81 81 ARG H H 81 8.470 8.228 0.242 1
1 771 . 11 1 1 A 81 81 ARG HA H 81 4.197 4.665 -0.468 1
1 778 . 11 1 1 A 81 81 ARG CA C 81 53.133 55.931 -2.798 1
1 779 . 11 1 1 A 81 81 ARG CB C 81 28.413 31.224 -2.811 1
1 782 . 11 1 1 A 81 81 ARG N N 81 121.625 124.332 -2.707 1
1 783 . 11 1 1 A 82 82 LEU H H 82 8.454 8.901 -0.447 1
1 784 . 11 1 1 A 82 82 LEU HA H 82 4.339 4.626 -0.287 1
1 794 . 11 1 1 A 82 82 LEU CA C 82 52.081 54.117 -2.036 1
1 795 . 11 1 1 A 82 82 LEU CB C 82 39.810 41.984 -2.174 1
1 799 . 11 1 1 A 82 82 LEU N N 82 123.832 125.122 -1.290 1
1 800 . 11 1 1 A 83 83 ARG H H 83 8.404 8.586 -0.182 1
1 801 . 11 1 1 A 83 83 ARG HA H 83 4.308 4.080 0.228 1
1 808 . 11 1 1 A 83 83 ARG CA C 83 53.258 59.474 -6.216 1
1 809 . 11 1 1 A 83 83 ARG CB C 83 28.160 30.096 -1.936 1
1 812 . 11 1 1 A 83 83 ARG N N 83 121.447 127.090 -5.643 1
1 813 . 11 1 1 A 84 84 GLY H H 84 8.410 8.256 0.154 1
1 814 . 11 1 1 A 84 84 GLY HA2 H 84 3.929 3.862 0.067 1
1 815 . 11 1 1 A 84 84 GLY HA3 H 84 3.929 3.863 0.066 1
1 816 . 11 1 1 A 84 84 GLY CA C 84 42.751 47.105 -4.354 1
1 817 . 11 1 1 A 84 84 GLY N N 84 110.030 106.789 3.241 1
1 818 . 11 1 1 A 85 85 GLY H H 85 8.295 7.673 0.622 1
1 819 . 11 1 1 A 85 85 GLY HA2 H 85 3.950 4.066 -0.116 1
1 820 . 11 1 1 A 85 85 GLY HA3 H 85 3.950 4.066 -0.116 1
1 821 . 11 1 1 A 85 85 GLY CA C 85 42.831 45.691 -2.860 1
1 822 . 11 1 1 A 85 85 GLY N N 85 108.838 106.978 1.860 1
1 823 . 11 1 1 A 86 86 SER H H 86 8.292 8.135 0.157 1
1 824 . 11 1 1 A 86 86 SER HA H 86 4.405 4.843 -0.438 1
1 827 . 11 1 1 A 86 86 SER CA C 86 55.965 57.191 -1.226 1
1 828 . 11 1 1 A 86 86 SER CB C 86 61.232 65.665 -4.433 1
1 829 . 11 1 1 A 86 86 SER N N 86 116.028 115.323 0.705 1
1 830 . 11 1 1 A 87 87 MET H H 87 8.470 8.871 -0.401 1
1 831 . 11 1 1 A 87 87 MET HA H 87 4.447 4.137 0.310 1
1 836 . 11 1 1 A 87 87 MET CA C 87 53.281 57.839 -4.558 1
1 837 . 11 1 1 A 87 87 MET CB C 87 29.788 33.656 -3.868 1
1 839 . 11 1 1 A 87 87 MET N N 87 121.625 126.399 -4.774 1
1 840 . 11 1 1 A 88 88 GLY H H 88 8.320 8.066 0.254 1
1 841 . 11 1 1 A 88 88 GLY HA2 H 88 3.919 3.973 -0.054 1
1 842 . 11 1 1 A 88 88 GLY HA3 H 88 3.896 3.974 -0.078 1
1 843 . 11 1 1 A 88 88 GLY CA C 88 43.060 45.211 -2.151 1
1 844 . 11 1 1 A 88 88 GLY N N 88 109.625 107.403 2.222 1
1 845 . 11 1 1 A 89 89 GLY H H 89 8.256 7.786 0.470 1
1 846 . 11 1 1 A 89 89 GLY HA2 H 89 3.940 4.080 -0.140 1
1 847 . 11 1 1 A 89 89 GLY HA3 H 89 3.910 4.082 -0.172 1
1 848 . 11 1 1 A 89 89 GLY CA C 89 42.678 44.368 -1.690 1
1 849 . 11 1 1 A 89 89 GLY N N 89 108.982 108.784 0.198 1
1 850 . 11 1 1 A 90 90 ALA H H 90 8.203 8.136 0.067 1
1 851 . 11 1 1 A 90 90 ALA HA H 90 4.255 4.085 0.170 1
1 855 . 11 1 1 A 90 90 ALA CA C 90 50.763 54.859 -4.096 1
1 856 . 11 1 1 A 90 90 ALA CB C 90 16.364 18.720 -2.356 1
1 857 . 11 1 1 A 90 90 ALA N N 90 124.065 126.411 -2.346 1
1 858 . 11 1 1 A 91 91 ALA H H 91 8.273 7.909 0.364 1
1 859 . 11 1 1 A 91 91 ALA HA H 91 4.204 4.381 -0.177 1
1 863 . 11 1 1 A 91 91 ALA CA C 91 51.080 52.157 -1.077 1
1 864 . 11 1 1 A 91 91 ALA CB C 91 16.036 20.362 -4.326 1
1 865 . 11 1 1 A 91 91 ALA N N 91 121.985 119.868 2.117 1
1 866 . 11 1 1 A 92 92 ASP H H 92 8.022 8.557 -0.535 1
1 867 . 11 1 1 A 92 92 ASP HA H 92 4.455 4.924 -0.469 1
1 870 . 11 1 1 A 92 92 ASP CA C 92 52.664 53.199 -0.535 1
1 871 . 11 1 1 A 92 92 ASP CB C 92 37.925 42.300 -4.375 1
1 872 . 11 1 1 A 92 92 ASP N N 92 118.621 118.589 0.032 1
1 873 . 11 1 1 A 93 93 GLU H H 93 8.282 8.250 0.032 1
1 874 . 11 1 1 A 93 93 GLU HA H 93 3.912 3.999 -0.087 1
1 879 . 11 1 1 A 93 93 GLU CA C 93 56.947 57.421 -0.474 1
1 880 . 11 1 1 A 93 93 GLU CB C 93 27.413 28.510 -1.097 1
1 882 . 11 1 1 A 93 93 GLU N N 93 122.247 118.321 3.926 1
1 883 . 11 1 1 A 94 94 GLU H H 94 8.194 7.900 0.294 1
1 884 . 11 1 1 A 94 94 GLU HA H 94 3.940 4.461 -0.521 1
1 889 . 11 1 1 A 94 94 GLU CA C 94 56.681 57.700 -1.019 1
1 890 . 11 1 1 A 94 94 GLU CB C 94 26.127 31.023 -4.896 1
1 892 . 11 1 1 A 94 94 GLU N N 94 118.024 118.967 -0.943 1
1 893 . 11 1 1 A 95 95 GLU H H 95 7.816 8.599 -0.783 1
1 894 . 11 1 1 A 95 95 GLU HA H 95 4.121 4.113 0.008 1
1 898 . 11 1 1 A 95 95 GLU CA C 95 56.162 58.862 -2.700 1
1 899 . 11 1 1 A 95 95 GLU CB C 95 26.403 28.474 -2.071 1
1 901 . 11 1 1 A 95 95 GLU N N 95 120.028 119.913 0.115 1
1 902 . 11 1 1 A 96 96 LEU H H 96 7.637 7.829 -0.192 1
1 903 . 11 1 1 A 96 96 LEU HA H 96 3.988 4.022 -0.034 1
1 913 . 11 1 1 A 96 96 LEU CA C 96 55.303 57.785 -2.482 1
1 914 . 11 1 1 A 96 96 LEU CB C 96 39.038 41.620 -2.582 1
1 918 . 11 1 1 A 96 96 LEU N N 96 119.866 118.218 1.648 1
1 919 . 11 1 1 A 97 97 ILE H H 97 8.044 7.060 0.984 1
1 920 . 11 1 1 A 97 97 ILE HA H 97 3.478 3.924 -0.446 1
1 930 . 11 1 1 A 97 97 ILE CA C 97 62.054 64.075 -2.021 1
1 931 . 11 1 1 A 97 97 ILE CB C 97 34.541 37.997 -3.456 1
1 935 . 11 1 1 A 97 97 ILE N N 97 119.088 119.785 -0.697 1
1 936 . 11 1 1 A 98 98 ARG H H 98 7.991 8.352 -0.361 1
1 937 . 11 1 1 A 98 98 ARG HA H 98 3.793 4.009 -0.216 1
1 944 . 11 1 1 A 98 98 ARG CA C 98 57.509 58.768 -1.259 1
1 945 . 11 1 1 A 98 98 ARG CB C 98 27.191 30.072 -2.881 1
1 948 . 11 1 1 A 98 98 ARG N N 98 119.225 120.927 -1.702 1
1 949 . 11 1 1 A 99 99 LYS H H 99 8.101 8.433 -0.332 1
1 950 . 11 1 1 A 99 99 LYS HA H 99 3.968 4.063 -0.095 1
1 959 . 11 1 1 A 99 99 LYS CA C 99 56.455 59.072 -2.617 1
1 960 . 11 1 1 A 99 99 LYS CB C 99 29.531 32.023 -2.492 1
1 964 . 11 1 1 A 99 99 LYS N N 99 119.464 118.343 1.121 1
1 965 . 11 1 1 A 100 100 ALA H H 100 8.167 7.870 0.297 1
1 966 . 11 1 1 A 100 100 ALA HA H 100 3.789 4.091 -0.302 1
1 970 . 11 1 1 A 100 100 ALA CA C 100 52.451 54.310 -1.859 1
1 971 . 11 1 1 A 100 100 ALA CB C 100 16.259 18.202 -1.943 1
1 972 . 11 1 1 A 100 100 ALA N N 100 122.398 121.556 0.842 1
1 973 . 11 1 1 A 101 101 ILE H H 101 8.777 7.419 1.358 1
1 974 . 11 1 1 A 101 101 ILE HA H 101 3.191 3.753 -0.562 1
1 984 . 11 1 1 A 101 101 ILE CA C 101 62.910 64.179 -1.269 1
1 985 . 11 1 1 A 101 101 ILE CB C 101 34.544 37.460 -2.916 1
1 989 . 11 1 1 A 101 101 ILE N N 101 120.431 117.130 3.301 1
1 990 . 11 1 1 A 102 102 GLU H H 102 7.890 7.702 0.188 1
1 991 . 11 1 1 A 102 102 GLU HA H 102 3.848 4.184 -0.336 1
1 996 . 11 1 1 A 102 102 GLU CA C 102 57.079 58.099 -1.020 1
1 997 . 11 1 1 A 102 102 GLU CB C 102 26.769 29.729 -2.960 1
1 999 . 11 1 1 A 102 102 GLU N N 102 120.248 121.966 -1.718 1
1 1000 . 11 1 1 A 103 103 LEU H H 103 8.194 7.539 0.655 1
1 1001 . 11 1 1 A 103 103 LEU HA H 103 3.912 4.300 -0.388 1
1 1011 . 11 1 1 A 103 103 LEU CA C 103 55.078 56.208 -1.130 1
1 1012 . 11 1 1 A 103 103 LEU CB C 103 38.963 42.484 -3.521 1
1 1016 . 11 1 1 A 103 103 LEU N N 103 120.341 117.887 2.454 1
1 1017 . 11 1 1 A 104 104 SER H H 104 8.268 7.845 0.423 1
1 1018 . 11 1 1 A 104 104 SER HA H 104 4.120 4.478 -0.358 1
1 1021 . 11 1 1 A 104 104 SER CA C 104 58.301 59.178 -0.877 1
1 1022 . 11 1 1 A 104 104 SER CB C 104 60.193 64.096 -3.903 1
1 1023 . 11 1 1 A 104 104 SER N N 104 115.150 116.138 -0.988 1
1 1024 . 11 1 1 A 105 105 LEU H H 105 7.501 7.592 -0.091 1
1 1025 . 11 1 1 A 105 105 LEU HA H 105 4.041 4.137 -0.096 1
1 1035 . 11 1 1 A 105 105 LEU CA C 105 53.995 56.843 -2.848 1
1 1036 . 11 1 1 A 105 105 LEU CB C 105 39.597 41.958 -2.361 1
1 1040 . 11 1 1 A 105 105 LEU N N 105 124.223 119.631 4.592 1
1 1041 . 11 1 1 A 106 106 LYS H H 106 7.542 8.085 -0.543 1
1 1042 . 11 1 1 A 106 106 LYS HA H 106 4.090 3.996 0.094 1
1 1050 . 11 1 1 A 106 106 LYS CA C 106 55.495 58.912 -3.417 1
1 1051 . 11 1 1 A 106 106 LYS CB C 106 29.941 31.817 -1.876 1
1 1055 . 11 1 1 A 106 106 LYS N N 106 120.328 117.958 2.370 1
1 1056 . 11 1 1 A 107 107 GLU H H 107 7.884 7.730 0.154 1
1 1057 . 11 1 1 A 107 107 GLU HA H 107 4.210 4.055 0.155 1
1 1060 . 11 1 1 A 107 107 GLU CA C 107 54.509 58.807 -4.298 1
1 1061 . 11 1 1 A 107 107 GLU CB C 107 27.239 29.642 -2.403 1
1 1062 . 11 1 1 A 107 107 GLU N N 107 118.621 120.370 -1.749 1
1 1063 . 11 1 1 A 108 108 SER H H 108 7.923 7.850 0.073 1
1 1064 . 11 1 1 A 108 108 SER HA H 108 4.385 4.506 -0.121 1
1 1067 . 11 1 1 A 108 108 SER CA C 108 56.442 60.071 -3.629 1
1 1068 . 11 1 1 A 108 108 SER CB C 108 60.953 63.167 -2.214 1
1 1069 . 11 1 1 A 108 108 SER N N 108 115.670 114.917 0.753 1
1 1070 . 11 1 1 A 109 109 ARG H H 109 8.068 8.162 -0.094 1
1 1071 . 11 1 1 A 109 109 ARG HA H 109 4.307 3.800 0.507 1
1 1078 . 11 1 1 A 109 109 ARG CA C 109 53.732 59.547 -5.815 1
1 1079 . 11 1 1 A 109 109 ARG CB C 109 27.968 29.601 -1.633 1
1 1082 . 11 1 1 A 109 109 ARG N N 109 122.313 121.834 0.479 1
1 1083 . 11 1 1 A 110 110 ASN H H 110 8.292 8.435 -0.143 1
1 1084 . 11 1 1 A 110 110 ASN HA H 110 4.720 4.426 0.294 1
1 1087 . 11 1 1 A 110 110 ASN CA C 110 50.750 55.957 -5.207 1
1 1088 . 11 1 1 A 110 110 ASN CB C 110 36.197 37.895 -1.698 1
1 1089 . 11 1 1 A 110 110 ASN N N 110 119.304 116.134 3.170 1
1 1090 . 11 1 1 A 111 111 SER H H 111 8.244 8.281 -0.037 1
1 1091 . 11 1 1 A 111 111 SER HA H 111 4.423 4.212 0.211 1
1 1094 . 11 1 1 A 111 111 SER CA C 111 55.990 61.223 -5.233 1
1 1095 . 11 1 1 A 111 111 SER CB C 111 61.027 62.310 -1.283 1
1 1096 . 11 1 1 A 111 111 SER N N 111 116.119 114.783 1.336 1
1 1097 . 11 1 1 A 112 112 GLY H H 112 8.327 8.457 -0.130 1
1 1098 . 11 1 1 A 112 112 GLY HA2 H 112 3.944 3.589 0.355 1
1 1099 . 11 1 1 A 112 112 GLY HA3 H 112 3.912 3.826 0.086 1
1 1100 . 11 1 1 A 112 112 GLY CA C 112 42.733 47.265 -4.532 1
1 1101 . 11 1 1 A 112 112 GLY N N 112 110.442 109.933 0.509 1
1 1102 . 11 1 1 A 113 113 GLY H H 113 8.097 7.978 0.119 1
1 1103 . 11 1 1 A 113 113 GLY HA2 H 113 3.831 3.496 0.335 1
1 1104 . 11 1 1 A 113 113 GLY HA3 H 113 3.785 3.693 0.092 1
1 1105 . 11 1 1 A 113 113 GLY CA C 113 42.435 44.899 -2.464 1
1 1106 . 11 1 1 A 113 113 GLY N N 113 108.745 108.573 0.172 1
1 2 . 12 1 1 A 3 3 HIS CB C 3 33.709 30.966 2.743 1
1 3 . 12 1 1 A 7 7 HIS H H 7 8.731 8.164 0.567 1
1 4 . 12 1 1 A 7 7 HIS HA H 7 4.564 4.205 0.359 1
1 7 . 12 1 1 A 7 7 HIS CA C 7 53.649 55.049 -1.400 1
1 8 . 12 1 1 A 7 7 HIS CB C 7 26.268 30.241 -3.973 1
1 9 . 12 1 1 A 7 7 HIS N N 7 121.126 120.062 1.064 1
1 10 . 12 1 1 A 8 8 GLY H H 8 8.540 8.375 0.165 1
1 11 . 12 1 1 A 8 8 GLY HA2 H 8 3.973 3.836 0.137 1
1 12 . 12 1 1 A 8 8 GLY HA3 H 8 3.811 3.876 -0.065 1
1 13 . 12 1 1 A 8 8 GLY CA C 8 42.618 44.386 -1.768 1
1 14 . 12 1 1 A 8 8 GLY N N 8 110.662 108.679 1.983 1
1 15 . 12 1 1 A 9 9 GLU H H 9 8.239 8.434 -0.195 1
1 16 . 12 1 1 A 9 9 GLU HA H 9 4.568 4.197 0.371 1
1 18 . 12 1 1 A 9 9 GLU CA C 9 53.605 54.635 -1.030 1
1 19 . 12 1 1 A 9 9 GLU CB C 9 28.019 31.937 -3.918 1
1 20 . 12 1 1 A 9 9 GLU N N 9 121.669 119.425 2.244 1
1 21 . 12 1 1 A 10 10 PHE H H 10 8.785 7.769 1.016 1
1 22 . 12 1 1 A 10 10 PHE HA H 10 4.850 5.265 -0.415 1
1 25 . 12 1 1 A 10 10 PHE CA C 10 52.630 56.126 -3.496 1
1 26 . 12 1 1 A 10 10 PHE CB C 10 37.906 41.090 -3.184 1
1 27 . 12 1 1 A 10 10 PHE N N 10 118.401 118.136 0.265 1
1 28 . 12 1 1 A 11 11 GLN H H 11 8.552 9.318 -0.766 1
1 29 . 12 1 1 A 11 11 GLN HA H 11 5.425 5.448 -0.023 1
1 34 . 12 1 1 A 11 11 GLN CA C 11 51.663 54.089 -2.426 1
1 35 . 12 1 1 A 11 11 GLN CB C 11 28.427 31.138 -2.711 1
1 37 . 12 1 1 A 11 11 GLN N N 11 117.519 122.247 -4.728 1
1 38 . 12 1 1 A 12 12 ILE H H 12 8.239 8.378 -0.139 1
1 39 . 12 1 1 A 12 12 ILE HA H 12 4.103 4.870 -0.767 1
1 49 . 12 1 1 A 12 12 ILE CA C 12 57.134 59.714 -2.580 1
1 50 . 12 1 1 A 12 12 ILE CB C 12 39.491 39.984 -0.493 1
1 54 . 12 1 1 A 12 12 ILE N N 12 114.043 121.521 -7.478 1
1 55 . 12 1 1 A 13 13 PHE H H 13 8.538 8.688 -0.150 1
1 56 . 12 1 1 A 13 13 PHE HA H 13 5.620 5.368 0.252 1
1 59 . 12 1 1 A 13 13 PHE CA C 13 52.438 56.288 -3.850 1
1 60 . 12 1 1 A 13 13 PHE CB C 13 39.253 42.143 -2.890 1
1 61 . 12 1 1 A 13 13 PHE N N 13 117.015 119.656 -2.641 1
1 62 . 12 1 1 A 14 14 ALA H H 14 9.238 9.520 -0.282 1
1 63 . 12 1 1 A 14 14 ALA HA H 14 5.311 5.332 -0.021 1
1 67 . 12 1 1 A 14 14 ALA CA C 14 47.183 49.925 -2.742 1
1 68 . 12 1 1 A 14 14 ALA CB C 14 17.811 22.246 -4.435 1
1 69 . 12 1 1 A 14 14 ALA N N 14 123.503 125.928 -2.425 1
1 70 . 12 1 1 A 15 15 LYS H H 15 8.810 8.995 -0.185 1
1 71 . 12 1 1 A 15 15 LYS HA H 15 5.511 5.513 -0.002 1
1 80 . 12 1 1 A 15 15 LYS CA C 15 51.718 54.461 -2.743 1
1 81 . 12 1 1 A 15 15 LYS CB C 15 33.635 35.869 -2.234 1
1 85 . 12 1 1 A 15 15 LYS N N 15 123.382 122.572 0.810 1
1 86 . 12 1 1 A 16 16 THR H H 16 8.830 8.548 0.282 1
1 87 . 12 1 1 A 16 16 THR HA H 16 5.212 5.214 -0.002 1
1 92 . 12 1 1 A 16 16 THR CA C 16 57.614 59.524 -1.910 1
1 93 . 12 1 1 A 16 16 THR CB C 16 68.210 72.044 -3.834 1
1 95 . 12 1 1 A 16 16 THR N N 16 116.517 116.003 0.514 1
1 96 . 12 1 1 A 17 17 LEU H H 17 9.428 8.809 0.619 1
1 97 . 12 1 1 A 17 17 LEU HA H 17 4.286 4.252 0.034 1
1 107 . 12 1 1 A 17 17 LEU CA C 17 54.504 56.960 -2.456 1
1 108 . 12 1 1 A 17 17 LEU CB C 17 38.564 42.023 -3.459 1
1 112 . 12 1 1 A 17 17 LEU N N 17 121.786 123.843 -2.057 1
1 113 . 12 1 1 A 18 18 THR H H 18 7.546 7.695 -0.149 1
1 114 . 12 1 1 A 18 18 THR HA H 18 4.391 4.583 -0.192 1
1 119 . 12 1 1 A 18 18 THR CA C 18 58.524 62.059 -3.535 1
1 120 . 12 1 1 A 18 18 THR CB C 18 66.166 71.175 -5.009 1
1 122 . 12 1 1 A 18 18 THR N N 18 105.598 108.199 -2.601 1
1 123 . 12 1 1 A 19 19 GLY H H 19 7.683 8.084 -0.401 1
1 124 . 12 1 1 A 19 19 GLY HA2 H 19 3.300 3.978 -0.678 1
1 125 . 12 1 1 A 19 19 GLY HA3 H 19 4.248 3.988 0.260 1
1 126 . 12 1 1 A 19 19 GLY CA C 19 42.947 46.011 -3.064 1
1 127 . 12 1 1 A 19 19 GLY N N 19 109.243 111.753 -2.510 1
1 128 . 12 1 1 A 20 20 LYS H H 20 7.375 7.760 -0.385 1
1 129 . 12 1 1 A 20 20 LYS HA H 20 4.331 4.727 -0.396 1
1 138 . 12 1 1 A 20 20 LYS CA C 20 53.829 54.962 -1.133 1
1 139 . 12 1 1 A 20 20 LYS CB C 20 30.385 34.579 -4.194 1
1 143 . 12 1 1 A 20 20 LYS N N 20 122.757 120.402 2.355 1
1 144 . 12 1 1 A 21 21 THR H H 21 8.637 9.004 -0.367 1
1 145 . 12 1 1 A 21 21 THR HA H 21 4.852 4.937 -0.085 1
1 150 . 12 1 1 A 21 21 THR CA C 21 59.846 62.530 -2.684 1
1 151 . 12 1 1 A 21 21 THR CB C 21 67.140 69.310 -2.170 1
1 153 . 12 1 1 A 21 21 THR N N 21 121.524 123.051 -1.527 1
1 154 . 12 1 1 A 22 22 ILE H H 22 9.509 9.524 -0.015 1
1 155 . 12 1 1 A 22 22 ILE HA H 22 4.349 4.884 -0.535 1
1 165 . 12 1 1 A 22 22 ILE CA C 22 57.634 59.630 -1.996 1
1 166 . 12 1 1 A 22 22 ILE CB C 22 38.334 40.620 -2.286 1
1 170 . 12 1 1 A 22 22 ILE N N 22 129.772 128.286 1.486 1
1 171 . 12 1 1 A 23 23 THR H H 23 8.838 8.690 0.148 1
1 172 . 12 1 1 A 23 23 THR HA H 23 4.653 4.582 0.071 1
1 177 . 12 1 1 A 23 23 THR CA C 23 60.194 61.665 -1.471 1
1 178 . 12 1 1 A 23 23 THR CB C 23 66.577 69.620 -3.043 1
1 180 . 12 1 1 A 23 23 THR N N 23 124.070 123.986 0.084 1
1 181 . 12 1 1 A 24 24 LEU H H 24 8.749 8.575 0.174 1
1 182 . 12 1 1 A 24 24 LEU HA H 24 4.619 5.000 -0.381 1
1 192 . 12 1 1 A 24 24 LEU CA C 24 50.257 52.773 -2.516 1
1 193 . 12 1 1 A 24 24 LEU CB C 24 42.932 45.416 -2.484 1
1 197 . 12 1 1 A 24 24 LEU N N 24 126.499 123.699 2.800 1
1 198 . 12 1 1 A 25 25 GLU H H 25 7.990 8.702 -0.712 1
1 199 . 12 1 1 A 25 25 GLU HA H 25 4.591 4.516 0.075 1
1 204 . 12 1 1 A 25 25 GLU CA C 25 52.845 55.979 -3.134 1
1 205 . 12 1 1 A 25 25 GLU CB C 25 27.210 29.229 -2.019 1
1 207 . 12 1 1 A 25 25 GLU N N 25 121.644 122.172 -0.528 1
1 208 . 12 1 1 A 26 26 VAL H H 26 8.657 8.305 0.352 1
1 209 . 12 1 1 A 26 26 VAL HA H 26 4.403 5.083 -0.680 1
1 217 . 12 1 1 A 26 26 VAL CA C 26 56.020 58.861 -2.841 1
1 218 . 12 1 1 A 26 26 VAL CB C 26 33.631 34.842 -1.211 1
1 221 . 12 1 1 A 26 26 VAL N N 26 116.647 121.011 -4.364 1
1 222 . 12 1 1 A 27 27 GLU H H 27 7.970 8.783 -0.813 1
1 223 . 12 1 1 A 27 27 GLU HA H 27 4.447 4.541 -0.094 1
1 228 . 12 1 1 A 27 27 GLU CA C 27 51.386 55.292 -3.906 1
1 229 . 12 1 1 A 27 27 GLU CB C 27 30.905 30.875 0.030 1
1 231 . 12 1 1 A 27 27 GLU N N 27 115.496 121.303 -5.807 1
1 232 . 12 1 1 A 28 28 SER H H 28 9.192 8.825 0.367 1
1 233 . 12 1 1 A 28 28 SER HA H 28 4.108 4.125 -0.017 1
1 236 . 12 1 1 A 28 28 SER CA C 28 59.909 60.941 -1.032 1
1 237 . 12 1 1 A 28 28 SER CB C 28 60.399 62.554 -2.155 1
1 238 . 12 1 1 A 28 28 SER N N 28 117.720 118.778 -1.058 1
1 239 . 12 1 1 A 29 29 SER H H 29 7.371 7.801 -0.430 1
1 240 . 12 1 1 A 29 29 SER HA H 29 4.327 4.623 -0.296 1
1 243 . 12 1 1 A 29 29 SER CA C 29 54.805 57.374 -2.569 1
1 244 . 12 1 1 A 29 29 SER CB C 29 60.775 63.770 -2.995 1
1 245 . 12 1 1 A 29 29 SER N N 29 108.936 114.729 -5.793 1
1 246 . 12 1 1 A 30 30 ASP H H 30 7.852 7.577 0.275 1
1 247 . 12 1 1 A 30 30 ASP HA H 30 4.591 4.531 0.060 1
1 250 . 12 1 1 A 30 30 ASP CA C 30 53.040 54.663 -1.623 1
1 251 . 12 1 1 A 30 30 ASP CB C 30 37.942 41.533 -3.591 1
1 252 . 12 1 1 A 30 30 ASP N N 30 123.735 121.395 2.340 1
1 253 . 12 1 1 A 31 31 THR H H 31 7.852 8.520 -0.668 1
1 254 . 12 1 1 A 31 31 THR HA H 31 4.918 4.920 -0.002 1
1 259 . 12 1 1 A 31 31 THR CA C 31 56.929 60.228 -3.299 1
1 260 . 12 1 1 A 31 31 THR CB C 31 68.674 71.449 -2.775 1
1 262 . 12 1 1 A 31 31 THR N N 31 109.181 113.124 -3.943 1
1 263 . 12 1 1 A 32 32 ILE H H 32 8.582 8.795 -0.213 1
1 264 . 12 1 1 A 32 32 ILE HA H 32 3.624 3.794 -0.170 1
1 274 . 12 1 1 A 32 32 ILE CA C 32 59.474 65.501 -6.027 1
1 275 . 12 1 1 A 32 32 ILE CB C 32 31.561 37.626 -6.065 1
1 279 . 12 1 1 A 32 32 ILE N N 32 121.833 122.861 -1.028 1
1 280 . 12 1 1 A 33 33 ASP H H 33 9.255 7.739 1.516 1
1 281 . 12 1 1 A 33 33 ASP HA H 33 4.201 4.258 -0.057 1
1 284 . 12 1 1 A 33 33 ASP CA C 33 54.679 57.824 -3.145 1
1 285 . 12 1 1 A 33 33 ASP CB C 33 37.700 41.671 -3.971 1
1 286 . 12 1 1 A 33 33 ASP N N 33 119.823 120.561 -0.738 1
1 287 . 12 1 1 A 34 34 ASN H H 34 8.026 7.722 0.304 1
1 288 . 12 1 1 A 34 34 ASN HA H 34 4.409 4.698 -0.289 1
1 291 . 12 1 1 A 34 34 ASN CA C 34 53.324 56.523 -3.199 1
1 292 . 12 1 1 A 34 34 ASN CB C 34 35.782 38.456 -2.674 1
1 293 . 12 1 1 A 34 34 ASN N N 34 119.540 117.757 1.783 1
1 294 . 12 1 1 A 35 35 VAL H H 35 8.167 8.070 0.097 1
1 295 . 12 1 1 A 35 35 VAL HA H 35 3.249 3.450 -0.201 1
1 303 . 12 1 1 A 35 35 VAL CA C 35 65.308 67.295 -1.987 1
1 304 . 12 1 1 A 35 35 VAL CB C 35 27.965 31.444 -3.479 1
1 307 . 12 1 1 A 35 35 VAL N N 35 122.223 120.711 1.512 1
1 308 . 12 1 1 A 36 36 LYS H H 36 8.460 8.293 0.167 1
1 313 . 12 1 1 A 36 36 LYS CB C 36 30.753 32.300 -1.547 1
1 315 . 12 1 1 A 36 36 LYS N N 36 119.438 119.230 0.208 1
1 316 . 12 1 1 A 37 37 SER H H 37 8.196 8.796 -0.600 1
1 317 . 12 1 1 A 37 37 SER HA H 37 4.130 4.221 -0.091 1
1 320 . 12 1 1 A 37 37 SER CA C 37 58.528 61.205 -2.677 1
1 321 . 12 1 1 A 37 37 SER CB C 37 59.768 62.651 -2.883 1
1 322 . 12 1 1 A 37 37 SER N N 37 117.791 114.285 3.506 1
1 323 . 12 1 1 A 38 38 LYS H H 38 8.043 8.394 -0.351 1
1 324 . 12 1 1 A 38 38 LYS HA H 38 4.095 4.022 0.073 1
1 325 . 12 1 1 A 38 38 LYS CA C 38 57.377 58.965 -1.588 1
1 326 . 12 1 1 A 38 38 LYS N N 38 124.094 120.584 3.510 1
1 327 . 12 1 1 A 39 39 ILE H H 39 8.254 7.944 0.310 1
1 328 . 12 1 1 A 39 39 ILE HA H 39 3.439 3.745 -0.306 1
1 338 . 12 1 1 A 39 39 ILE CA C 39 63.977 64.615 -0.638 1
1 339 . 12 1 1 A 39 39 ILE CB C 39 33.935 37.511 -3.576 1
1 343 . 12 1 1 A 39 39 ILE N N 39 122.107 120.487 1.620 1
1 344 . 12 1 1 A 40 40 GLN H H 40 8.379 8.530 -0.151 1
1 345 . 12 1 1 A 40 40 GLN HA H 40 3.746 4.043 -0.297 1
1 350 . 12 1 1 A 40 40 GLN CA C 40 57.472 58.157 -0.685 1
1 351 . 12 1 1 A 40 40 GLN CB C 40 25.072 28.020 -2.948 1
1 353 . 12 1 1 A 40 40 GLN N N 40 123.725 120.283 3.442 1
1 354 . 12 1 1 A 41 41 ASP H H 41 8.210 7.995 0.215 1
1 355 . 12 1 1 A 41 41 ASP HA H 41 4.247 4.391 -0.144 1
1 358 . 12 1 1 A 41 41 ASP CA C 41 54.646 56.720 -2.074 1
1 359 . 12 1 1 A 41 41 ASP CB C 41 38.136 40.922 -2.786 1
1 360 . 12 1 1 A 41 41 ASP N N 41 120.564 120.666 -0.102 1
1 361 . 12 1 1 A 42 42 LYS H H 42 7.381 7.845 -0.464 1
1 362 . 12 1 1 A 42 42 LYS HA H 42 4.246 4.330 -0.084 1
1 369 . 12 1 1 A 42 42 LYS CA C 42 55.579 57.716 -2.137 1
1 370 . 12 1 1 A 42 42 LYS CB C 42 31.406 33.410 -2.004 1
1 373 . 12 1 1 A 42 42 LYS N N 42 115.674 116.706 -1.032 1
1 374 . 12 1 1 A 43 43 GLU H H 43 8.537 8.802 -0.265 1
1 375 . 12 1 1 A 43 43 GLU HA H 43 4.522 4.512 0.010 1
1 380 . 12 1 1 A 43 43 GLU CA C 43 52.772 55.766 -2.994 1
1 381 . 12 1 1 A 43 43 GLU CB C 43 30.535 31.068 -0.533 1
1 383 . 12 1 1 A 43 43 GLU N N 43 114.355 116.155 -1.800 1
1 384 . 12 1 1 A 44 44 GLY H H 44 8.611 8.461 0.150 1
1 385 . 12 1 1 A 44 44 GLY HA2 H 44 4.067 3.967 0.100 1
1 386 . 12 1 1 A 44 44 GLY HA3 H 44 3.819 3.968 -0.149 1
1 387 . 12 1 1 A 44 44 GLY CA C 44 43.205 45.548 -2.343 1
1 388 . 12 1 1 A 44 44 GLY N N 44 109.406 108.586 0.820 1
1 389 . 12 1 1 A 45 45 ILE H H 45 6.092 8.107 -2.015 1
1 390 . 12 1 1 A 45 45 ILE HA H 45 4.324 4.121 0.203 1
1 400 . 12 1 1 A 45 45 ILE CA C 45 55.211 60.139 -4.928 1
1 401 . 12 1 1 A 45 45 ILE CB C 45 37.903 38.279 -0.376 1
1 405 . 12 1 1 A 45 45 ILE N N 45 120.791 122.487 -1.696 1
1 406 . 12 1 1 A 46 46 PRO HA H 46 4.547 4.557 -0.010 1
1 413 . 12 1 1 A 46 46 PRO CA C 46 58.971 62.042 -3.071 1
1 414 . 12 1 1 A 46 46 PRO CB C 46 29.142 32.385 -3.243 1
1 417 . 12 1 1 A 47 47 PRO HA H 47 4.062 4.212 -0.150 1
1 424 . 12 1 1 A 47 47 PRO CA C 47 63.476 65.754 -2.278 1
1 425 . 12 1 1 A 47 47 PRO CB C 47 30.113 31.804 -1.691 1
1 428 . 12 1 1 A 48 48 ASP H H 48 8.418 8.515 -0.097 1
1 429 . 12 1 1 A 48 48 ASP HA H 48 4.346 4.429 -0.083 1
1 432 . 12 1 1 A 48 48 ASP CA C 48 52.838 56.126 -3.288 1
1 433 . 12 1 1 A 48 48 ASP CB C 48 36.926 40.055 -3.129 1
1 434 . 12 1 1 A 48 48 ASP N N 48 113.462 116.945 -3.483 1
1 435 . 12 1 1 A 49 49 GLN H H 49 7.822 7.775 0.047 1
1 436 . 12 1 1 A 49 49 GLN HA H 49 4.283 4.200 0.083 1
1 439 . 12 1 1 A 49 49 GLN CA C 49 52.770 57.336 -4.566 1
1 441 . 12 1 1 A 49 49 GLN N N 49 117.377 118.158 -0.781 1
1 442 . 12 1 1 A 50 50 GLN H H 50 7.451 7.641 -0.190 1
1 443 . 12 1 1 A 50 50 GLN HA H 50 4.260 4.968 -0.708 1
1 448 . 12 1 1 A 50 50 GLN CA C 50 53.725 54.363 -0.638 1
1 449 . 12 1 1 A 50 50 GLN CB C 50 29.142 33.104 -3.962 1
1 451 . 12 1 1 A 50 50 GLN N N 50 117.526 118.110 -0.584 1
1 452 . 12 1 1 A 51 51 ARG H H 51 8.534 8.640 -0.106 1
1 453 . 12 1 1 A 51 51 ARG HA H 51 4.486 5.239 -0.753 1
1 460 . 12 1 1 A 51 51 ARG CA C 51 52.492 54.318 -1.826 1
1 461 . 12 1 1 A 51 51 ARG CB C 51 29.096 34.859 -5.763 1
1 464 . 12 1 1 A 51 51 ARG N N 51 121.655 119.847 1.808 1
1 465 . 12 1 1 A 52 52 LEU H H 52 8.683 8.937 -0.254 1
1 466 . 12 1 1 A 52 52 LEU HA H 52 5.255 5.052 0.203 1
1 476 . 12 1 1 A 52 52 LEU CA C 52 50.618 53.798 -3.180 1
1 477 . 12 1 1 A 52 52 LEU CB C 52 43.007 44.156 -1.149 1
1 481 . 12 1 1 A 52 52 LEU N N 52 122.929 122.007 0.922 1
1 482 . 12 1 1 A 53 53 ILE H H 53 9.286 9.085 0.201 1
1 483 . 12 1 1 A 53 53 ILE HA H 53 5.096 4.881 0.215 1
1 492 . 12 1 1 A 53 53 ILE CA C 53 56.795 60.694 -3.899 1
1 496 . 12 1 1 A 53 53 ILE N N 53 124.718 127.038 -2.320 1
1 497 . 12 1 1 A 54 54 TRP H H 54 8.871 8.955 -0.084 1
1 499 . 12 1 1 A 54 54 TRP N N 54 127.412 128.520 -1.108 1
1 501 . 12 1 1 A 55 55 ALA H H 55 8.401 8.192 0.209 1
1 502 . 12 1 1 A 55 55 ALA HA H 55 3.183 3.367 -0.184 1
1 506 . 12 1 1 A 55 55 ALA CA C 55 49.712 52.612 -2.900 1
1 507 . 12 1 1 A 55 55 ALA CB C 55 13.252 17.156 -3.904 1
1 508 . 12 1 1 A 55 55 ALA N N 55 128.894 129.938 -1.044 1
1 509 . 12 1 1 A 56 56 GLY H H 56 8.248 8.383 -0.135 1
1 510 . 12 1 1 A 56 56 GLY HA2 H 56 3.968 3.748 0.220 1
1 511 . 12 1 1 A 56 56 GLY HA3 H 56 3.916 3.762 0.154 1
1 512 . 12 1 1 A 56 56 GLY CA C 56 43.142 45.696 -2.554 1
1 513 . 12 1 1 A 56 56 GLY N N 56 101.499 102.524 -1.025 1
1 514 . 12 1 1 A 57 57 LYS H H 57 8.028 7.362 0.666 1
1 515 . 12 1 1 A 57 57 LYS HA H 57 4.609 4.724 -0.115 1
1 522 . 12 1 1 A 57 57 LYS CA C 57 51.928 54.653 -2.725 1
1 523 . 12 1 1 A 57 57 LYS CB C 57 32.613 35.433 -2.820 1
1 526 . 12 1 1 A 57 57 LYS N N 57 118.995 120.796 -1.801 1
1 527 . 12 1 1 A 58 58 GLN H H 58 8.607 8.410 0.197 1
1 528 . 12 1 1 A 58 58 GLN HA H 58 4.617 4.646 -0.029 1
1 533 . 12 1 1 A 58 58 GLN CA C 58 53.261 55.797 -2.536 1
1 534 . 12 1 1 A 58 58 GLN CB C 58 26.613 29.324 -2.711 1
1 536 . 12 1 1 A 58 58 GLN N N 58 119.825 124.996 -5.171 1
1 537 . 12 1 1 A 59 59 LEU H H 59 8.653 8.986 -0.333 1
1 538 . 12 1 1 A 59 59 LEU HA H 59 4.138 4.541 -0.403 1
1 548 . 12 1 1 A 59 59 LEU CA C 59 51.991 54.084 -2.093 1
1 549 . 12 1 1 A 59 59 LEU CB C 59 39.006 42.733 -3.727 1
1 553 . 12 1 1 A 59 59 LEU N N 59 125.484 124.872 0.612 1
1 554 . 12 1 1 A 60 60 GLU H H 60 8.461 8.988 -0.527 1
1 555 . 12 1 1 A 60 60 GLU HA H 60 4.371 4.403 -0.032 1
1 559 . 12 1 1 A 60 60 GLU CA C 60 53.436 56.011 -2.575 1
1 560 . 12 1 1 A 60 60 GLU CB C 60 29.057 30.303 -1.246 1
1 562 . 12 1 1 A 60 60 GLU N N 60 123.237 121.731 1.506 1
1 563 . 12 1 1 A 61 61 ASP H H 61 8.076 8.856 -0.780 1
1 564 . 12 1 1 A 61 61 ASP HA H 61 4.265 4.369 -0.104 1
1 567 . 12 1 1 A 61 61 ASP CA C 61 54.398 56.284 -1.886 1
1 568 . 12 1 1 A 61 61 ASP CB C 61 38.340 40.073 -1.733 1
1 569 . 12 1 1 A 61 61 ASP N N 61 120.701 123.940 -3.239 1
1 570 . 12 1 1 A 62 62 GLY HA2 H 62 4.104 3.982 0.122 1
1 571 . 12 1 1 A 62 62 GLY HA3 H 62 3.832 3.983 -0.151 1
1 572 . 12 1 1 A 62 62 GLY CA C 62 42.576 45.344 -2.768 1
1 573 . 12 1 1 A 63 63 ARG H H 63 7.319 8.364 -1.045 1
1 574 . 12 1 1 A 63 63 ARG HA H 63 4.595 4.501 0.094 1
1 579 . 12 1 1 A 63 63 ARG CA C 63 51.971 55.614 -3.643 1
1 582 . 12 1 1 A 63 63 ARG N N 63 119.206 120.503 -1.297 1
1 583 . 12 1 1 A 64 64 THR H H 64 8.735 8.452 0.283 1
1 584 . 12 1 1 A 64 64 THR HA H 64 5.208 5.070 0.138 1
1 589 . 12 1 1 A 64 64 THR CA C 64 57.126 59.530 -2.404 1
1 590 . 12 1 1 A 64 64 THR CB C 64 69.885 71.876 -1.991 1
1 592 . 12 1 1 A 64 64 THR N N 64 108.713 110.954 -2.241 1
1 593 . 12 1 1 A 65 65 LEU H H 65 8.241 9.547 -1.306 1
1 594 . 12 1 1 A 65 65 LEU HA H 65 4.003 3.971 0.032 1
1 604 . 12 1 1 A 65 65 LEU CA C 65 56.409 58.001 -1.592 1
1 605 . 12 1 1 A 65 65 LEU CB C 65 37.179 41.335 -4.156 1
1 609 . 12 1 1 A 65 65 LEU N N 65 118.111 122.413 -4.302 1
1 610 . 12 1 1 A 66 66 SER H H 66 8.296 7.981 0.315 1
1 611 . 12 1 1 A 66 66 SER HA H 66 4.201 4.247 -0.046 1
1 614 . 12 1 1 A 66 66 SER CA C 66 58.454 60.815 -2.361 1
1 615 . 12 1 1 A 66 66 SER CB C 66 59.969 62.898 -2.929 1
1 616 . 12 1 1 A 66 66 SER N N 66 113.148 114.370 -1.222 1
1 617 . 12 1 1 A 67 67 ASP H H 67 7.984 8.295 -0.311 1
1 618 . 12 1 1 A 67 67 ASP HA H 67 4.187 4.298 -0.111 1
1 621 . 12 1 1 A 67 67 ASP CA C 67 54.744 57.322 -2.578 1
1 622 . 12 1 1 A 67 67 ASP CB C 67 37.794 41.722 -3.928 1
1 623 . 12 1 1 A 67 67 ASP N N 67 124.130 121.665 2.465 1
1 624 . 12 1 1 A 68 68 TYR H H 68 7.177 7.897 -0.720 1
1 625 . 12 1 1 A 68 68 TYR N N 68 115.334 120.828 -5.494 1
1 626 . 12 1 1 A 69 69 ASN H H 69 8.111 8.038 0.073 1
1 627 . 12 1 1 A 69 69 ASN HA H 69 4.253 4.306 -0.053 1
1 630 . 12 1 1 A 69 69 ASN CA C 69 51.386 54.306 -2.920 1
1 631 . 12 1 1 A 69 69 ASN CB C 69 34.867 36.279 -1.412 1
1 632 . 12 1 1 A 69 69 ASN N N 69 116.867 116.600 0.267 1
1 633 . 12 1 1 A 70 70 ILE H H 70 7.460 8.305 -0.845 1
1 634 . 12 1 1 A 70 70 ILE HA H 70 3.210 4.074 -0.864 1
1 644 . 12 1 1 A 70 70 ILE CA C 70 60.157 61.109 -0.952 1
1 645 . 12 1 1 A 70 70 ILE CB C 70 34.754 38.253 -3.499 1
1 649 . 12 1 1 A 70 70 ILE N N 70 119.821 119.295 0.526 1
1 650 . 12 1 1 A 71 71 GLN H H 71 7.368 8.324 -0.956 1
1 651 . 12 1 1 A 71 71 GLN HA H 71 4.099 4.686 -0.587 1
1 656 . 12 1 1 A 71 71 GLN CA C 71 50.906 53.726 -2.820 1
1 657 . 12 1 1 A 71 71 GLN CB C 71 28.793 31.753 -2.960 1
1 659 . 12 1 1 A 71 71 GLN N N 71 124.287 125.225 -0.938 1
1 660 . 12 1 1 A 72 72 ARG H H 72 7.583 9.012 -1.429 1
1 661 . 12 1 1 A 72 72 ARG HA H 72 3.907 4.162 -0.255 1
1 668 . 12 1 1 A 72 72 ARG CA C 72 54.527 59.412 -4.885 1
1 669 . 12 1 1 A 72 72 ARG CB C 72 27.470 29.997 -2.527 1
1 672 . 12 1 1 A 72 72 ARG N N 72 119.007 121.840 -2.833 1
1 673 . 12 1 1 A 73 73 GLU H H 73 9.262 7.758 1.504 1
1 674 . 12 1 1 A 73 73 GLU HA H 73 3.586 4.320 -0.734 1
1 679 . 12 1 1 A 73 73 GLU CA C 73 55.703 56.434 -0.731 1
1 680 . 12 1 1 A 73 73 GLU CB C 73 23.669 29.359 -5.690 1
1 682 . 12 1 1 A 73 73 GLU N N 73 115.180 118.039 -2.859 1
1 683 . 12 1 1 A 74 74 SER H H 74 7.551 7.805 -0.254 1
1 684 . 12 1 1 A 74 74 SER HA H 74 4.613 4.862 -0.249 1
1 687 . 12 1 1 A 74 74 SER CA C 74 58.305 56.265 2.040 1
1 688 . 12 1 1 A 74 74 SER CB C 74 62.156 65.535 -3.379 1
1 689 . 12 1 1 A 74 74 SER N N 74 115.104 116.450 -1.346 1
1 690 . 12 1 1 A 75 75 THR H H 75 8.785 8.678 0.107 1
1 691 . 12 1 1 A 75 75 THR HA H 75 5.014 4.800 0.214 1
1 696 . 12 1 1 A 75 75 THR CA C 75 59.835 62.021 -2.186 1
1 697 . 12 1 1 A 75 75 THR CB C 75 67.258 69.255 -1.997 1
1 699 . 12 1 1 A 75 75 THR N N 75 118.401 121.895 -3.494 1
1 700 . 12 1 1 A 76 76 LEU H H 76 9.447 9.811 -0.364 1
1 701 . 12 1 1 A 76 76 LEU HA H 76 4.930 4.616 0.314 1
1 711 . 12 1 1 A 76 76 LEU CA C 76 51.107 54.307 -3.200 1
1 712 . 12 1 1 A 76 76 LEU CB C 76 40.841 42.752 -1.911 1
1 716 . 12 1 1 A 76 76 LEU N N 76 127.905 128.282 -0.377 1
1 717 . 12 1 1 A 77 77 HIS HA H 77 4.976 5.171 -0.195 1
1 720 . 12 1 1 A 77 77 HIS CA C 77 53.776 54.232 -0.456 1
1 721 . 12 1 1 A 77 77 HIS CB C 77 28.438 31.627 -3.189 1
1 722 . 12 1 1 A 78 78 LEU H H 78 8.450 9.762 -1.312 1
1 723 . 12 1 1 A 78 78 LEU HA H 78 5.085 5.065 0.020 1
1 733 . 12 1 1 A 78 78 LEU CA C 78 50.896 53.900 -3.004 1
1 734 . 12 1 1 A 78 78 LEU CB C 78 41.916 45.093 -3.177 1
1 738 . 12 1 1 A 78 78 LEU N N 78 126.178 126.288 -0.110 1
1 739 . 12 1 1 A 79 79 VAL H H 79 9.093 9.710 -0.617 1
1 740 . 12 1 1 A 79 79 VAL HA H 79 4.053 4.650 -0.597 1
1 748 . 12 1 1 A 79 79 VAL CA C 79 59.054 61.400 -2.346 1
1 749 . 12 1 1 A 79 79 VAL CB C 79 32.115 32.663 -0.548 1
1 752 . 12 1 1 A 79 79 VAL N N 79 128.372 127.032 1.340 1
1 753 . 12 1 1 A 80 80 LEU H H 80 8.000 8.911 -0.911 1
1 754 . 12 1 1 A 80 80 LEU HA H 80 5.105 4.614 0.491 1
1 764 . 12 1 1 A 80 80 LEU CA C 80 50.556 54.388 -3.832 1
1 765 . 12 1 1 A 80 80 LEU CB C 80 39.597 41.177 -1.580 1
1 769 . 12 1 1 A 80 80 LEU N N 80 126.145 129.554 -3.409 1
1 770 . 12 1 1 A 81 81 ARG H H 81 8.470 8.714 -0.244 1
1 771 . 12 1 1 A 81 81 ARG HA H 81 4.197 4.510 -0.313 1
1 778 . 12 1 1 A 81 81 ARG CA C 81 53.133 56.404 -3.271 1
1 779 . 12 1 1 A 81 81 ARG CB C 81 28.413 30.935 -2.522 1
1 782 . 12 1 1 A 81 81 ARG N N 81 121.625 126.525 -4.900 1
1 783 . 12 1 1 A 82 82 LEU H H 82 8.454 8.704 -0.250 1
1 784 . 12 1 1 A 82 82 LEU HA H 82 4.339 4.443 -0.104 1
1 794 . 12 1 1 A 82 82 LEU CA C 82 52.081 54.481 -2.400 1
1 795 . 12 1 1 A 82 82 LEU CB C 82 39.810 41.598 -1.788 1
1 799 . 12 1 1 A 82 82 LEU N N 82 123.832 126.837 -3.005 1
1 800 . 12 1 1 A 83 83 ARG H H 83 8.404 8.595 -0.191 1
1 801 . 12 1 1 A 83 83 ARG HA H 83 4.308 4.108 0.200 1
1 808 . 12 1 1 A 83 83 ARG CA C 83 53.258 57.788 -4.530 1
1 809 . 12 1 1 A 83 83 ARG CB C 83 28.160 29.853 -1.693 1
1 812 . 12 1 1 A 83 83 ARG N N 83 121.447 122.640 -1.193 1
1 813 . 12 1 1 A 84 84 GLY H H 84 8.410 7.453 0.957 1
1 814 . 12 1 1 A 84 84 GLY HA2 H 84 3.929 4.069 -0.140 1
1 815 . 12 1 1 A 84 84 GLY HA3 H 84 3.929 4.070 -0.141 1
1 816 . 12 1 1 A 84 84 GLY CA C 84 42.751 45.277 -2.526 1
1 817 . 12 1 1 A 84 84 GLY N N 84 110.030 107.019 3.011 1
1 818 . 12 1 1 A 85 85 GLY H H 85 8.295 8.787 -0.492 1
1 819 . 12 1 1 A 85 85 GLY HA2 H 85 3.950 3.940 0.010 1
1 820 . 12 1 1 A 85 85 GLY HA3 H 85 3.950 3.941 0.009 1
1 821 . 12 1 1 A 85 85 GLY CA C 85 42.831 46.642 -3.811 1
1 822 . 12 1 1 A 85 85 GLY N N 85 108.838 113.498 -4.660 1
1 823 . 12 1 1 A 86 86 SER H H 86 8.292 8.324 -0.032 1
1 824 . 12 1 1 A 86 86 SER HA H 86 4.405 4.727 -0.322 1
1 827 . 12 1 1 A 86 86 SER CA C 86 55.965 58.083 -2.118 1
1 828 . 12 1 1 A 86 86 SER CB C 86 61.232 66.014 -4.782 1
1 829 . 12 1 1 A 86 86 SER N N 86 116.028 121.572 -5.544 1
1 830 . 12 1 1 A 87 87 MET H H 87 8.470 7.936 0.534 1
1 831 . 12 1 1 A 87 87 MET HA H 87 4.447 4.251 0.196 1
1 836 . 12 1 1 A 87 87 MET CA C 87 53.281 58.155 -4.874 1
1 837 . 12 1 1 A 87 87 MET CB C 87 29.788 32.852 -3.064 1
1 839 . 12 1 1 A 87 87 MET N N 87 121.625 120.025 1.600 1
1 840 . 12 1 1 A 88 88 GLY H H 88 8.320 8.173 0.147 1
1 841 . 12 1 1 A 88 88 GLY HA2 H 88 3.919 3.933 -0.014 1
1 842 . 12 1 1 A 88 88 GLY HA3 H 88 3.896 3.933 -0.037 1
1 843 . 12 1 1 A 88 88 GLY CA C 88 43.060 46.137 -3.077 1
1 844 . 12 1 1 A 88 88 GLY N N 88 109.625 107.880 1.745 1
1 845 . 12 1 1 A 89 89 GLY H H 89 8.256 8.083 0.173 1
1 846 . 12 1 1 A 89 89 GLY HA2 H 89 3.940 4.048 -0.108 1
1 847 . 12 1 1 A 89 89 GLY HA3 H 89 3.910 4.048 -0.138 1
1 848 . 12 1 1 A 89 89 GLY CA C 89 42.678 44.374 -1.696 1
1 849 . 12 1 1 A 89 89 GLY N N 89 108.982 108.660 0.322 1
1 850 . 12 1 1 A 90 90 ALA H H 90 8.203 8.326 -0.123 1
1 851 . 12 1 1 A 90 90 ALA HA H 90 4.255 4.155 0.100 1
1 855 . 12 1 1 A 90 90 ALA CA C 90 50.763 54.631 -3.868 1
1 856 . 12 1 1 A 90 90 ALA CB C 90 16.364 19.541 -3.177 1
1 857 . 12 1 1 A 90 90 ALA N N 90 124.065 122.892 1.173 1
1 858 . 12 1 1 A 91 91 ALA H H 91 8.273 7.713 0.560 1
1 859 . 12 1 1 A 91 91 ALA HA H 91 4.204 4.677 -0.473 1
1 863 . 12 1 1 A 91 91 ALA CA C 91 51.080 50.263 0.817 1
1 864 . 12 1 1 A 91 91 ALA CB C 91 16.036 21.147 -5.111 1
1 865 . 12 1 1 A 91 91 ALA N N 91 121.985 120.065 1.920 1
1 866 . 12 1 1 A 92 92 ASP H H 92 8.022 8.740 -0.718 1
1 867 . 12 1 1 A 92 92 ASP HA H 92 4.455 4.972 -0.517 1
1 870 . 12 1 1 A 92 92 ASP CA C 92 52.664 53.028 -0.364 1
1 871 . 12 1 1 A 92 92 ASP CB C 92 37.925 41.752 -3.827 1
1 872 . 12 1 1 A 92 92 ASP N N 92 118.621 122.766 -4.145 1
1 873 . 12 1 1 A 93 93 GLU H H 93 8.282 8.459 -0.177 1
1 874 . 12 1 1 A 93 93 GLU HA H 93 3.912 3.932 -0.020 1
1 879 . 12 1 1 A 93 93 GLU CA C 93 56.947 57.412 -0.465 1
1 880 . 12 1 1 A 93 93 GLU CB C 93 27.413 28.651 -1.238 1
1 882 . 12 1 1 A 93 93 GLU N N 93 122.247 118.437 3.810 1
1 883 . 12 1 1 A 94 94 GLU H H 94 8.194 7.968 0.226 1
1 884 . 12 1 1 A 94 94 GLU HA H 94 3.940 4.410 -0.470 1
1 889 . 12 1 1 A 94 94 GLU CA C 94 56.681 57.930 -1.249 1
1 890 . 12 1 1 A 94 94 GLU CB C 94 26.127 31.027 -4.900 1
1 892 . 12 1 1 A 94 94 GLU N N 94 118.024 119.454 -1.430 1
1 893 . 12 1 1 A 95 95 GLU H H 95 7.816 8.660 -0.844 1
1 894 . 12 1 1 A 95 95 GLU HA H 95 4.121 4.163 -0.042 1
1 898 . 12 1 1 A 95 95 GLU CA C 95 56.162 58.456 -2.294 1
1 899 . 12 1 1 A 95 95 GLU CB C 95 26.403 28.657 -2.254 1
1 901 . 12 1 1 A 95 95 GLU N N 95 120.028 119.825 0.203 1
1 902 . 12 1 1 A 96 96 LEU H H 96 7.637 7.741 -0.104 1
1 903 . 12 1 1 A 96 96 LEU HA H 96 3.988 4.086 -0.098 1
1 913 . 12 1 1 A 96 96 LEU CA C 96 55.303 56.860 -1.557 1
1 914 . 12 1 1 A 96 96 LEU CB C 96 39.038 41.485 -2.447 1
1 918 . 12 1 1 A 96 96 LEU N N 96 119.866 118.362 1.504 1
1 919 . 12 1 1 A 97 97 ILE H H 97 8.044 7.609 0.435 1
1 920 . 12 1 1 A 97 97 ILE HA H 97 3.478 3.990 -0.512 1
1 930 . 12 1 1 A 97 97 ILE CA C 97 62.054 63.860 -1.806 1
1 931 . 12 1 1 A 97 97 ILE CB C 97 34.541 38.133 -3.592 1
1 935 . 12 1 1 A 97 97 ILE N N 97 119.088 119.478 -0.390 1
1 936 . 12 1 1 A 98 98 ARG H H 98 7.991 8.311 -0.320 1
1 937 . 12 1 1 A 98 98 ARG HA H 98 3.793 4.022 -0.229 1
1 944 . 12 1 1 A 98 98 ARG CA C 98 57.509 58.853 -1.344 1
1 945 . 12 1 1 A 98 98 ARG CB C 98 27.191 29.968 -2.777 1
1 948 . 12 1 1 A 98 98 ARG N N 98 119.225 121.019 -1.794 1
1 949 . 12 1 1 A 99 99 LYS H H 99 8.101 7.732 0.369 1
1 950 . 12 1 1 A 99 99 LYS HA H 99 3.968 4.082 -0.114 1
1 959 . 12 1 1 A 99 99 LYS CA C 99 56.455 59.050 -2.595 1
1 960 . 12 1 1 A 99 99 LYS CB C 99 29.531 31.899 -2.368 1
1 964 . 12 1 1 A 99 99 LYS N N 99 119.464 118.479 0.985 1
1 965 . 12 1 1 A 100 100 ALA H H 100 8.167 7.995 0.172 1
1 966 . 12 1 1 A 100 100 ALA HA H 100 3.789 4.166 -0.377 1
1 970 . 12 1 1 A 100 100 ALA CA C 100 52.451 54.733 -2.282 1
1 971 . 12 1 1 A 100 100 ALA CB C 100 16.259 18.502 -2.243 1
1 972 . 12 1 1 A 100 100 ALA N N 100 122.398 121.474 0.924 1
1 973 . 12 1 1 A 101 101 ILE H H 101 8.777 8.213 0.564 1
1 974 . 12 1 1 A 101 101 ILE HA H 101 3.191 3.628 -0.437 1
1 984 . 12 1 1 A 101 101 ILE CA C 101 62.910 65.183 -2.273 1
1 985 . 12 1 1 A 101 101 ILE CB C 101 34.544 37.267 -2.723 1
1 989 . 12 1 1 A 101 101 ILE N N 101 120.431 119.073 1.358 1
1 990 . 12 1 1 A 102 102 GLU H H 102 7.890 7.602 0.288 1
1 991 . 12 1 1 A 102 102 GLU HA H 102 3.848 4.176 -0.328 1
1 996 . 12 1 1 A 102 102 GLU CA C 102 57.079 58.495 -1.416 1
1 997 . 12 1 1 A 102 102 GLU CB C 102 26.769 29.808 -3.039 1
1 999 . 12 1 1 A 102 102 GLU N N 102 120.248 121.363 -1.115 1
1 1000 . 12 1 1 A 103 103 LEU H H 103 8.194 7.759 0.435 1
1 1001 . 12 1 1 A 103 103 LEU HA H 103 3.912 4.303 -0.391 1
1 1011 . 12 1 1 A 103 103 LEU CA C 103 55.078 56.805 -1.727 1
1 1012 . 12 1 1 A 103 103 LEU CB C 103 38.963 42.399 -3.436 1
1 1016 . 12 1 1 A 103 103 LEU N N 103 120.341 118.696 1.645 1
1 1017 . 12 1 1 A 104 104 SER H H 104 8.268 7.767 0.501 1
1 1018 . 12 1 1 A 104 104 SER HA H 104 4.120 4.533 -0.413 1
1 1021 . 12 1 1 A 104 104 SER CA C 104 58.301 59.921 -1.620 1
1 1022 . 12 1 1 A 104 104 SER CB C 104 60.193 63.985 -3.792 1
1 1023 . 12 1 1 A 104 104 SER N N 104 115.150 113.208 1.942 1
1 1024 . 12 1 1 A 105 105 LEU H H 105 7.501 7.748 -0.247 1
1 1025 . 12 1 1 A 105 105 LEU HA H 105 4.041 4.008 0.033 1
1 1035 . 12 1 1 A 105 105 LEU CA C 105 53.995 56.056 -2.061 1
1 1036 . 12 1 1 A 105 105 LEU CB C 105 39.597 42.008 -2.411 1
1 1040 . 12 1 1 A 105 105 LEU N N 105 124.223 120.001 4.222 1
1 1041 . 12 1 1 A 106 106 LYS H H 106 7.542 8.136 -0.594 1
1 1042 . 12 1 1 A 106 106 LYS HA H 106 4.090 4.001 0.089 1
1 1050 . 12 1 1 A 106 106 LYS CA C 106 55.495 59.050 -3.555 1
1 1051 . 12 1 1 A 106 106 LYS CB C 106 29.941 32.380 -2.439 1
1 1055 . 12 1 1 A 106 106 LYS N N 106 120.328 120.267 0.061 1
1 1056 . 12 1 1 A 107 107 GLU H H 107 7.884 7.954 -0.070 1
1 1057 . 12 1 1 A 107 107 GLU HA H 107 4.210 4.151 0.059 1
1 1060 . 12 1 1 A 107 107 GLU CA C 107 54.509 58.908 -4.399 1
1 1061 . 12 1 1 A 107 107 GLU CB C 107 27.239 28.997 -1.758 1
1 1062 . 12 1 1 A 107 107 GLU N N 107 118.621 120.881 -2.260 1
1 1063 . 12 1 1 A 108 108 SER H H 108 7.923 7.938 -0.015 1
1 1064 . 12 1 1 A 108 108 SER HA H 108 4.385 4.303 0.082 1
1 1067 . 12 1 1 A 108 108 SER CA C 108 56.442 61.176 -4.734 1
1 1068 . 12 1 1 A 108 108 SER CB C 108 60.953 63.218 -2.265 1
1 1069 . 12 1 1 A 108 108 SER N N 108 115.670 114.632 1.038 1
1 1070 . 12 1 1 A 109 109 ARG H H 109 8.068 7.957 0.111 1
1 1071 . 12 1 1 A 109 109 ARG HA H 109 4.307 4.152 0.155 1
1 1078 . 12 1 1 A 109 109 ARG CA C 109 53.732 59.343 -5.611 1
1 1079 . 12 1 1 A 109 109 ARG CB C 109 27.968 30.046 -2.078 1
1 1082 . 12 1 1 A 109 109 ARG N N 109 122.313 121.718 0.595 1
1 1083 . 12 1 1 A 110 110 ASN H H 110 8.292 8.059 0.233 1
1 1084 . 12 1 1 A 110 110 ASN HA H 110 4.720 4.524 0.196 1
1 1087 . 12 1 1 A 110 110 ASN CA C 110 50.750 55.793 -5.043 1
1 1088 . 12 1 1 A 110 110 ASN CB C 110 36.197 38.342 -2.145 1
1 1089 . 12 1 1 A 110 110 ASN N N 110 119.304 118.237 1.067 1
1 1090 . 12 1 1 A 111 111 SER H H 111 8.244 7.428 0.816 1
1 1091 . 12 1 1 A 111 111 SER HA H 111 4.423 4.834 -0.411 1
1 1094 . 12 1 1 A 111 111 SER CA C 111 55.990 58.515 -2.525 1
1 1095 . 12 1 1 A 111 111 SER CB C 111 61.027 63.724 -2.697 1
1 1096 . 12 1 1 A 111 111 SER N N 111 116.119 114.235 1.884 1
1 1097 . 12 1 1 A 112 112 GLY H H 112 8.327 8.211 0.116 1
1 1098 . 12 1 1 A 112 112 GLY HA2 H 112 3.944 4.027 -0.083 1
1 1099 . 12 1 1 A 112 112 GLY HA3 H 112 3.912 4.108 -0.196 1
1 1100 . 12 1 1 A 112 112 GLY CA C 112 42.733 46.458 -3.725 1
1 1101 . 12 1 1 A 112 112 GLY N N 112 110.442 110.255 0.187 1
1 1102 . 12 1 1 A 113 113 GLY H H 113 8.097 8.383 -0.286 1
1 1103 . 12 1 1 A 113 113 GLY HA2 H 113 3.831 3.657 0.174 1
1 1104 . 12 1 1 A 113 113 GLY HA3 H 113 3.785 3.737 0.048 1
1 1105 . 12 1 1 A 113 113 GLY CA C 113 42.435 47.123 -4.688 1
1 1106 . 12 1 1 A 113 113 GLY N N 113 108.745 109.825 -1.080 1
1 2 . 13 1 1 A 3 3 HIS CB C 3 33.709 31.040 2.669 1
1 3 . 13 1 1 A 7 7 HIS H H 7 8.731 8.627 0.104 1
1 4 . 13 1 1 A 7 7 HIS HA H 7 4.564 4.747 -0.183 1
1 7 . 13 1 1 A 7 7 HIS CA C 7 53.649 55.573 -1.924 1
1 8 . 13 1 1 A 7 7 HIS CB C 7 26.268 33.538 -7.270 1
1 9 . 13 1 1 A 7 7 HIS N N 7 121.126 122.287 -1.161 1
1 10 . 13 1 1 A 8 8 GLY H H 8 8.540 8.374 0.166 1
1 11 . 13 1 1 A 8 8 GLY HA2 H 8 3.973 3.803 0.170 1
1 12 . 13 1 1 A 8 8 GLY HA3 H 8 3.811 3.950 -0.139 1
1 13 . 13 1 1 A 8 8 GLY CA C 8 42.618 44.702 -2.084 1
1 14 . 13 1 1 A 8 8 GLY N N 8 110.662 113.017 -2.355 1
1 15 . 13 1 1 A 9 9 GLU H H 9 8.239 7.820 0.419 1
1 16 . 13 1 1 A 9 9 GLU HA H 9 4.568 4.318 0.250 1
1 18 . 13 1 1 A 9 9 GLU CA C 9 53.605 56.139 -2.534 1
1 19 . 13 1 1 A 9 9 GLU CB C 9 28.019 31.243 -3.224 1
1 20 . 13 1 1 A 9 9 GLU N N 9 121.669 120.834 0.835 1
1 21 . 13 1 1 A 10 10 PHE H H 10 8.785 6.861 1.924 1
1 22 . 13 1 1 A 10 10 PHE HA H 10 4.850 5.234 -0.384 1
1 25 . 13 1 1 A 10 10 PHE CA C 10 52.630 56.331 -3.701 1
1 26 . 13 1 1 A 10 10 PHE CB C 10 37.906 41.763 -3.857 1
1 27 . 13 1 1 A 10 10 PHE N N 10 118.401 118.099 0.302 1
1 28 . 13 1 1 A 11 11 GLN H H 11 8.552 9.337 -0.785 1
1 29 . 13 1 1 A 11 11 GLN HA H 11 5.425 5.318 0.107 1
1 34 . 13 1 1 A 11 11 GLN CA C 11 51.663 54.234 -2.571 1
1 35 . 13 1 1 A 11 11 GLN CB C 11 28.427 31.111 -2.684 1
1 37 . 13 1 1 A 11 11 GLN N N 11 117.519 121.706 -4.187 1
1 38 . 13 1 1 A 12 12 ILE H H 12 8.239 8.368 -0.129 1
1 39 . 13 1 1 A 12 12 ILE HA H 12 4.103 4.989 -0.886 1
1 49 . 13 1 1 A 12 12 ILE CA C 12 57.134 60.286 -3.152 1
1 50 . 13 1 1 A 12 12 ILE CB C 12 39.491 39.977 -0.486 1
1 54 . 13 1 1 A 12 12 ILE N N 12 114.043 121.630 -7.587 1
1 55 . 13 1 1 A 13 13 PHE H H 13 8.538 8.847 -0.309 1
1 56 . 13 1 1 A 13 13 PHE HA H 13 5.620 5.322 0.298 1
1 59 . 13 1 1 A 13 13 PHE CA C 13 52.438 56.392 -3.954 1
1 60 . 13 1 1 A 13 13 PHE CB C 13 39.253 42.536 -3.283 1
1 61 . 13 1 1 A 13 13 PHE N N 13 117.015 119.784 -2.769 1
1 62 . 13 1 1 A 14 14 ALA H H 14 9.238 8.960 0.278 1
1 63 . 13 1 1 A 14 14 ALA HA H 14 5.311 5.280 0.031 1
1 67 . 13 1 1 A 14 14 ALA CA C 14 47.183 50.589 -3.406 1
1 68 . 13 1 1 A 14 14 ALA CB C 14 17.811 23.077 -5.266 1
1 69 . 13 1 1 A 14 14 ALA N N 14 123.503 123.116 0.387 1
1 70 . 13 1 1 A 15 15 LYS H H 15 8.810 9.117 -0.307 1
1 71 . 13 1 1 A 15 15 LYS HA H 15 5.511 5.436 0.075 1
1 80 . 13 1 1 A 15 15 LYS CA C 15 51.718 54.710 -2.992 1
1 81 . 13 1 1 A 15 15 LYS CB C 15 33.635 35.991 -2.356 1
1 85 . 13 1 1 A 15 15 LYS N N 15 123.382 122.555 0.827 1
1 86 . 13 1 1 A 16 16 THR H H 16 8.830 8.626 0.204 1
1 87 . 13 1 1 A 16 16 THR HA H 16 5.212 4.903 0.309 1
1 92 . 13 1 1 A 16 16 THR CA C 16 57.614 60.891 -3.277 1
1 93 . 13 1 1 A 16 16 THR CB C 16 68.210 70.880 -2.670 1
1 95 . 13 1 1 A 16 16 THR N N 16 116.517 115.791 0.726 1
1 96 . 13 1 1 A 17 17 LEU H H 17 9.428 8.395 1.033 1
1 97 . 13 1 1 A 17 17 LEU HA H 17 4.286 3.902 0.384 1
1 107 . 13 1 1 A 17 17 LEU CA C 17 54.504 58.542 -4.038 1
1 108 . 13 1 1 A 17 17 LEU CB C 17 38.564 41.460 -2.896 1
1 112 . 13 1 1 A 17 17 LEU N N 17 121.786 123.409 -1.623 1
1 113 . 13 1 1 A 18 18 THR H H 18 7.546 7.855 -0.309 1
1 114 . 13 1 1 A 18 18 THR HA H 18 4.391 4.240 0.151 1
1 119 . 13 1 1 A 18 18 THR CA C 18 58.524 63.373 -4.849 1
1 120 . 13 1 1 A 18 18 THR CB C 18 66.166 70.416 -4.250 1
1 122 . 13 1 1 A 18 18 THR N N 18 105.598 108.389 -2.791 1
1 123 . 13 1 1 A 19 19 GLY H H 19 7.683 8.163 -0.480 1
1 124 . 13 1 1 A 19 19 GLY HA2 H 19 3.300 3.951 -0.651 1
1 125 . 13 1 1 A 19 19 GLY HA3 H 19 4.248 3.966 0.282 1
1 126 . 13 1 1 A 19 19 GLY CA C 19 42.947 46.083 -3.136 1
1 127 . 13 1 1 A 19 19 GLY N N 19 109.243 111.981 -2.738 1
1 128 . 13 1 1 A 20 20 LYS H H 20 7.375 7.625 -0.250 1
1 129 . 13 1 1 A 20 20 LYS HA H 20 4.331 4.716 -0.385 1
1 138 . 13 1 1 A 20 20 LYS CA C 20 53.829 55.033 -1.204 1
1 139 . 13 1 1 A 20 20 LYS CB C 20 30.385 34.503 -4.118 1
1 143 . 13 1 1 A 20 20 LYS N N 20 122.757 120.225 2.532 1
1 144 . 13 1 1 A 21 21 THR H H 21 8.637 8.893 -0.256 1
1 145 . 13 1 1 A 21 21 THR HA H 21 4.852 4.608 0.244 1
1 150 . 13 1 1 A 21 21 THR CA C 21 59.846 62.551 -2.705 1
1 151 . 13 1 1 A 21 21 THR CB C 21 67.140 68.932 -1.792 1
1 153 . 13 1 1 A 21 21 THR N N 21 121.524 123.368 -1.844 1
1 154 . 13 1 1 A 22 22 ILE H H 22 9.509 9.033 0.476 1
1 155 . 13 1 1 A 22 22 ILE HA H 22 4.349 4.803 -0.454 1
1 165 . 13 1 1 A 22 22 ILE CA C 22 57.634 60.005 -2.371 1
1 166 . 13 1 1 A 22 22 ILE CB C 22 38.334 41.642 -3.308 1
1 170 . 13 1 1 A 22 22 ILE N N 22 129.772 126.901 2.871 1
1 171 . 13 1 1 A 23 23 THR H H 23 8.838 8.786 0.052 1
1 172 . 13 1 1 A 23 23 THR HA H 23 4.653 4.409 0.244 1
1 177 . 13 1 1 A 23 23 THR CA C 23 60.194 61.279 -1.085 1
1 178 . 13 1 1 A 23 23 THR CB C 23 66.577 69.963 -3.386 1
1 180 . 13 1 1 A 23 23 THR N N 23 124.070 123.535 0.535 1
1 181 . 13 1 1 A 24 24 LEU H H 24 8.749 8.590 0.159 1
1 182 . 13 1 1 A 24 24 LEU HA H 24 4.619 5.062 -0.443 1
1 192 . 13 1 1 A 24 24 LEU CA C 24 50.257 52.805 -2.548 1
1 193 . 13 1 1 A 24 24 LEU CB C 24 42.932 45.606 -2.674 1
1 197 . 13 1 1 A 24 24 LEU N N 24 126.499 123.360 3.139 1
1 198 . 13 1 1 A 25 25 GLU H H 25 7.990 8.578 -0.588 1
1 199 . 13 1 1 A 25 25 GLU HA H 25 4.591 4.663 -0.072 1
1 204 . 13 1 1 A 25 25 GLU CA C 25 52.845 56.153 -3.308 1
1 205 . 13 1 1 A 25 25 GLU CB C 25 27.210 29.697 -2.487 1
1 207 . 13 1 1 A 25 25 GLU N N 25 121.644 120.759 0.885 1
1 208 . 13 1 1 A 26 26 VAL H H 26 8.657 8.729 -0.072 1
1 209 . 13 1 1 A 26 26 VAL HA H 26 4.403 4.974 -0.571 1
1 217 . 13 1 1 A 26 26 VAL CA C 26 56.020 58.907 -2.887 1
1 218 . 13 1 1 A 26 26 VAL CB C 26 33.631 35.297 -1.666 1
1 221 . 13 1 1 A 26 26 VAL N N 26 116.647 117.596 -0.949 1
1 222 . 13 1 1 A 27 27 GLU H H 27 7.970 8.897 -0.927 1
1 223 . 13 1 1 A 27 27 GLU HA H 27 4.447 4.698 -0.251 1
1 228 . 13 1 1 A 27 27 GLU CA C 27 51.386 57.031 -5.645 1
1 229 . 13 1 1 A 27 27 GLU CB C 27 30.905 30.515 0.390 1
1 231 . 13 1 1 A 27 27 GLU N N 27 115.496 123.410 -7.914 1
1 232 . 13 1 1 A 28 28 SER H H 28 9.192 8.925 0.267 1
1 233 . 13 1 1 A 28 28 SER HA H 28 4.108 4.030 0.078 1
1 236 . 13 1 1 A 28 28 SER CA C 28 59.909 60.886 -0.977 1
1 237 . 13 1 1 A 28 28 SER CB C 28 60.399 62.416 -2.017 1
1 238 . 13 1 1 A 28 28 SER N N 28 117.720 118.760 -1.040 1
1 239 . 13 1 1 A 29 29 SER H H 29 7.371 7.800 -0.429 1
1 240 . 13 1 1 A 29 29 SER HA H 29 4.327 4.633 -0.306 1
1 243 . 13 1 1 A 29 29 SER CA C 29 54.805 57.347 -2.542 1
1 244 . 13 1 1 A 29 29 SER CB C 29 60.775 63.765 -2.990 1
1 245 . 13 1 1 A 29 29 SER N N 29 108.936 114.736 -5.800 1
1 246 . 13 1 1 A 30 30 ASP H H 30 7.852 7.647 0.205 1
1 247 . 13 1 1 A 30 30 ASP HA H 30 4.591 4.516 0.075 1
1 250 . 13 1 1 A 30 30 ASP CA C 30 53.040 54.524 -1.484 1
1 251 . 13 1 1 A 30 30 ASP CB C 30 37.942 41.860 -3.918 1
1 252 . 13 1 1 A 30 30 ASP N N 30 123.735 121.592 2.143 1
1 253 . 13 1 1 A 31 31 THR H H 31 7.852 8.307 -0.455 1
1 254 . 13 1 1 A 31 31 THR HA H 31 4.918 4.905 0.013 1
1 259 . 13 1 1 A 31 31 THR CA C 31 56.929 59.840 -2.911 1
1 260 . 13 1 1 A 31 31 THR CB C 31 68.674 71.817 -3.143 1
1 262 . 13 1 1 A 31 31 THR N N 31 109.181 113.167 -3.986 1
1 263 . 13 1 1 A 32 32 ILE H H 32 8.582 8.841 -0.259 1
1 264 . 13 1 1 A 32 32 ILE HA H 32 3.624 3.785 -0.161 1
1 274 . 13 1 1 A 32 32 ILE CA C 32 59.474 65.587 -6.113 1
1 275 . 13 1 1 A 32 32 ILE CB C 32 31.561 37.659 -6.098 1
1 279 . 13 1 1 A 32 32 ILE N N 32 121.833 122.676 -0.843 1
1 280 . 13 1 1 A 33 33 ASP H H 33 9.255 8.201 1.054 1
1 281 . 13 1 1 A 33 33 ASP HA H 33 4.201 4.391 -0.190 1
1 284 . 13 1 1 A 33 33 ASP CA C 33 54.679 57.731 -3.052 1
1 285 . 13 1 1 A 33 33 ASP CB C 33 37.700 41.507 -3.807 1
1 286 . 13 1 1 A 33 33 ASP N N 33 119.823 120.567 -0.744 1
1 287 . 13 1 1 A 34 34 ASN H H 34 8.026 7.779 0.247 1
1 288 . 13 1 1 A 34 34 ASN HA H 34 4.409 4.630 -0.221 1
1 291 . 13 1 1 A 34 34 ASN CA C 34 53.324 56.405 -3.081 1
1 292 . 13 1 1 A 34 34 ASN CB C 34 35.782 38.872 -3.090 1
1 293 . 13 1 1 A 34 34 ASN N N 34 119.540 117.615 1.925 1
1 294 . 13 1 1 A 35 35 VAL H H 35 8.167 8.077 0.090 1
1 295 . 13 1 1 A 35 35 VAL HA H 35 3.249 3.439 -0.190 1
1 303 . 13 1 1 A 35 35 VAL CA C 35 65.308 67.195 -1.887 1
1 304 . 13 1 1 A 35 35 VAL CB C 35 27.965 31.472 -3.507 1
1 307 . 13 1 1 A 35 35 VAL N N 35 122.223 120.100 2.123 1
1 308 . 13 1 1 A 36 36 LYS H H 36 8.460 8.295 0.165 1
1 313 . 13 1 1 A 36 36 LYS CB C 36 30.753 32.215 -1.462 1
1 315 . 13 1 1 A 36 36 LYS N N 36 119.438 119.143 0.295 1
1 316 . 13 1 1 A 37 37 SER H H 37 8.196 8.609 -0.413 1
1 317 . 13 1 1 A 37 37 SER HA H 37 4.130 4.354 -0.224 1
1 320 . 13 1 1 A 37 37 SER CA C 37 58.528 61.051 -2.523 1
1 321 . 13 1 1 A 37 37 SER CB C 37 59.768 62.578 -2.810 1
1 322 . 13 1 1 A 37 37 SER N N 37 117.791 114.276 3.515 1
1 323 . 13 1 1 A 38 38 LYS H H 38 8.043 8.409 -0.366 1
1 324 . 13 1 1 A 38 38 LYS HA H 38 4.095 3.941 0.154 1
1 325 . 13 1 1 A 38 38 LYS CA C 38 57.377 59.034 -1.657 1
1 326 . 13 1 1 A 38 38 LYS N N 38 124.094 121.396 2.698 1
1 327 . 13 1 1 A 39 39 ILE H H 39 8.254 8.075 0.179 1
1 328 . 13 1 1 A 39 39 ILE HA H 39 3.439 3.809 -0.370 1
1 338 . 13 1 1 A 39 39 ILE CA C 39 63.977 64.039 -0.062 1
1 339 . 13 1 1 A 39 39 ILE CB C 39 33.935 37.200 -3.265 1
1 343 . 13 1 1 A 39 39 ILE N N 39 122.107 120.975 1.132 1
1 344 . 13 1 1 A 40 40 GLN H H 40 8.379 8.221 0.158 1
1 345 . 13 1 1 A 40 40 GLN HA H 40 3.746 4.018 -0.272 1
1 350 . 13 1 1 A 40 40 GLN CA C 40 57.472 58.103 -0.631 1
1 351 . 13 1 1 A 40 40 GLN CB C 40 25.072 28.132 -3.060 1
1 353 . 13 1 1 A 40 40 GLN N N 40 123.725 119.988 3.737 1
1 354 . 13 1 1 A 41 41 ASP H H 41 8.210 7.985 0.225 1
1 355 . 13 1 1 A 41 41 ASP HA H 41 4.247 4.420 -0.173 1
1 358 . 13 1 1 A 41 41 ASP CA C 41 54.646 56.733 -2.087 1
1 359 . 13 1 1 A 41 41 ASP CB C 41 38.136 41.057 -2.921 1
1 360 . 13 1 1 A 41 41 ASP N N 41 120.564 120.570 -0.006 1
1 361 . 13 1 1 A 42 42 LYS H H 42 7.381 8.248 -0.867 1
1 362 . 13 1 1 A 42 42 LYS HA H 42 4.246 4.338 -0.092 1
1 369 . 13 1 1 A 42 42 LYS CA C 42 55.579 57.633 -2.054 1
1 370 . 13 1 1 A 42 42 LYS CB C 42 31.406 33.549 -2.143 1
1 373 . 13 1 1 A 42 42 LYS N N 42 115.674 116.582 -0.908 1
1 374 . 13 1 1 A 43 43 GLU H H 43 8.537 8.382 0.155 1
1 375 . 13 1 1 A 43 43 GLU HA H 43 4.522 4.523 -0.001 1
1 380 . 13 1 1 A 43 43 GLU CA C 43 52.772 55.672 -2.900 1
1 381 . 13 1 1 A 43 43 GLU CB C 43 30.535 31.077 -0.542 1
1 383 . 13 1 1 A 43 43 GLU N N 43 114.355 116.218 -1.863 1
1 384 . 13 1 1 A 44 44 GLY H H 44 8.611 8.592 0.019 1
1 385 . 13 1 1 A 44 44 GLY HA2 H 44 4.067 3.960 0.107 1
1 386 . 13 1 1 A 44 44 GLY HA3 H 44 3.819 3.961 -0.142 1
1 387 . 13 1 1 A 44 44 GLY CA C 44 43.205 45.380 -2.175 1
1 388 . 13 1 1 A 44 44 GLY N N 44 109.406 108.591 0.815 1
1 389 . 13 1 1 A 45 45 ILE H H 45 6.092 8.076 -1.984 1
1 390 . 13 1 1 A 45 45 ILE HA H 45 4.324 4.115 0.209 1
1 400 . 13 1 1 A 45 45 ILE CA C 45 55.211 60.108 -4.897 1
1 401 . 13 1 1 A 45 45 ILE CB C 45 37.903 38.495 -0.592 1
1 405 . 13 1 1 A 45 45 ILE N N 45 120.791 122.433 -1.642 1
1 406 . 13 1 1 A 46 46 PRO HA H 46 4.547 4.558 -0.011 1
1 413 . 13 1 1 A 46 46 PRO CA C 46 58.971 62.030 -3.059 1
1 414 . 13 1 1 A 46 46 PRO CB C 46 29.142 32.370 -3.228 1
1 417 . 13 1 1 A 47 47 PRO HA H 47 4.062 4.497 -0.435 1
1 424 . 13 1 1 A 47 47 PRO CA C 47 63.476 65.779 -2.303 1
1 425 . 13 1 1 A 47 47 PRO CB C 47 30.113 31.886 -1.773 1
1 428 . 13 1 1 A 48 48 ASP H H 48 8.418 8.521 -0.103 1
1 429 . 13 1 1 A 48 48 ASP HA H 48 4.346 4.460 -0.114 1
1 432 . 13 1 1 A 48 48 ASP CA C 48 52.838 56.057 -3.219 1
1 433 . 13 1 1 A 48 48 ASP CB C 48 36.926 40.231 -3.305 1
1 434 . 13 1 1 A 48 48 ASP N N 48 113.462 116.681 -3.219 1
1 435 . 13 1 1 A 49 49 GLN H H 49 7.822 8.033 -0.211 1
1 436 . 13 1 1 A 49 49 GLN HA H 49 4.283 4.281 0.002 1
1 439 . 13 1 1 A 49 49 GLN CA C 49 52.770 56.739 -3.969 1
1 441 . 13 1 1 A 49 49 GLN N N 49 117.377 117.038 0.339 1
1 442 . 13 1 1 A 50 50 GLN H H 50 7.451 7.574 -0.123 1
1 443 . 13 1 1 A 50 50 GLN HA H 50 4.260 4.989 -0.729 1
1 448 . 13 1 1 A 50 50 GLN CA C 50 53.725 54.797 -1.072 1
1 449 . 13 1 1 A 50 50 GLN CB C 50 29.142 31.044 -1.902 1
1 451 . 13 1 1 A 50 50 GLN N N 50 117.526 117.849 -0.323 1
1 452 . 13 1 1 A 51 51 ARG H H 51 8.534 8.771 -0.237 1
1 453 . 13 1 1 A 51 51 ARG HA H 51 4.486 5.129 -0.643 1
1 460 . 13 1 1 A 51 51 ARG CA C 51 52.492 54.600 -2.108 1
1 461 . 13 1 1 A 51 51 ARG CB C 51 29.096 33.756 -4.660 1
1 464 . 13 1 1 A 51 51 ARG N N 51 121.655 123.000 -1.345 1
1 465 . 13 1 1 A 52 52 LEU H H 52 8.683 9.104 -0.421 1
1 466 . 13 1 1 A 52 52 LEU HA H 52 5.255 5.305 -0.050 1
1 476 . 13 1 1 A 52 52 LEU CA C 52 50.618 53.344 -2.726 1
1 477 . 13 1 1 A 52 52 LEU CB C 52 43.007 44.034 -1.027 1
1 481 . 13 1 1 A 52 52 LEU N N 52 122.929 122.920 0.009 1
1 482 . 13 1 1 A 53 53 ILE H H 53 9.286 9.359 -0.073 1
1 483 . 13 1 1 A 53 53 ILE HA H 53 5.096 5.033 0.063 1
1 492 . 13 1 1 A 53 53 ILE CA C 53 56.795 60.572 -3.777 1
1 496 . 13 1 1 A 53 53 ILE N N 53 124.718 124.616 0.102 1
1 497 . 13 1 1 A 54 54 TRP H H 54 8.871 9.444 -0.573 1
1 499 . 13 1 1 A 54 54 TRP N N 54 127.412 128.702 -1.290 1
1 501 . 13 1 1 A 55 55 ALA H H 55 8.401 8.585 -0.184 1
1 502 . 13 1 1 A 55 55 ALA HA H 55 3.183 3.603 -0.420 1
1 506 . 13 1 1 A 55 55 ALA CA C 55 49.712 52.843 -3.131 1
1 507 . 13 1 1 A 55 55 ALA CB C 55 13.252 17.349 -4.097 1
1 508 . 13 1 1 A 55 55 ALA N N 55 128.894 130.393 -1.499 1
1 509 . 13 1 1 A 56 56 GLY H H 56 8.248 8.446 -0.198 1
1 510 . 13 1 1 A 56 56 GLY HA2 H 56 3.968 3.752 0.216 1
1 511 . 13 1 1 A 56 56 GLY HA3 H 56 3.916 3.753 0.163 1
1 512 . 13 1 1 A 56 56 GLY CA C 56 43.142 45.612 -2.470 1
1 513 . 13 1 1 A 56 56 GLY N N 56 101.499 102.589 -1.090 1
1 514 . 13 1 1 A 57 57 LYS H H 57 8.028 7.509 0.519 1
1 515 . 13 1 1 A 57 57 LYS HA H 57 4.609 4.707 -0.098 1
1 522 . 13 1 1 A 57 57 LYS CA C 57 51.928 54.686 -2.758 1
1 523 . 13 1 1 A 57 57 LYS CB C 57 32.613 35.407 -2.794 1
1 526 . 13 1 1 A 57 57 LYS N N 57 118.995 121.217 -2.222 1
1 527 . 13 1 1 A 58 58 GLN H H 58 8.607 8.483 0.124 1
1 528 . 13 1 1 A 58 58 GLN HA H 58 4.617 4.674 -0.057 1
1 533 . 13 1 1 A 58 58 GLN CA C 58 53.261 55.925 -2.664 1
1 534 . 13 1 1 A 58 58 GLN CB C 58 26.613 29.365 -2.752 1
1 536 . 13 1 1 A 58 58 GLN N N 58 119.825 127.152 -7.327 1
1 537 . 13 1 1 A 59 59 LEU H H 59 8.653 9.520 -0.867 1
1 538 . 13 1 1 A 59 59 LEU HA H 59 4.138 4.333 -0.195 1
1 548 . 13 1 1 A 59 59 LEU CA C 59 51.991 55.195 -3.204 1
1 549 . 13 1 1 A 59 59 LEU CB C 59 39.006 42.073 -3.067 1
1 553 . 13 1 1 A 59 59 LEU N N 59 125.484 127.483 -1.999 1
1 554 . 13 1 1 A 60 60 GLU H H 60 8.461 8.960 -0.499 1
1 555 . 13 1 1 A 60 60 GLU HA H 60 4.371 4.421 -0.050 1
1 559 . 13 1 1 A 60 60 GLU CA C 60 53.436 56.145 -2.709 1
1 560 . 13 1 1 A 60 60 GLU CB C 60 29.057 30.493 -1.436 1
1 562 . 13 1 1 A 60 60 GLU N N 60 123.237 123.842 -0.605 1
1 563 . 13 1 1 A 61 61 ASP H H 61 8.076 8.761 -0.685 1
1 564 . 13 1 1 A 61 61 ASP HA H 61 4.265 4.334 -0.069 1
1 567 . 13 1 1 A 61 61 ASP CA C 61 54.398 56.693 -2.295 1
1 568 . 13 1 1 A 61 61 ASP CB C 61 38.340 40.411 -2.071 1
1 569 . 13 1 1 A 61 61 ASP N N 61 120.701 123.111 -2.410 1
1 570 . 13 1 1 A 62 62 GLY HA2 H 62 4.104 3.964 0.140 1
1 571 . 13 1 1 A 62 62 GLY HA3 H 62 3.832 3.966 -0.134 1
1 572 . 13 1 1 A 62 62 GLY CA C 62 42.576 45.270 -2.694 1
1 573 . 13 1 1 A 63 63 ARG H H 63 7.319 8.384 -1.065 1
1 574 . 13 1 1 A 63 63 ARG HA H 63 4.595 4.413 0.182 1
1 579 . 13 1 1 A 63 63 ARG CA C 63 51.971 56.016 -4.045 1
1 582 . 13 1 1 A 63 63 ARG N N 63 119.206 120.526 -1.320 1
1 583 . 13 1 1 A 64 64 THR H H 64 8.735 8.492 0.243 1
1 584 . 13 1 1 A 64 64 THR HA H 64 5.208 4.941 0.267 1
1 589 . 13 1 1 A 64 64 THR CA C 64 57.126 59.551 -2.425 1
1 590 . 13 1 1 A 64 64 THR CB C 64 69.885 72.083 -2.198 1
1 592 . 13 1 1 A 64 64 THR N N 64 108.713 112.461 -3.748 1
1 593 . 13 1 1 A 65 65 LEU H H 65 8.241 9.078 -0.837 1
1 594 . 13 1 1 A 65 65 LEU HA H 65 4.003 3.928 0.075 1
1 604 . 13 1 1 A 65 65 LEU CA C 65 56.409 57.537 -1.128 1
1 605 . 13 1 1 A 65 65 LEU CB C 65 37.179 41.815 -4.636 1
1 609 . 13 1 1 A 65 65 LEU N N 65 118.111 122.698 -4.587 1
1 610 . 13 1 1 A 66 66 SER H H 66 8.296 8.026 0.270 1
1 611 . 13 1 1 A 66 66 SER HA H 66 4.201 4.238 -0.037 1
1 614 . 13 1 1 A 66 66 SER CA C 66 58.454 60.645 -2.191 1
1 615 . 13 1 1 A 66 66 SER CB C 66 59.969 62.918 -2.949 1
1 616 . 13 1 1 A 66 66 SER N N 66 113.148 113.684 -0.536 1
1 617 . 13 1 1 A 67 67 ASP H H 67 7.984 8.177 -0.193 1
1 618 . 13 1 1 A 67 67 ASP HA H 67 4.187 4.316 -0.129 1
1 621 . 13 1 1 A 67 67 ASP CA C 67 54.744 57.197 -2.453 1
1 622 . 13 1 1 A 67 67 ASP CB C 67 37.794 41.393 -3.599 1
1 623 . 13 1 1 A 67 67 ASP N N 67 124.130 121.722 2.408 1
1 624 . 13 1 1 A 68 68 TYR H H 68 7.177 7.707 -0.530 1
1 625 . 13 1 1 A 68 68 TYR N N 68 115.334 120.791 -5.457 1
1 626 . 13 1 1 A 69 69 ASN H H 69 8.111 7.667 0.444 1
1 627 . 13 1 1 A 69 69 ASN HA H 69 4.253 4.456 -0.203 1
1 630 . 13 1 1 A 69 69 ASN CA C 69 51.386 54.329 -2.943 1
1 631 . 13 1 1 A 69 69 ASN CB C 69 34.867 36.602 -1.735 1
1 632 . 13 1 1 A 69 69 ASN N N 69 116.867 116.231 0.636 1
1 633 . 13 1 1 A 70 70 ILE H H 70 7.460 7.484 -0.024 1
1 634 . 13 1 1 A 70 70 ILE HA H 70 3.210 3.778 -0.568 1
1 644 . 13 1 1 A 70 70 ILE CA C 70 60.157 63.587 -3.430 1
1 645 . 13 1 1 A 70 70 ILE CB C 70 34.754 38.406 -3.652 1
1 649 . 13 1 1 A 70 70 ILE N N 70 119.821 119.085 0.736 1
1 650 . 13 1 1 A 71 71 GLN H H 71 7.368 7.846 -0.478 1
1 651 . 13 1 1 A 71 71 GLN HA H 71 4.099 4.109 -0.010 1
1 656 . 13 1 1 A 71 71 GLN CA C 71 50.906 57.847 -6.941 1
1 657 . 13 1 1 A 71 71 GLN CB C 71 28.793 27.253 1.540 1
1 659 . 13 1 1 A 71 71 GLN N N 71 124.287 119.940 4.347 1
1 660 . 13 1 1 A 72 72 ARG H H 72 7.583 8.729 -1.146 1
1 661 . 13 1 1 A 72 72 ARG HA H 72 3.907 4.493 -0.586 1
1 668 . 13 1 1 A 72 72 ARG CA C 72 54.527 57.712 -3.185 1
1 669 . 13 1 1 A 72 72 ARG CB C 72 27.470 31.778 -4.308 1
1 672 . 13 1 1 A 72 72 ARG N N 72 119.007 122.673 -3.666 1
1 673 . 13 1 1 A 73 73 GLU H H 73 9.262 7.761 1.501 1
1 674 . 13 1 1 A 73 73 GLU HA H 73 3.586 4.541 -0.955 1
1 679 . 13 1 1 A 73 73 GLU CA C 73 55.703 56.084 -0.381 1
1 680 . 13 1 1 A 73 73 GLU CB C 73 23.669 27.968 -4.299 1
1 682 . 13 1 1 A 73 73 GLU N N 73 115.180 118.484 -3.304 1
1 683 . 13 1 1 A 74 74 SER H H 74 7.551 8.186 -0.635 1
1 684 . 13 1 1 A 74 74 SER HA H 74 4.613 5.247 -0.634 1
1 687 . 13 1 1 A 74 74 SER CA C 74 58.305 56.881 1.424 1
1 688 . 13 1 1 A 74 74 SER CB C 74 62.156 65.978 -3.822 1
1 689 . 13 1 1 A 74 74 SER N N 74 115.104 117.641 -2.537 1
1 690 . 13 1 1 A 75 75 THR H H 75 8.785 8.982 -0.197 1
1 691 . 13 1 1 A 75 75 THR HA H 75 5.014 5.030 -0.016 1
1 696 . 13 1 1 A 75 75 THR CA C 75 59.835 61.396 -1.561 1
1 697 . 13 1 1 A 75 75 THR CB C 75 67.258 69.055 -1.797 1
1 699 . 13 1 1 A 75 75 THR N N 75 118.401 117.606 0.795 1
1 700 . 13 1 1 A 76 76 LEU H H 76 9.447 10.039 -0.592 1
1 701 . 13 1 1 A 76 76 LEU HA H 76 4.930 4.905 0.025 1
1 711 . 13 1 1 A 76 76 LEU CA C 76 51.107 54.038 -2.931 1
1 712 . 13 1 1 A 76 76 LEU CB C 76 40.841 41.456 -0.615 1
1 716 . 13 1 1 A 76 76 LEU N N 76 127.905 127.669 0.236 1
1 717 . 13 1 1 A 77 77 HIS HA H 77 4.976 4.787 0.189 1
1 720 . 13 1 1 A 77 77 HIS CA C 77 53.776 57.056 -3.280 1
1 721 . 13 1 1 A 77 77 HIS CB C 77 28.438 29.135 -0.697 1
1 722 . 13 1 1 A 78 78 LEU H H 78 8.450 8.767 -0.317 1
1 723 . 13 1 1 A 78 78 LEU HA H 78 5.085 5.403 -0.318 1
1 733 . 13 1 1 A 78 78 LEU CA C 78 50.896 53.365 -2.469 1
1 734 . 13 1 1 A 78 78 LEU CB C 78 41.916 46.405 -4.489 1
1 738 . 13 1 1 A 78 78 LEU N N 78 126.178 127.470 -1.292 1
1 739 . 13 1 1 A 79 79 VAL H H 79 9.093 9.191 -0.098 1
1 740 . 13 1 1 A 79 79 VAL HA H 79 4.053 4.819 -0.766 1
1 748 . 13 1 1 A 79 79 VAL CA C 79 59.054 59.633 -0.579 1
1 749 . 13 1 1 A 79 79 VAL CB C 79 32.115 35.274 -3.159 1
1 752 . 13 1 1 A 79 79 VAL N N 79 128.372 119.539 8.833 1
1 753 . 13 1 1 A 80 80 LEU H H 80 8.000 8.949 -0.949 1
1 754 . 13 1 1 A 80 80 LEU HA H 80 5.105 4.933 0.172 1
1 764 . 13 1 1 A 80 80 LEU CA C 80 50.556 53.438 -2.882 1
1 765 . 13 1 1 A 80 80 LEU CB C 80 39.597 43.008 -3.411 1
1 769 . 13 1 1 A 80 80 LEU N N 80 126.145 127.159 -1.014 1
1 770 . 13 1 1 A 81 81 ARG H H 81 8.470 8.502 -0.032 1
1 771 . 13 1 1 A 81 81 ARG HA H 81 4.197 4.593 -0.396 1
1 778 . 13 1 1 A 81 81 ARG CA C 81 53.133 56.159 -3.026 1
1 779 . 13 1 1 A 81 81 ARG CB C 81 28.413 31.347 -2.934 1
1 782 . 13 1 1 A 81 81 ARG N N 81 121.625 124.720 -3.095 1
1 783 . 13 1 1 A 82 82 LEU H H 82 8.454 8.775 -0.321 1
1 784 . 13 1 1 A 82 82 LEU HA H 82 4.339 4.943 -0.604 1
1 794 . 13 1 1 A 82 82 LEU CA C 82 52.081 53.629 -1.548 1
1 795 . 13 1 1 A 82 82 LEU CB C 82 39.810 45.675 -5.865 1
1 799 . 13 1 1 A 82 82 LEU N N 82 123.832 124.763 -0.931 1
1 800 . 13 1 1 A 83 83 ARG H H 83 8.404 8.804 -0.400 1
1 801 . 13 1 1 A 83 83 ARG HA H 83 4.308 4.153 0.155 1
1 808 . 13 1 1 A 83 83 ARG CA C 83 53.258 56.551 -3.293 1
1 809 . 13 1 1 A 83 83 ARG CB C 83 28.160 29.135 -0.975 1
1 812 . 13 1 1 A 83 83 ARG N N 83 121.447 124.992 -3.545 1
1 813 . 13 1 1 A 84 84 GLY H H 84 8.410 8.195 0.215 1
1 814 . 13 1 1 A 84 84 GLY HA2 H 84 3.929 4.079 -0.150 1
1 815 . 13 1 1 A 84 84 GLY HA3 H 84 3.929 4.079 -0.150 1
1 816 . 13 1 1 A 84 84 GLY CA C 84 42.751 45.527 -2.776 1
1 817 . 13 1 1 A 84 84 GLY N N 84 110.030 107.926 2.104 1
1 818 . 13 1 1 A 85 85 GLY H H 85 8.295 8.114 0.181 1
1 819 . 13 1 1 A 85 85 GLY HA2 H 85 3.950 3.902 0.048 1
1 820 . 13 1 1 A 85 85 GLY HA3 H 85 3.950 3.903 0.047 1
1 821 . 13 1 1 A 85 85 GLY CA C 85 42.831 46.926 -4.095 1
1 822 . 13 1 1 A 85 85 GLY N N 85 108.838 109.859 -1.021 1
1 823 . 13 1 1 A 86 86 SER H H 86 8.292 7.961 0.331 1
1 824 . 13 1 1 A 86 86 SER HA H 86 4.405 4.675 -0.270 1
1 827 . 13 1 1 A 86 86 SER CA C 86 55.965 57.910 -1.945 1
1 828 . 13 1 1 A 86 86 SER CB C 86 61.232 64.271 -3.039 1
1 829 . 13 1 1 A 86 86 SER N N 86 116.028 113.853 2.175 1
1 830 . 13 1 1 A 87 87 MET H H 87 8.470 8.002 0.468 1
1 831 . 13 1 1 A 87 87 MET HA H 87 4.447 4.262 0.185 1
1 836 . 13 1 1 A 87 87 MET CA C 87 53.281 58.244 -4.963 1
1 837 . 13 1 1 A 87 87 MET CB C 87 29.788 33.433 -3.645 1
1 839 . 13 1 1 A 87 87 MET N N 87 121.625 121.074 0.551 1
1 840 . 13 1 1 A 88 88 GLY H H 88 8.320 7.268 1.052 1
1 841 . 13 1 1 A 88 88 GLY HA2 H 88 3.919 4.080 -0.161 1
1 842 . 13 1 1 A 88 88 GLY HA3 H 88 3.896 4.081 -0.185 1
1 843 . 13 1 1 A 88 88 GLY CA C 88 43.060 45.735 -2.675 1
1 844 . 13 1 1 A 88 88 GLY N N 88 109.625 105.396 4.229 1
1 845 . 13 1 1 A 89 89 GLY H H 89 8.256 9.081 -0.825 1
1 846 . 13 1 1 A 89 89 GLY HA2 H 89 3.940 3.887 0.053 1
1 847 . 13 1 1 A 89 89 GLY HA3 H 89 3.910 3.888 0.022 1
1 848 . 13 1 1 A 89 89 GLY CA C 89 42.678 47.108 -4.430 1
1 849 . 13 1 1 A 89 89 GLY N N 89 108.982 109.476 -0.494 1
1 850 . 13 1 1 A 90 90 ALA H H 90 8.203 7.820 0.383 1
1 851 . 13 1 1 A 90 90 ALA HA H 90 4.255 4.117 0.138 1
1 855 . 13 1 1 A 90 90 ALA CA C 90 50.763 54.863 -4.100 1
1 856 . 13 1 1 A 90 90 ALA CB C 90 16.364 19.161 -2.797 1
1 857 . 13 1 1 A 90 90 ALA N N 90 124.065 122.805 1.260 1
1 858 . 13 1 1 A 91 91 ALA H H 91 8.273 7.866 0.407 1
1 859 . 13 1 1 A 91 91 ALA HA H 91 4.204 4.596 -0.392 1
1 863 . 13 1 1 A 91 91 ALA CA C 91 51.080 50.756 0.324 1
1 864 . 13 1 1 A 91 91 ALA CB C 91 16.036 20.563 -4.527 1
1 865 . 13 1 1 A 91 91 ALA N N 91 121.985 119.496 2.489 1
1 866 . 13 1 1 A 92 92 ASP H H 92 8.022 9.280 -1.258 1
1 867 . 13 1 1 A 92 92 ASP HA H 92 4.455 4.890 -0.435 1
1 870 . 13 1 1 A 92 92 ASP CA C 92 52.664 55.306 -2.642 1
1 871 . 13 1 1 A 92 92 ASP CB C 92 37.925 42.842 -4.917 1
1 872 . 13 1 1 A 92 92 ASP N N 92 118.621 121.725 -3.104 1
1 873 . 13 1 1 A 93 93 GLU H H 93 8.282 8.031 0.251 1
1 874 . 13 1 1 A 93 93 GLU HA H 93 3.912 4.629 -0.717 1
1 879 . 13 1 1 A 93 93 GLU CA C 93 56.947 57.863 -0.916 1
1 880 . 13 1 1 A 93 93 GLU CB C 93 27.413 32.314 -4.901 1
1 882 . 13 1 1 A 93 93 GLU N N 93 122.247 116.037 6.210 1
1 883 . 13 1 1 A 94 94 GLU H H 94 8.194 8.280 -0.086 1
1 884 . 13 1 1 A 94 94 GLU HA H 94 3.940 4.447 -0.507 1
1 889 . 13 1 1 A 94 94 GLU CA C 94 56.681 57.555 -0.874 1
1 890 . 13 1 1 A 94 94 GLU CB C 94 26.127 30.965 -4.838 1
1 892 . 13 1 1 A 94 94 GLU N N 94 118.024 118.593 -0.569 1
1 893 . 13 1 1 A 95 95 GLU H H 95 7.816 8.249 -0.433 1
1 894 . 13 1 1 A 95 95 GLU HA H 95 4.121 4.173 -0.052 1
1 898 . 13 1 1 A 95 95 GLU CA C 95 56.162 58.598 -2.436 1
1 899 . 13 1 1 A 95 95 GLU CB C 95 26.403 28.091 -1.688 1
1 901 . 13 1 1 A 95 95 GLU N N 95 120.028 118.344 1.684 1
1 902 . 13 1 1 A 96 96 LEU H H 96 7.637 7.766 -0.129 1
1 903 . 13 1 1 A 96 96 LEU HA H 96 3.988 4.117 -0.129 1
1 913 . 13 1 1 A 96 96 LEU CA C 96 55.303 57.015 -1.712 1
1 914 . 13 1 1 A 96 96 LEU CB C 96 39.038 41.558 -2.520 1
1 918 . 13 1 1 A 96 96 LEU N N 96 119.866 118.164 1.702 1
1 919 . 13 1 1 A 97 97 ILE H H 97 8.044 7.723 0.321 1
1 920 . 13 1 1 A 97 97 ILE HA H 97 3.478 3.977 -0.499 1
1 930 . 13 1 1 A 97 97 ILE CA C 97 62.054 63.794 -1.740 1
1 931 . 13 1 1 A 97 97 ILE CB C 97 34.541 37.931 -3.390 1
1 935 . 13 1 1 A 97 97 ILE N N 97 119.088 119.769 -0.681 1
1 936 . 13 1 1 A 98 98 ARG H H 98 7.991 8.346 -0.355 1
1 937 . 13 1 1 A 98 98 ARG HA H 98 3.793 4.057 -0.264 1
1 944 . 13 1 1 A 98 98 ARG CA C 98 57.509 58.872 -1.363 1
1 945 . 13 1 1 A 98 98 ARG CB C 98 27.191 30.138 -2.947 1
1 948 . 13 1 1 A 98 98 ARG N N 98 119.225 120.686 -1.461 1
1 949 . 13 1 1 A 99 99 LYS H H 99 8.101 7.718 0.383 1
1 950 . 13 1 1 A 99 99 LYS HA H 99 3.968 4.078 -0.110 1
1 959 . 13 1 1 A 99 99 LYS CA C 99 56.455 59.096 -2.641 1
1 960 . 13 1 1 A 99 99 LYS CB C 99 29.531 31.924 -2.393 1
1 964 . 13 1 1 A 99 99 LYS N N 99 119.464 118.337 1.127 1
1 965 . 13 1 1 A 100 100 ALA H H 100 8.167 7.961 0.206 1
1 966 . 13 1 1 A 100 100 ALA HA H 100 3.789 4.183 -0.394 1
1 970 . 13 1 1 A 100 100 ALA CA C 100 52.451 54.228 -1.777 1
1 971 . 13 1 1 A 100 100 ALA CB C 100 16.259 18.346 -2.087 1
1 972 . 13 1 1 A 100 100 ALA N N 100 122.398 121.614 0.784 1
1 973 . 13 1 1 A 101 101 ILE H H 101 8.777 7.347 1.430 1
1 974 . 13 1 1 A 101 101 ILE HA H 101 3.191 3.770 -0.579 1
1 984 . 13 1 1 A 101 101 ILE CA C 101 62.910 64.247 -1.337 1
1 985 . 13 1 1 A 101 101 ILE CB C 101 34.544 37.659 -3.115 1
1 989 . 13 1 1 A 101 101 ILE N N 101 120.431 117.272 3.159 1
1 990 . 13 1 1 A 102 102 GLU H H 102 7.890 7.677 0.213 1
1 991 . 13 1 1 A 102 102 GLU HA H 102 3.848 4.217 -0.369 1
1 996 . 13 1 1 A 102 102 GLU CA C 102 57.079 57.776 -0.697 1
1 997 . 13 1 1 A 102 102 GLU CB C 102 26.769 30.029 -3.260 1
1 999 . 13 1 1 A 102 102 GLU N N 102 120.248 120.034 0.214 1
1 1000 . 13 1 1 A 103 103 LEU H H 103 8.194 7.704 0.490 1
1 1001 . 13 1 1 A 103 103 LEU HA H 103 3.912 4.316 -0.404 1
1 1011 . 13 1 1 A 103 103 LEU CA C 103 55.078 56.242 -1.164 1
1 1012 . 13 1 1 A 103 103 LEU CB C 103 38.963 42.508 -3.545 1
1 1016 . 13 1 1 A 103 103 LEU N N 103 120.341 117.105 3.236 1
1 1017 . 13 1 1 A 104 104 SER H H 104 8.268 8.025 0.243 1
1 1018 . 13 1 1 A 104 104 SER HA H 104 4.120 4.409 -0.289 1
1 1021 . 13 1 1 A 104 104 SER CA C 104 58.301 58.952 -0.651 1
1 1022 . 13 1 1 A 104 104 SER CB C 104 60.193 63.559 -3.366 1
1 1023 . 13 1 1 A 104 104 SER N N 104 115.150 114.910 0.240 1
1 1024 . 13 1 1 A 105 105 LEU H H 105 7.501 7.601 -0.100 1
1 1025 . 13 1 1 A 105 105 LEU HA H 105 4.041 3.953 0.088 1
1 1035 . 13 1 1 A 105 105 LEU CA C 105 53.995 56.493 -2.498 1
1 1036 . 13 1 1 A 105 105 LEU CB C 105 39.597 42.130 -2.533 1
1 1040 . 13 1 1 A 105 105 LEU N N 105 124.223 119.200 5.023 1
1 1041 . 13 1 1 A 106 106 LYS H H 106 7.542 7.925 -0.383 1
1 1042 . 13 1 1 A 106 106 LYS HA H 106 4.090 4.078 0.012 1
1 1050 . 13 1 1 A 106 106 LYS CA C 106 55.495 58.542 -3.047 1
1 1051 . 13 1 1 A 106 106 LYS CB C 106 29.941 31.794 -1.853 1
1 1055 . 13 1 1 A 106 106 LYS N N 106 120.328 119.127 1.201 1
1 1056 . 13 1 1 A 107 107 GLU H H 107 7.884 8.190 -0.306 1
1 1057 . 13 1 1 A 107 107 GLU HA H 107 4.210 4.030 0.180 1
1 1060 . 13 1 1 A 107 107 GLU CA C 107 54.509 59.156 -4.647 1
1 1061 . 13 1 1 A 107 107 GLU CB C 107 27.239 29.504 -2.265 1
1 1062 . 13 1 1 A 107 107 GLU N N 107 118.621 119.396 -0.775 1
1 1063 . 13 1 1 A 108 108 SER H H 108 7.923 7.785 0.138 1
1 1064 . 13 1 1 A 108 108 SER HA H 108 4.385 4.262 0.123 1
1 1067 . 13 1 1 A 108 108 SER CA C 108 56.442 60.359 -3.917 1
1 1068 . 13 1 1 A 108 108 SER CB C 108 60.953 62.882 -1.929 1
1 1069 . 13 1 1 A 108 108 SER N N 108 115.670 115.656 0.014 1
1 1070 . 13 1 1 A 109 109 ARG H H 109 8.068 7.800 0.268 1
1 1071 . 13 1 1 A 109 109 ARG HA H 109 4.307 3.921 0.386 1
1 1078 . 13 1 1 A 109 109 ARG CA C 109 53.732 59.600 -5.868 1
1 1079 . 13 1 1 A 109 109 ARG CB C 109 27.968 29.615 -1.647 1
1 1082 . 13 1 1 A 109 109 ARG N N 109 122.313 122.032 0.281 1
1 1083 . 13 1 1 A 110 110 ASN H H 110 8.292 8.191 0.101 1
1 1084 . 13 1 1 A 110 110 ASN HA H 110 4.720 4.508 0.212 1
1 1087 . 13 1 1 A 110 110 ASN CA C 110 50.750 56.081 -5.331 1
1 1088 . 13 1 1 A 110 110 ASN CB C 110 36.197 38.408 -2.211 1
1 1089 . 13 1 1 A 110 110 ASN N N 110 119.304 118.470 0.834 1
1 1090 . 13 1 1 A 111 111 SER H H 111 8.244 7.890 0.354 1
1 1091 . 13 1 1 A 111 111 SER HA H 111 4.423 5.052 -0.629 1
1 1094 . 13 1 1 A 111 111 SER CA C 111 55.990 58.418 -2.428 1
1 1095 . 13 1 1 A 111 111 SER CB C 111 61.027 63.759 -2.732 1
1 1096 . 13 1 1 A 111 111 SER N N 111 116.119 112.616 3.503 1
1 1097 . 13 1 1 A 112 112 GLY H H 112 8.327 8.398 -0.071 1
1 1098 . 13 1 1 A 112 112 GLY HA2 H 112 3.944 3.850 0.094 1
1 1099 . 13 1 1 A 112 112 GLY HA3 H 112 3.912 3.865 0.047 1
1 1100 . 13 1 1 A 112 112 GLY CA C 112 42.733 47.264 -4.531 1
1 1101 . 13 1 1 A 112 112 GLY N N 112 110.442 110.131 0.311 1
1 1102 . 13 1 1 A 113 113 GLY H H 113 8.097 8.263 -0.166 1
1 1103 . 13 1 1 A 113 113 GLY HA2 H 113 3.831 3.636 0.195 1
1 1104 . 13 1 1 A 113 113 GLY HA3 H 113 3.785 3.800 -0.015 1
1 1105 . 13 1 1 A 113 113 GLY CA C 113 42.435 45.858 -3.423 1
1 1106 . 13 1 1 A 113 113 GLY N N 113 108.745 109.666 -0.921 1
1 2 . 14 1 1 A 3 3 HIS CB C 3 33.709 31.413 2.296 1
1 3 . 14 1 1 A 7 7 HIS H H 7 8.731 8.007 0.724 1
1 4 . 14 1 1 A 7 7 HIS HA H 7 4.564 4.322 0.242 1
1 7 . 14 1 1 A 7 7 HIS CA C 7 53.649 56.632 -2.983 1
1 8 . 14 1 1 A 7 7 HIS CB C 7 26.268 30.082 -3.814 1
1 9 . 14 1 1 A 7 7 HIS N N 7 121.126 117.496 3.630 1
1 10 . 14 1 1 A 8 8 GLY H H 8 8.540 8.430 0.110 1
1 11 . 14 1 1 A 8 8 GLY HA2 H 8 3.973 3.812 0.161 1
1 12 . 14 1 1 A 8 8 GLY HA3 H 8 3.811 3.845 -0.034 1
1 13 . 14 1 1 A 8 8 GLY CA C 8 42.618 46.319 -3.701 1
1 14 . 14 1 1 A 8 8 GLY N N 8 110.662 108.064 2.598 1
1 15 . 14 1 1 A 9 9 GLU H H 9 8.239 8.204 0.035 1
1 16 . 14 1 1 A 9 9 GLU HA H 9 4.568 4.262 0.306 1
1 18 . 14 1 1 A 9 9 GLU CA C 9 53.605 54.554 -0.949 1
1 19 . 14 1 1 A 9 9 GLU CB C 9 28.019 32.193 -4.174 1
1 20 . 14 1 1 A 9 9 GLU N N 9 121.669 120.573 1.096 1
1 21 . 14 1 1 A 10 10 PHE H H 10 8.785 8.367 0.418 1
1 22 . 14 1 1 A 10 10 PHE HA H 10 4.850 5.223 -0.373 1
1 25 . 14 1 1 A 10 10 PHE CA C 10 52.630 56.642 -4.012 1
1 26 . 14 1 1 A 10 10 PHE CB C 10 37.906 41.116 -3.210 1
1 27 . 14 1 1 A 10 10 PHE N N 10 118.401 121.393 -2.992 1
1 28 . 14 1 1 A 11 11 GLN H H 11 8.552 9.330 -0.778 1
1 29 . 14 1 1 A 11 11 GLN HA H 11 5.425 5.315 0.110 1
1 34 . 14 1 1 A 11 11 GLN CA C 11 51.663 54.067 -2.404 1
1 35 . 14 1 1 A 11 11 GLN CB C 11 28.427 30.709 -2.282 1
1 37 . 14 1 1 A 11 11 GLN N N 11 117.519 120.363 -2.844 1
1 38 . 14 1 1 A 12 12 ILE H H 12 8.239 8.250 -0.011 1
1 39 . 14 1 1 A 12 12 ILE HA H 12 4.103 4.958 -0.855 1
1 49 . 14 1 1 A 12 12 ILE CA C 12 57.134 60.056 -2.922 1
1 50 . 14 1 1 A 12 12 ILE CB C 12 39.491 39.917 -0.426 1
1 54 . 14 1 1 A 12 12 ILE N N 12 114.043 121.635 -7.592 1
1 55 . 14 1 1 A 13 13 PHE H H 13 8.538 8.819 -0.281 1
1 56 . 14 1 1 A 13 13 PHE HA H 13 5.620 5.404 0.216 1
1 59 . 14 1 1 A 13 13 PHE CA C 13 52.438 56.417 -3.979 1
1 60 . 14 1 1 A 13 13 PHE CB C 13 39.253 42.425 -3.172 1
1 61 . 14 1 1 A 13 13 PHE N N 13 117.015 119.693 -2.678 1
1 62 . 14 1 1 A 14 14 ALA H H 14 9.238 9.569 -0.331 1
1 63 . 14 1 1 A 14 14 ALA HA H 14 5.311 5.408 -0.097 1
1 67 . 14 1 1 A 14 14 ALA CA C 14 47.183 49.845 -2.662 1
1 68 . 14 1 1 A 14 14 ALA CB C 14 17.811 22.178 -4.367 1
1 69 . 14 1 1 A 14 14 ALA N N 14 123.503 125.943 -2.440 1
1 70 . 14 1 1 A 15 15 LYS H H 15 8.810 9.244 -0.434 1
1 71 . 14 1 1 A 15 15 LYS HA H 15 5.511 5.320 0.191 1
1 80 . 14 1 1 A 15 15 LYS CA C 15 51.718 54.577 -2.859 1
1 81 . 14 1 1 A 15 15 LYS CB C 15 33.635 35.695 -2.060 1
1 85 . 14 1 1 A 15 15 LYS N N 15 123.382 122.650 0.732 1
1 86 . 14 1 1 A 16 16 THR H H 16 8.830 8.480 0.350 1
1 87 . 14 1 1 A 16 16 THR HA H 16 5.212 4.760 0.452 1
1 92 . 14 1 1 A 16 16 THR CA C 16 57.614 60.672 -3.058 1
1 93 . 14 1 1 A 16 16 THR CB C 16 68.210 71.208 -2.998 1
1 95 . 14 1 1 A 16 16 THR N N 16 116.517 116.267 0.250 1
1 96 . 14 1 1 A 17 17 LEU H H 17 9.428 8.827 0.601 1
1 97 . 14 1 1 A 17 17 LEU HA H 17 4.286 4.268 0.018 1
1 107 . 14 1 1 A 17 17 LEU CA C 17 54.504 57.114 -2.610 1
1 108 . 14 1 1 A 17 17 LEU CB C 17 38.564 42.068 -3.504 1
1 112 . 14 1 1 A 17 17 LEU N N 17 121.786 123.274 -1.488 1
1 113 . 14 1 1 A 18 18 THR H H 18 7.546 7.721 -0.175 1
1 114 . 14 1 1 A 18 18 THR HA H 18 4.391 4.383 0.008 1
1 119 . 14 1 1 A 18 18 THR CA C 18 58.524 62.624 -4.100 1
1 120 . 14 1 1 A 18 18 THR CB C 18 66.166 70.579 -4.413 1
1 122 . 14 1 1 A 18 18 THR N N 18 105.598 108.258 -2.660 1
1 123 . 14 1 1 A 19 19 GLY H H 19 7.683 8.015 -0.332 1
1 124 . 14 1 1 A 19 19 GLY HA2 H 19 3.300 3.975 -0.675 1
1 125 . 14 1 1 A 19 19 GLY HA3 H 19 4.248 3.982 0.266 1
1 126 . 14 1 1 A 19 19 GLY CA C 19 42.947 45.506 -2.559 1
1 127 . 14 1 1 A 19 19 GLY N N 19 109.243 111.580 -2.337 1
1 128 . 14 1 1 A 20 20 LYS H H 20 7.375 7.433 -0.058 1
1 129 . 14 1 1 A 20 20 LYS HA H 20 4.331 4.622 -0.291 1
1 138 . 14 1 1 A 20 20 LYS CA C 20 53.829 55.224 -1.395 1
1 139 . 14 1 1 A 20 20 LYS CB C 20 30.385 34.035 -3.650 1
1 143 . 14 1 1 A 20 20 LYS N N 20 122.757 121.409 1.348 1
1 144 . 14 1 1 A 21 21 THR H H 21 8.637 8.817 -0.180 1
1 145 . 14 1 1 A 21 21 THR HA H 21 4.852 4.934 -0.082 1
1 150 . 14 1 1 A 21 21 THR CA C 21 59.846 62.325 -2.479 1
1 151 . 14 1 1 A 21 21 THR CB C 21 67.140 70.252 -3.112 1
1 153 . 14 1 1 A 21 21 THR N N 21 121.524 123.028 -1.504 1
1 154 . 14 1 1 A 22 22 ILE H H 22 9.509 9.344 0.165 1
1 155 . 14 1 1 A 22 22 ILE HA H 22 4.349 4.853 -0.504 1
1 165 . 14 1 1 A 22 22 ILE CA C 22 57.634 60.128 -2.494 1
1 166 . 14 1 1 A 22 22 ILE CB C 22 38.334 41.798 -3.464 1
1 170 . 14 1 1 A 22 22 ILE N N 22 129.772 127.182 2.590 1
1 171 . 14 1 1 A 23 23 THR H H 23 8.838 8.790 0.048 1
1 172 . 14 1 1 A 23 23 THR HA H 23 4.653 4.601 0.052 1
1 177 . 14 1 1 A 23 23 THR CA C 23 60.194 61.919 -1.725 1
1 178 . 14 1 1 A 23 23 THR CB C 23 66.577 69.245 -2.668 1
1 180 . 14 1 1 A 23 23 THR N N 23 124.070 123.965 0.105 1
1 181 . 14 1 1 A 24 24 LEU H H 24 8.749 8.745 0.004 1
1 182 . 14 1 1 A 24 24 LEU HA H 24 4.619 5.011 -0.392 1
1 192 . 14 1 1 A 24 24 LEU CA C 24 50.257 52.622 -2.365 1
1 193 . 14 1 1 A 24 24 LEU CB C 24 42.932 45.422 -2.490 1
1 197 . 14 1 1 A 24 24 LEU N N 24 126.499 124.047 2.452 1
1 198 . 14 1 1 A 25 25 GLU H H 25 7.990 8.501 -0.511 1
1 199 . 14 1 1 A 25 25 GLU HA H 25 4.591 4.779 -0.188 1
1 204 . 14 1 1 A 25 25 GLU CA C 25 52.845 56.108 -3.263 1
1 205 . 14 1 1 A 25 25 GLU CB C 25 27.210 30.460 -3.250 1
1 207 . 14 1 1 A 25 25 GLU N N 25 121.644 120.436 1.208 1
1 208 . 14 1 1 A 26 26 VAL H H 26 8.657 8.594 0.063 1
1 209 . 14 1 1 A 26 26 VAL HA H 26 4.403 4.849 -0.446 1
1 217 . 14 1 1 A 26 26 VAL CA C 26 56.020 58.796 -2.776 1
1 218 . 14 1 1 A 26 26 VAL CB C 26 33.631 35.816 -2.185 1
1 221 . 14 1 1 A 26 26 VAL N N 26 116.647 117.900 -1.253 1
1 222 . 14 1 1 A 27 27 GLU H H 27 7.970 8.545 -0.575 1
1 223 . 14 1 1 A 27 27 GLU HA H 27 4.447 4.523 -0.076 1
1 228 . 14 1 1 A 27 27 GLU CA C 27 51.386 56.711 -5.325 1
1 229 . 14 1 1 A 27 27 GLU CB C 27 30.905 30.797 0.108 1
1 231 . 14 1 1 A 27 27 GLU N N 27 115.496 122.922 -7.426 1
1 232 . 14 1 1 A 28 28 SER H H 28 9.192 9.019 0.173 1
1 233 . 14 1 1 A 28 28 SER HA H 28 4.108 4.102 0.006 1
1 236 . 14 1 1 A 28 28 SER CA C 28 59.909 60.935 -1.026 1
1 237 . 14 1 1 A 28 28 SER CB C 28 60.399 62.482 -2.083 1
1 238 . 14 1 1 A 28 28 SER N N 28 117.720 118.453 -0.733 1
1 239 . 14 1 1 A 29 29 SER H H 29 7.371 7.863 -0.492 1
1 240 . 14 1 1 A 29 29 SER HA H 29 4.327 4.648 -0.321 1
1 243 . 14 1 1 A 29 29 SER CA C 29 54.805 57.391 -2.586 1
1 244 . 14 1 1 A 29 29 SER CB C 29 60.775 63.790 -3.015 1
1 245 . 14 1 1 A 29 29 SER N N 29 108.936 114.781 -5.845 1
1 246 . 14 1 1 A 30 30 ASP H H 30 7.852 7.678 0.174 1
1 247 . 14 1 1 A 30 30 ASP HA H 30 4.591 4.498 0.093 1
1 250 . 14 1 1 A 30 30 ASP CA C 30 53.040 55.012 -1.972 1
1 251 . 14 1 1 A 30 30 ASP CB C 30 37.942 41.478 -3.536 1
1 252 . 14 1 1 A 30 30 ASP N N 30 123.735 121.816 1.919 1
1 253 . 14 1 1 A 31 31 THR H H 31 7.852 8.236 -0.384 1
1 254 . 14 1 1 A 31 31 THR HA H 31 4.918 4.973 -0.055 1
1 259 . 14 1 1 A 31 31 THR CA C 31 56.929 59.657 -2.728 1
1 260 . 14 1 1 A 31 31 THR CB C 31 68.674 72.142 -3.468 1
1 262 . 14 1 1 A 31 31 THR N N 31 109.181 112.379 -3.198 1
1 263 . 14 1 1 A 32 32 ILE H H 32 8.582 8.752 -0.170 1
1 264 . 14 1 1 A 32 32 ILE HA H 32 3.624 3.814 -0.190 1
1 274 . 14 1 1 A 32 32 ILE CA C 32 59.474 65.496 -6.022 1
1 275 . 14 1 1 A 32 32 ILE CB C 32 31.561 37.839 -6.278 1
1 279 . 14 1 1 A 32 32 ILE N N 32 121.833 122.860 -1.027 1
1 280 . 14 1 1 A 33 33 ASP H H 33 9.255 8.154 1.101 1
1 281 . 14 1 1 A 33 33 ASP HA H 33 4.201 4.262 -0.061 1
1 284 . 14 1 1 A 33 33 ASP CA C 33 54.679 57.734 -3.055 1
1 285 . 14 1 1 A 33 33 ASP CB C 33 37.700 41.050 -3.350 1
1 286 . 14 1 1 A 33 33 ASP N N 33 119.823 120.558 -0.735 1
1 287 . 14 1 1 A 34 34 ASN H H 34 8.026 7.619 0.407 1
1 288 . 14 1 1 A 34 34 ASN HA H 34 4.409 4.604 -0.195 1
1 291 . 14 1 1 A 34 34 ASN CA C 34 53.324 56.368 -3.044 1
1 292 . 14 1 1 A 34 34 ASN CB C 34 35.782 38.872 -3.090 1
1 293 . 14 1 1 A 34 34 ASN N N 34 119.540 117.583 1.957 1
1 294 . 14 1 1 A 35 35 VAL H H 35 8.167 7.980 0.187 1
1 295 . 14 1 1 A 35 35 VAL HA H 35 3.249 3.450 -0.201 1
1 303 . 14 1 1 A 35 35 VAL CA C 35 65.308 67.172 -1.864 1
1 304 . 14 1 1 A 35 35 VAL CB C 35 27.965 31.648 -3.683 1
1 307 . 14 1 1 A 35 35 VAL N N 35 122.223 120.019 2.204 1
1 308 . 14 1 1 A 36 36 LYS H H 36 8.460 8.387 0.073 1
1 313 . 14 1 1 A 36 36 LYS CB C 36 30.753 32.227 -1.474 1
1 315 . 14 1 1 A 36 36 LYS N N 36 119.438 119.238 0.200 1
1 316 . 14 1 1 A 37 37 SER H H 37 8.196 8.466 -0.270 1
1 317 . 14 1 1 A 37 37 SER HA H 37 4.130 4.170 -0.040 1
1 320 . 14 1 1 A 37 37 SER CA C 37 58.528 61.180 -2.652 1
1 321 . 14 1 1 A 37 37 SER CB C 37 59.768 62.618 -2.850 1
1 322 . 14 1 1 A 37 37 SER N N 37 117.791 114.150 3.641 1
1 323 . 14 1 1 A 38 38 LYS H H 38 8.043 8.013 0.030 1
1 324 . 14 1 1 A 38 38 LYS HA H 38 4.095 3.990 0.105 1
1 325 . 14 1 1 A 38 38 LYS CA C 38 57.377 58.971 -1.594 1
1 326 . 14 1 1 A 38 38 LYS N N 38 124.094 120.983 3.111 1
1 327 . 14 1 1 A 39 39 ILE H H 39 8.254 8.197 0.057 1
1 328 . 14 1 1 A 39 39 ILE HA H 39 3.439 3.707 -0.268 1
1 338 . 14 1 1 A 39 39 ILE CA C 39 63.977 65.121 -1.144 1
1 339 . 14 1 1 A 39 39 ILE CB C 39 33.935 37.414 -3.479 1
1 343 . 14 1 1 A 39 39 ILE N N 39 122.107 120.553 1.554 1
1 344 . 14 1 1 A 40 40 GLN H H 40 8.379 8.368 0.011 1
1 345 . 14 1 1 A 40 40 GLN HA H 40 3.746 4.309 -0.563 1
1 350 . 14 1 1 A 40 40 GLN CA C 40 57.472 58.107 -0.635 1
1 351 . 14 1 1 A 40 40 GLN CB C 40 25.072 28.154 -3.082 1
1 353 . 14 1 1 A 40 40 GLN N N 40 123.725 120.393 3.332 1
1 354 . 14 1 1 A 41 41 ASP H H 41 8.210 7.881 0.329 1
1 355 . 14 1 1 A 41 41 ASP HA H 41 4.247 4.353 -0.106 1
1 358 . 14 1 1 A 41 41 ASP CA C 41 54.646 56.650 -2.004 1
1 359 . 14 1 1 A 41 41 ASP CB C 41 38.136 40.765 -2.629 1
1 360 . 14 1 1 A 41 41 ASP N N 41 120.564 120.457 0.107 1
1 361 . 14 1 1 A 42 42 LYS H H 42 7.381 7.879 -0.498 1
1 362 . 14 1 1 A 42 42 LYS HA H 42 4.246 4.302 -0.056 1
1 369 . 14 1 1 A 42 42 LYS CA C 42 55.579 57.867 -2.288 1
1 370 . 14 1 1 A 42 42 LYS CB C 42 31.406 33.462 -2.056 1
1 373 . 14 1 1 A 42 42 LYS N N 42 115.674 116.700 -1.026 1
1 374 . 14 1 1 A 43 43 GLU H H 43 8.537 9.047 -0.510 1
1 375 . 14 1 1 A 43 43 GLU HA H 43 4.522 4.516 0.006 1
1 380 . 14 1 1 A 43 43 GLU CA C 43 52.772 55.699 -2.927 1
1 381 . 14 1 1 A 43 43 GLU CB C 43 30.535 30.920 -0.385 1
1 383 . 14 1 1 A 43 43 GLU N N 43 114.355 116.137 -1.782 1
1 384 . 14 1 1 A 44 44 GLY H H 44 8.611 8.210 0.401 1
1 385 . 14 1 1 A 44 44 GLY HA2 H 44 4.067 3.963 0.104 1
1 386 . 14 1 1 A 44 44 GLY HA3 H 44 3.819 3.964 -0.145 1
1 387 . 14 1 1 A 44 44 GLY CA C 44 43.205 45.375 -2.170 1
1 388 . 14 1 1 A 44 44 GLY N N 44 109.406 108.188 1.218 1
1 389 . 14 1 1 A 45 45 ILE H H 45 6.092 8.011 -1.919 1
1 390 . 14 1 1 A 45 45 ILE HA H 45 4.324 4.104 0.220 1
1 400 . 14 1 1 A 45 45 ILE CA C 45 55.211 60.327 -5.116 1
1 401 . 14 1 1 A 45 45 ILE CB C 45 37.903 38.142 -0.239 1
1 405 . 14 1 1 A 45 45 ILE N N 45 120.791 122.223 -1.432 1
1 406 . 14 1 1 A 46 46 PRO HA H 46 4.547 4.645 -0.098 1
1 413 . 14 1 1 A 46 46 PRO CA C 46 58.971 61.988 -3.017 1
1 414 . 14 1 1 A 46 46 PRO CB C 46 29.142 32.164 -3.022 1
1 417 . 14 1 1 A 47 47 PRO HA H 47 4.062 4.179 -0.117 1
1 424 . 14 1 1 A 47 47 PRO CA C 47 63.476 65.785 -2.309 1
1 425 . 14 1 1 A 47 47 PRO CB C 47 30.113 31.779 -1.666 1
1 428 . 14 1 1 A 48 48 ASP H H 48 8.418 9.034 -0.616 1
1 429 . 14 1 1 A 48 48 ASP HA H 48 4.346 4.442 -0.096 1
1 432 . 14 1 1 A 48 48 ASP CA C 48 52.838 55.649 -2.811 1
1 433 . 14 1 1 A 48 48 ASP CB C 48 36.926 39.340 -2.414 1
1 434 . 14 1 1 A 48 48 ASP N N 48 113.462 116.242 -2.780 1
1 435 . 14 1 1 A 49 49 GLN H H 49 7.822 8.266 -0.444 1
1 436 . 14 1 1 A 49 49 GLN HA H 49 4.283 4.495 -0.212 1
1 439 . 14 1 1 A 49 49 GLN CA C 49 52.770 55.773 -3.003 1
1 441 . 14 1 1 A 49 49 GLN N N 49 117.377 118.235 -0.858 1
1 442 . 14 1 1 A 50 50 GLN H H 50 7.451 7.913 -0.462 1
1 443 . 14 1 1 A 50 50 GLN HA H 50 4.260 4.703 -0.443 1
1 448 . 14 1 1 A 50 50 GLN CA C 50 53.725 55.318 -1.593 1
1 449 . 14 1 1 A 50 50 GLN CB C 50 29.142 30.487 -1.345 1
1 451 . 14 1 1 A 50 50 GLN N N 50 117.526 118.883 -1.357 1
1 452 . 14 1 1 A 51 51 ARG H H 51 8.534 9.058 -0.524 1
1 453 . 14 1 1 A 51 51 ARG HA H 51 4.486 5.049 -0.563 1
1 460 . 14 1 1 A 51 51 ARG CA C 51 52.492 54.738 -2.246 1
1 461 . 14 1 1 A 51 51 ARG CB C 51 29.096 33.369 -4.273 1
1 464 . 14 1 1 A 51 51 ARG N N 51 121.655 124.399 -2.744 1
1 465 . 14 1 1 A 52 52 LEU H H 52 8.683 9.154 -0.471 1
1 466 . 14 1 1 A 52 52 LEU HA H 52 5.255 5.012 0.243 1
1 476 . 14 1 1 A 52 52 LEU CA C 52 50.618 53.669 -3.051 1
1 477 . 14 1 1 A 52 52 LEU CB C 52 43.007 43.175 -0.168 1
1 481 . 14 1 1 A 52 52 LEU N N 52 122.929 126.693 -3.764 1
1 482 . 14 1 1 A 53 53 ILE H H 53 9.286 8.924 0.362 1
1 483 . 14 1 1 A 53 53 ILE HA H 53 5.096 5.050 0.046 1
1 492 . 14 1 1 A 53 53 ILE CA C 53 56.795 60.274 -3.479 1
1 496 . 14 1 1 A 53 53 ILE N N 53 124.718 124.757 -0.039 1
1 497 . 14 1 1 A 54 54 TRP H H 54 8.871 9.300 -0.429 1
1 499 . 14 1 1 A 54 54 TRP N N 54 127.412 127.925 -0.513 1
1 501 . 14 1 1 A 55 55 ALA H H 55 8.401 8.632 -0.231 1
1 502 . 14 1 1 A 55 55 ALA HA H 55 3.183 3.454 -0.271 1
1 506 . 14 1 1 A 55 55 ALA CA C 55 49.712 52.585 -2.873 1
1 507 . 14 1 1 A 55 55 ALA CB C 55 13.252 17.024 -3.772 1
1 508 . 14 1 1 A 55 55 ALA N N 55 128.894 130.100 -1.206 1
1 509 . 14 1 1 A 56 56 GLY H H 56 8.248 8.423 -0.175 1
1 510 . 14 1 1 A 56 56 GLY HA2 H 56 3.968 3.747 0.221 1
1 511 . 14 1 1 A 56 56 GLY HA3 H 56 3.916 3.758 0.158 1
1 512 . 14 1 1 A 56 56 GLY CA C 56 43.142 45.545 -2.403 1
1 513 . 14 1 1 A 56 56 GLY N N 56 101.499 102.543 -1.044 1
1 514 . 14 1 1 A 57 57 LYS H H 57 8.028 7.555 0.473 1
1 515 . 14 1 1 A 57 57 LYS HA H 57 4.609 4.835 -0.226 1
1 522 . 14 1 1 A 57 57 LYS CA C 57 51.928 54.043 -2.115 1
1 523 . 14 1 1 A 57 57 LYS CB C 57 32.613 35.670 -3.057 1
1 526 . 14 1 1 A 57 57 LYS N N 57 118.995 120.333 -1.338 1
1 527 . 14 1 1 A 58 58 GLN H H 58 8.607 8.321 0.286 1
1 528 . 14 1 1 A 58 58 GLN HA H 58 4.617 4.648 -0.031 1
1 533 . 14 1 1 A 58 58 GLN CA C 58 53.261 55.903 -2.642 1
1 534 . 14 1 1 A 58 58 GLN CB C 58 26.613 29.287 -2.674 1
1 536 . 14 1 1 A 58 58 GLN N N 58 119.825 121.813 -1.988 1
1 537 . 14 1 1 A 59 59 LEU H H 59 8.653 9.408 -0.755 1
1 538 . 14 1 1 A 59 59 LEU HA H 59 4.138 4.365 -0.227 1
1 548 . 14 1 1 A 59 59 LEU CA C 59 51.991 55.037 -3.046 1
1 549 . 14 1 1 A 59 59 LEU CB C 59 39.006 42.214 -3.208 1
1 553 . 14 1 1 A 59 59 LEU N N 59 125.484 124.878 0.606 1
1 554 . 14 1 1 A 60 60 GLU H H 60 8.461 8.511 -0.050 1
1 555 . 14 1 1 A 60 60 GLU HA H 60 4.371 4.592 -0.221 1
1 559 . 14 1 1 A 60 60 GLU CA C 60 53.436 55.957 -2.521 1
1 560 . 14 1 1 A 60 60 GLU CB C 60 29.057 31.785 -2.728 1
1 562 . 14 1 1 A 60 60 GLU N N 60 123.237 124.804 -1.567 1
1 563 . 14 1 1 A 61 61 ASP H H 61 8.076 9.329 -1.253 1
1 564 . 14 1 1 A 61 61 ASP HA H 61 4.265 4.360 -0.095 1
1 567 . 14 1 1 A 61 61 ASP CA C 61 54.398 57.257 -2.859 1
1 568 . 14 1 1 A 61 61 ASP CB C 61 38.340 40.514 -2.174 1
1 569 . 14 1 1 A 61 61 ASP N N 61 120.701 128.218 -7.517 1
1 570 . 14 1 1 A 62 62 GLY HA2 H 62 4.104 3.988 0.116 1
1 571 . 14 1 1 A 62 62 GLY HA3 H 62 3.832 3.993 -0.161 1
1 572 . 14 1 1 A 62 62 GLY CA C 62 42.576 45.536 -2.960 1
1 573 . 14 1 1 A 63 63 ARG H H 63 7.319 8.468 -1.149 1
1 574 . 14 1 1 A 63 63 ARG HA H 63 4.595 4.505 0.090 1
1 579 . 14 1 1 A 63 63 ARG CA C 63 51.971 56.246 -4.275 1
1 582 . 14 1 1 A 63 63 ARG N N 63 119.206 121.976 -2.770 1
1 583 . 14 1 1 A 64 64 THR H H 64 8.735 8.606 0.129 1
1 584 . 14 1 1 A 64 64 THR HA H 64 5.208 5.039 0.169 1
1 589 . 14 1 1 A 64 64 THR CA C 64 57.126 59.523 -2.397 1
1 590 . 14 1 1 A 64 64 THR CB C 64 69.885 71.802 -1.917 1
1 592 . 14 1 1 A 64 64 THR N N 64 108.713 116.415 -7.702 1
1 593 . 14 1 1 A 65 65 LEU H H 65 8.241 9.361 -1.120 1
1 594 . 14 1 1 A 65 65 LEU HA H 65 4.003 3.925 0.078 1
1 604 . 14 1 1 A 65 65 LEU CA C 65 56.409 58.034 -1.625 1
1 605 . 14 1 1 A 65 65 LEU CB C 65 37.179 41.345 -4.166 1
1 609 . 14 1 1 A 65 65 LEU N N 65 118.111 123.141 -5.030 1
1 610 . 14 1 1 A 66 66 SER H H 66 8.296 8.043 0.253 1
1 611 . 14 1 1 A 66 66 SER HA H 66 4.201 4.240 -0.039 1
1 614 . 14 1 1 A 66 66 SER CA C 66 58.454 60.702 -2.248 1
1 615 . 14 1 1 A 66 66 SER CB C 66 59.969 62.897 -2.928 1
1 616 . 14 1 1 A 66 66 SER N N 66 113.148 113.873 -0.725 1
1 617 . 14 1 1 A 67 67 ASP H H 67 7.984 8.266 -0.282 1
1 618 . 14 1 1 A 67 67 ASP HA H 67 4.187 4.233 -0.046 1
1 621 . 14 1 1 A 67 67 ASP CA C 67 54.744 57.358 -2.614 1
1 622 . 14 1 1 A 67 67 ASP CB C 67 37.794 41.792 -3.998 1
1 623 . 14 1 1 A 67 67 ASP N N 67 124.130 121.500 2.630 1
1 624 . 14 1 1 A 68 68 TYR H H 68 7.177 7.823 -0.646 1
1 625 . 14 1 1 A 68 68 TYR N N 68 115.334 115.876 -0.542 1
1 626 . 14 1 1 A 69 69 ASN H H 69 8.111 8.207 -0.096 1
1 627 . 14 1 1 A 69 69 ASN HA H 69 4.253 4.310 -0.057 1
1 630 . 14 1 1 A 69 69 ASN CA C 69 51.386 54.459 -3.073 1
1 631 . 14 1 1 A 69 69 ASN CB C 69 34.867 37.693 -2.826 1
1 632 . 14 1 1 A 69 69 ASN N N 69 116.867 117.315 -0.448 1
1 633 . 14 1 1 A 70 70 ILE H H 70 7.460 7.532 -0.072 1
1 634 . 14 1 1 A 70 70 ILE HA H 70 3.210 3.929 -0.719 1
1 644 . 14 1 1 A 70 70 ILE CA C 70 60.157 62.081 -1.924 1
1 645 . 14 1 1 A 70 70 ILE CB C 70 34.754 37.722 -2.968 1
1 649 . 14 1 1 A 70 70 ILE N N 70 119.821 119.908 -0.087 1
1 650 . 14 1 1 A 71 71 GLN H H 71 7.368 8.931 -1.563 1
1 651 . 14 1 1 A 71 71 GLN HA H 71 4.099 4.586 -0.487 1
1 656 . 14 1 1 A 71 71 GLN CA C 71 50.906 54.730 -3.824 1
1 657 . 14 1 1 A 71 71 GLN CB C 71 28.793 30.075 -1.282 1
1 659 . 14 1 1 A 71 71 GLN N N 71 124.287 124.931 -0.644 1
1 660 . 14 1 1 A 72 72 ARG H H 72 7.583 8.741 -1.158 1
1 661 . 14 1 1 A 72 72 ARG HA H 72 3.907 4.420 -0.513 1
1 668 . 14 1 1 A 72 72 ARG CA C 72 54.527 58.075 -3.548 1
1 669 . 14 1 1 A 72 72 ARG CB C 72 27.470 31.564 -4.094 1
1 672 . 14 1 1 A 72 72 ARG N N 72 119.007 120.932 -1.925 1
1 673 . 14 1 1 A 73 73 GLU H H 73 9.262 7.921 1.341 1
1 674 . 14 1 1 A 73 73 GLU HA H 73 3.586 4.397 -0.811 1
1 679 . 14 1 1 A 73 73 GLU CA C 73 55.703 57.428 -1.725 1
1 680 . 14 1 1 A 73 73 GLU CB C 73 23.669 29.645 -5.976 1
1 682 . 14 1 1 A 73 73 GLU N N 73 115.180 118.478 -3.298 1
1 683 . 14 1 1 A 74 74 SER H H 74 7.551 7.615 -0.064 1
1 684 . 14 1 1 A 74 74 SER HA H 74 4.613 4.490 0.123 1
1 687 . 14 1 1 A 74 74 SER CA C 74 58.305 58.438 -0.133 1
1 688 . 14 1 1 A 74 74 SER CB C 74 62.156 63.895 -1.739 1
1 689 . 14 1 1 A 74 74 SER N N 74 115.104 115.929 -0.825 1
1 690 . 14 1 1 A 75 75 THR H H 75 8.785 8.816 -0.031 1
1 691 . 14 1 1 A 75 75 THR HA H 75 5.014 4.913 0.101 1
1 696 . 14 1 1 A 75 75 THR CA C 75 59.835 62.244 -2.409 1
1 697 . 14 1 1 A 75 75 THR CB C 75 67.258 69.310 -2.052 1
1 699 . 14 1 1 A 75 75 THR N N 75 118.401 120.507 -2.106 1
1 700 . 14 1 1 A 76 76 LEU H H 76 9.447 10.038 -0.591 1
1 701 . 14 1 1 A 76 76 LEU HA H 76 4.930 4.914 0.016 1
1 711 . 14 1 1 A 76 76 LEU CA C 76 51.107 53.946 -2.839 1
1 712 . 14 1 1 A 76 76 LEU CB C 76 40.841 43.291 -2.450 1
1 716 . 14 1 1 A 76 76 LEU N N 76 127.905 127.940 -0.035 1
1 717 . 14 1 1 A 77 77 HIS HA H 77 4.976 5.624 -0.648 1
1 720 . 14 1 1 A 77 77 HIS CA C 77 53.776 53.961 -0.185 1
1 721 . 14 1 1 A 77 77 HIS CB C 77 28.438 32.574 -4.136 1
1 722 . 14 1 1 A 78 78 LEU H H 78 8.450 8.600 -0.150 1
1 723 . 14 1 1 A 78 78 LEU HA H 78 5.085 5.101 -0.016 1
1 733 . 14 1 1 A 78 78 LEU CA C 78 50.896 53.736 -2.840 1
1 734 . 14 1 1 A 78 78 LEU CB C 78 41.916 43.158 -1.242 1
1 738 . 14 1 1 A 78 78 LEU N N 78 126.178 126.672 -0.494 1
1 739 . 14 1 1 A 79 79 VAL H H 79 9.093 8.170 0.923 1
1 740 . 14 1 1 A 79 79 VAL HA H 79 4.053 4.409 -0.356 1
1 748 . 14 1 1 A 79 79 VAL CA C 79 59.054 61.823 -2.769 1
1 749 . 14 1 1 A 79 79 VAL CB C 79 32.115 32.825 -0.710 1
1 752 . 14 1 1 A 79 79 VAL N N 79 128.372 124.090 4.282 1
1 753 . 14 1 1 A 80 80 LEU H H 80 8.000 9.000 -1.000 1
1 754 . 14 1 1 A 80 80 LEU HA H 80 5.105 4.800 0.305 1
1 764 . 14 1 1 A 80 80 LEU CA C 80 50.556 53.635 -3.079 1
1 765 . 14 1 1 A 80 80 LEU CB C 80 39.597 42.362 -2.765 1
1 769 . 14 1 1 A 80 80 LEU N N 80 126.145 127.461 -1.316 1
1 770 . 14 1 1 A 81 81 ARG H H 81 8.470 8.476 -0.006 1
1 771 . 14 1 1 A 81 81 ARG HA H 81 4.197 4.709 -0.512 1
1 778 . 14 1 1 A 81 81 ARG CA C 81 53.133 56.057 -2.924 1
1 779 . 14 1 1 A 81 81 ARG CB C 81 28.413 31.123 -2.710 1
1 782 . 14 1 1 A 81 81 ARG N N 81 121.625 125.805 -4.180 1
1 783 . 14 1 1 A 82 82 LEU H H 82 8.454 8.735 -0.281 1
1 784 . 14 1 1 A 82 82 LEU HA H 82 4.339 4.752 -0.413 1
1 794 . 14 1 1 A 82 82 LEU CA C 82 52.081 54.483 -2.402 1
1 795 . 14 1 1 A 82 82 LEU CB C 82 39.810 43.291 -3.481 1
1 799 . 14 1 1 A 82 82 LEU N N 82 123.832 127.732 -3.900 1
1 800 . 14 1 1 A 83 83 ARG H H 83 8.404 8.913 -0.509 1
1 801 . 14 1 1 A 83 83 ARG HA H 83 4.308 4.415 -0.107 1
1 808 . 14 1 1 A 83 83 ARG CA C 83 53.258 55.660 -2.402 1
1 809 . 14 1 1 A 83 83 ARG CB C 83 28.160 30.623 -2.463 1
1 812 . 14 1 1 A 83 83 ARG N N 83 121.447 127.733 -6.286 1
1 813 . 14 1 1 A 84 84 GLY H H 84 8.410 7.965 0.445 1
1 814 . 14 1 1 A 84 84 GLY HA2 H 84 3.929 4.054 -0.125 1
1 815 . 14 1 1 A 84 84 GLY HA3 H 84 3.929 4.055 -0.126 1
1 816 . 14 1 1 A 84 84 GLY CA C 84 42.751 45.513 -2.762 1
1 817 . 14 1 1 A 84 84 GLY N N 84 110.030 107.339 2.691 1
1 818 . 14 1 1 A 85 85 GLY H H 85 8.295 8.212 0.083 1
1 819 . 14 1 1 A 85 85 GLY HA2 H 85 3.950 3.941 0.009 1
1 820 . 14 1 1 A 85 85 GLY HA3 H 85 3.950 3.941 0.009 1
1 821 . 14 1 1 A 85 85 GLY CA C 85 42.831 46.261 -3.430 1
1 822 . 14 1 1 A 85 85 GLY N N 85 108.838 109.894 -1.056 1
1 823 . 14 1 1 A 86 86 SER H H 86 8.292 8.182 0.110 1
1 824 . 14 1 1 A 86 86 SER HA H 86 4.405 4.335 0.070 1
1 827 . 14 1 1 A 86 86 SER CA C 86 55.965 60.863 -4.898 1
1 828 . 14 1 1 A 86 86 SER CB C 86 61.232 62.893 -1.661 1
1 829 . 14 1 1 A 86 86 SER N N 86 116.028 115.244 0.784 1
1 830 . 14 1 1 A 87 87 MET H H 87 8.470 7.953 0.517 1
1 831 . 14 1 1 A 87 87 MET HA H 87 4.447 4.116 0.331 1
1 836 . 14 1 1 A 87 87 MET CA C 87 53.281 58.336 -5.055 1
1 837 . 14 1 1 A 87 87 MET CB C 87 29.788 32.687 -2.899 1
1 839 . 14 1 1 A 87 87 MET N N 87 121.625 119.695 1.930 1
1 840 . 14 1 1 A 88 88 GLY H H 88 8.320 8.580 -0.260 1
1 841 . 14 1 1 A 88 88 GLY HA2 H 88 3.919 3.920 -0.001 1
1 842 . 14 1 1 A 88 88 GLY HA3 H 88 3.896 3.921 -0.025 1
1 843 . 14 1 1 A 88 88 GLY CA C 88 43.060 46.897 -3.837 1
1 844 . 14 1 1 A 88 88 GLY N N 88 109.625 106.881 2.744 1
1 845 . 14 1 1 A 89 89 GLY H H 89 8.256 8.349 -0.093 1
1 846 . 14 1 1 A 89 89 GLY HA2 H 89 3.940 4.206 -0.266 1
1 847 . 14 1 1 A 89 89 GLY HA3 H 89 3.910 4.206 -0.296 1
1 848 . 14 1 1 A 89 89 GLY CA C 89 42.678 46.135 -3.457 1
1 849 . 14 1 1 A 89 89 GLY N N 89 108.982 108.287 0.695 1
1 850 . 14 1 1 A 90 90 ALA H H 90 8.203 8.411 -0.208 1
1 851 . 14 1 1 A 90 90 ALA HA H 90 4.255 4.226 0.029 1
1 855 . 14 1 1 A 90 90 ALA CA C 90 50.763 53.653 -2.890 1
1 856 . 14 1 1 A 90 90 ALA CB C 90 16.364 18.910 -2.546 1
1 857 . 14 1 1 A 90 90 ALA N N 90 124.065 125.125 -1.060 1
1 858 . 14 1 1 A 91 91 ALA H H 91 8.273 7.450 0.823 1
1 859 . 14 1 1 A 91 91 ALA HA H 91 4.204 4.459 -0.255 1
1 863 . 14 1 1 A 91 91 ALA CA C 91 51.080 51.679 -0.599 1
1 864 . 14 1 1 A 91 91 ALA CB C 91 16.036 20.151 -4.115 1
1 865 . 14 1 1 A 91 91 ALA N N 91 121.985 118.315 3.670 1
1 866 . 14 1 1 A 92 92 ASP H H 92 8.022 8.715 -0.693 1
1 867 . 14 1 1 A 92 92 ASP HA H 92 4.455 4.656 -0.201 1
1 870 . 14 1 1 A 92 92 ASP CA C 92 52.664 56.268 -3.604 1
1 871 . 14 1 1 A 92 92 ASP CB C 92 37.925 41.818 -3.893 1
1 872 . 14 1 1 A 92 92 ASP N N 92 118.621 123.835 -5.214 1
1 873 . 14 1 1 A 93 93 GLU H H 93 8.282 7.883 0.399 1
1 874 . 14 1 1 A 93 93 GLU HA H 93 3.912 4.590 -0.678 1
1 879 . 14 1 1 A 93 93 GLU CA C 93 56.947 57.782 -0.835 1
1 880 . 14 1 1 A 93 93 GLU CB C 93 27.413 32.237 -4.824 1
1 882 . 14 1 1 A 93 93 GLU N N 93 122.247 116.399 5.848 1
1 883 . 14 1 1 A 94 94 GLU H H 94 8.194 8.363 -0.169 1
1 884 . 14 1 1 A 94 94 GLU HA H 94 3.940 4.449 -0.509 1
1 889 . 14 1 1 A 94 94 GLU CA C 94 56.681 58.106 -1.425 1
1 890 . 14 1 1 A 94 94 GLU CB C 94 26.127 30.837 -4.710 1
1 892 . 14 1 1 A 94 94 GLU N N 94 118.024 119.270 -1.246 1
1 893 . 14 1 1 A 95 95 GLU H H 95 7.816 8.203 -0.387 1
1 894 . 14 1 1 A 95 95 GLU HA H 95 4.121 4.115 0.006 1
1 898 . 14 1 1 A 95 95 GLU CA C 95 56.162 58.804 -2.642 1
1 899 . 14 1 1 A 95 95 GLU CB C 95 26.403 28.328 -1.925 1
1 901 . 14 1 1 A 95 95 GLU N N 95 120.028 117.926 2.102 1
1 902 . 14 1 1 A 96 96 LEU H H 96 7.637 7.729 -0.092 1
1 903 . 14 1 1 A 96 96 LEU HA H 96 3.988 4.046 -0.058 1
1 913 . 14 1 1 A 96 96 LEU CA C 96 55.303 57.583 -2.280 1
1 914 . 14 1 1 A 96 96 LEU CB C 96 39.038 41.716 -2.678 1
1 918 . 14 1 1 A 96 96 LEU N N 96 119.866 117.946 1.920 1
1 919 . 14 1 1 A 97 97 ILE H H 97 8.044 7.756 0.288 1
1 920 . 14 1 1 A 97 97 ILE HA H 97 3.478 4.013 -0.535 1
1 930 . 14 1 1 A 97 97 ILE CA C 97 62.054 63.647 -1.593 1
1 931 . 14 1 1 A 97 97 ILE CB C 97 34.541 38.005 -3.464 1
1 935 . 14 1 1 A 97 97 ILE N N 97 119.088 119.412 -0.324 1
1 936 . 14 1 1 A 98 98 ARG H H 98 7.991 7.774 0.217 1
1 937 . 14 1 1 A 98 98 ARG HA H 98 3.793 4.051 -0.258 1
1 944 . 14 1 1 A 98 98 ARG CA C 98 57.509 59.053 -1.544 1
1 945 . 14 1 1 A 98 98 ARG CB C 98 27.191 30.239 -3.048 1
1 948 . 14 1 1 A 98 98 ARG N N 98 119.225 120.839 -1.614 1
1 949 . 14 1 1 A 99 99 LYS H H 99 8.101 8.060 0.041 1
1 950 . 14 1 1 A 99 99 LYS HA H 99 3.968 4.072 -0.104 1
1 959 . 14 1 1 A 99 99 LYS CA C 99 56.455 59.155 -2.700 1
1 960 . 14 1 1 A 99 99 LYS CB C 99 29.531 32.192 -2.661 1
1 964 . 14 1 1 A 99 99 LYS N N 99 119.464 119.719 -0.255 1
1 965 . 14 1 1 A 100 100 ALA H H 100 8.167 8.227 -0.060 1
1 966 . 14 1 1 A 100 100 ALA HA H 100 3.789 4.048 -0.259 1
1 970 . 14 1 1 A 100 100 ALA CA C 100 52.451 54.942 -2.491 1
1 971 . 14 1 1 A 100 100 ALA CB C 100 16.259 18.489 -2.230 1
1 972 . 14 1 1 A 100 100 ALA N N 100 122.398 121.255 1.143 1
1 973 . 14 1 1 A 101 101 ILE H H 101 8.777 7.702 1.075 1
1 974 . 14 1 1 A 101 101 ILE HA H 101 3.191 3.689 -0.498 1
1 984 . 14 1 1 A 101 101 ILE CA C 101 62.910 65.095 -2.185 1
1 985 . 14 1 1 A 101 101 ILE CB C 101 34.544 37.963 -3.419 1
1 989 . 14 1 1 A 101 101 ILE N N 101 120.431 118.945 1.486 1
1 990 . 14 1 1 A 102 102 GLU H H 102 7.890 7.886 0.004 1
1 991 . 14 1 1 A 102 102 GLU HA H 102 3.848 4.088 -0.240 1
1 996 . 14 1 1 A 102 102 GLU CA C 102 57.079 58.532 -1.453 1
1 997 . 14 1 1 A 102 102 GLU CB C 102 26.769 29.569 -2.800 1
1 999 . 14 1 1 A 102 102 GLU N N 102 120.248 120.292 -0.044 1
1 1000 . 14 1 1 A 103 103 LEU H H 103 8.194 8.869 -0.675 1
1 1001 . 14 1 1 A 103 103 LEU HA H 103 3.912 4.213 -0.301 1
1 1011 . 14 1 1 A 103 103 LEU CA C 103 55.078 57.499 -2.421 1
1 1012 . 14 1 1 A 103 103 LEU CB C 103 38.963 42.315 -3.352 1
1 1016 . 14 1 1 A 103 103 LEU N N 103 120.341 121.432 -1.091 1
1 1017 . 14 1 1 A 104 104 SER H H 104 8.268 7.653 0.615 1
1 1018 . 14 1 1 A 104 104 SER HA H 104 4.120 4.394 -0.274 1
1 1021 . 14 1 1 A 104 104 SER CA C 104 58.301 59.756 -1.455 1
1 1022 . 14 1 1 A 104 104 SER CB C 104 60.193 63.794 -3.601 1
1 1023 . 14 1 1 A 104 104 SER N N 104 115.150 113.670 1.480 1
1 1024 . 14 1 1 A 105 105 LEU H H 105 7.501 7.640 -0.139 1
1 1025 . 14 1 1 A 105 105 LEU HA H 105 4.041 4.133 -0.092 1
1 1035 . 14 1 1 A 105 105 LEU CA C 105 53.995 55.421 -1.426 1
1 1036 . 14 1 1 A 105 105 LEU CB C 105 39.597 42.291 -2.694 1
1 1040 . 14 1 1 A 105 105 LEU N N 105 124.223 121.102 3.121 1
1 1041 . 14 1 1 A 106 106 LYS H H 106 7.542 8.042 -0.500 1
1 1042 . 14 1 1 A 106 106 LYS HA H 106 4.090 4.024 0.066 1
1 1050 . 14 1 1 A 106 106 LYS CA C 106 55.495 58.797 -3.302 1
1 1051 . 14 1 1 A 106 106 LYS CB C 106 29.941 31.541 -1.600 1
1 1055 . 14 1 1 A 106 106 LYS N N 106 120.328 118.052 2.276 1
1 1056 . 14 1 1 A 107 107 GLU H H 107 7.884 8.263 -0.379 1
1 1057 . 14 1 1 A 107 107 GLU HA H 107 4.210 4.069 0.141 1
1 1060 . 14 1 1 A 107 107 GLU CA C 107 54.509 59.155 -4.646 1
1 1061 . 14 1 1 A 107 107 GLU CB C 107 27.239 29.305 -2.066 1
1 1062 . 14 1 1 A 107 107 GLU N N 107 118.621 120.344 -1.723 1
1 1063 . 14 1 1 A 108 108 SER H H 108 7.923 8.593 -0.670 1
1 1064 . 14 1 1 A 108 108 SER HA H 108 4.385 4.224 0.161 1
1 1067 . 14 1 1 A 108 108 SER CA C 108 56.442 60.754 -4.312 1
1 1068 . 14 1 1 A 108 108 SER CB C 108 60.953 62.929 -1.976 1
1 1069 . 14 1 1 A 108 108 SER N N 108 115.670 115.206 0.464 1
1 1070 . 14 1 1 A 109 109 ARG H H 109 8.068 7.985 0.083 1
1 1071 . 14 1 1 A 109 109 ARG HA H 109 4.307 4.220 0.087 1
1 1078 . 14 1 1 A 109 109 ARG CA C 109 53.732 58.300 -4.568 1
1 1079 . 14 1 1 A 109 109 ARG CB C 109 27.968 29.634 -1.666 1
1 1082 . 14 1 1 A 109 109 ARG N N 109 122.313 119.700 2.613 1
1 1083 . 14 1 1 A 110 110 ASN H H 110 8.292 7.784 0.508 1
1 1084 . 14 1 1 A 110 110 ASN HA H 110 4.720 4.646 0.074 1
1 1087 . 14 1 1 A 110 110 ASN CA C 110 50.750 55.198 -4.448 1
1 1088 . 14 1 1 A 110 110 ASN CB C 110 36.197 38.097 -1.900 1
1 1089 . 14 1 1 A 110 110 ASN N N 110 119.304 117.389 1.915 1
1 1090 . 14 1 1 A 111 111 SER H H 111 8.244 7.817 0.427 1
1 1091 . 14 1 1 A 111 111 SER HA H 111 4.423 4.318 0.105 1
1 1094 . 14 1 1 A 111 111 SER CA C 111 55.990 62.066 -6.076 1
1 1095 . 14 1 1 A 111 111 SER CB C 111 61.027 62.869 -1.842 1
1 1096 . 14 1 1 A 111 111 SER N N 111 116.119 116.190 -0.071 1
1 1097 . 14 1 1 A 112 112 GLY H H 112 8.327 8.061 0.266 1
1 1098 . 14 1 1 A 112 112 GLY HA2 H 112 3.944 3.909 0.035 1
1 1099 . 14 1 1 A 112 112 GLY HA3 H 112 3.912 3.912 0.000 1
1 1100 . 14 1 1 A 112 112 GLY CA C 112 42.733 46.842 -4.109 1
1 1101 . 14 1 1 A 112 112 GLY N N 112 110.442 109.740 0.702 1
1 1102 . 14 1 1 A 113 113 GLY H H 113 8.097 8.448 -0.351 1
1 1103 . 14 1 1 A 113 113 GLY HA2 H 113 3.831 3.753 0.078 1
1 1104 . 14 1 1 A 113 113 GLY HA3 H 113 3.785 3.778 0.007 1
1 1105 . 14 1 1 A 113 113 GLY CA C 113 42.435 47.172 -4.737 1
1 1106 . 14 1 1 A 113 113 GLY N N 113 108.745 109.437 -0.692 1
1 2 . 15 1 1 A 3 3 HIS CB C 3 33.709 29.823 3.886 1
1 3 . 15 1 1 A 7 7 HIS H H 7 8.731 7.969 0.762 1
1 4 . 15 1 1 A 7 7 HIS HA H 7 4.564 4.381 0.183 1
1 7 . 15 1 1 A 7 7 HIS CA C 7 53.649 56.296 -2.647 1
1 8 . 15 1 1 A 7 7 HIS CB C 7 26.268 29.536 -3.268 1
1 9 . 15 1 1 A 7 7 HIS N N 7 121.126 118.167 2.959 1
1 10 . 15 1 1 A 8 8 GLY H H 8 8.540 8.247 0.293 1
1 11 . 15 1 1 A 8 8 GLY HA2 H 8 3.973 3.759 0.214 1
1 12 . 15 1 1 A 8 8 GLY HA3 H 8 3.811 3.886 -0.075 1
1 13 . 15 1 1 A 8 8 GLY CA C 8 42.618 44.952 -2.334 1
1 14 . 15 1 1 A 8 8 GLY N N 8 110.662 113.149 -2.487 1
1 15 . 15 1 1 A 9 9 GLU H H 9 8.239 7.525 0.714 1
1 16 . 15 1 1 A 9 9 GLU HA H 9 4.568 3.997 0.571 1
1 18 . 15 1 1 A 9 9 GLU CA C 9 53.605 55.002 -1.397 1
1 19 . 15 1 1 A 9 9 GLU CB C 9 28.019 32.894 -4.875 1
1 20 . 15 1 1 A 9 9 GLU N N 9 121.669 118.782 2.887 1
1 21 . 15 1 1 A 10 10 PHE H H 10 8.785 8.205 0.580 1
1 22 . 15 1 1 A 10 10 PHE HA H 10 4.850 5.285 -0.435 1
1 25 . 15 1 1 A 10 10 PHE CA C 10 52.630 56.784 -4.154 1
1 26 . 15 1 1 A 10 10 PHE CB C 10 37.906 41.084 -3.178 1
1 27 . 15 1 1 A 10 10 PHE N N 10 118.401 119.460 -1.059 1
1 28 . 15 1 1 A 11 11 GLN H H 11 8.552 8.558 -0.006 1
1 29 . 15 1 1 A 11 11 GLN HA H 11 5.425 5.205 0.220 1
1 34 . 15 1 1 A 11 11 GLN CA C 11 51.663 54.191 -2.528 1
1 35 . 15 1 1 A 11 11 GLN CB C 11 28.427 31.276 -2.849 1
1 37 . 15 1 1 A 11 11 GLN N N 11 117.519 122.272 -4.753 1
1 38 . 15 1 1 A 12 12 ILE H H 12 8.239 8.351 -0.112 1
1 39 . 15 1 1 A 12 12 ILE HA H 12 4.103 5.199 -1.096 1
1 49 . 15 1 1 A 12 12 ILE CA C 12 57.134 59.123 -1.989 1
1 50 . 15 1 1 A 12 12 ILE CB C 12 39.491 42.268 -2.777 1
1 54 . 15 1 1 A 12 12 ILE N N 12 114.043 116.832 -2.789 1
1 55 . 15 1 1 A 13 13 PHE H H 13 8.538 8.388 0.150 1
1 56 . 15 1 1 A 13 13 PHE HA H 13 5.620 5.135 0.485 1
1 59 . 15 1 1 A 13 13 PHE CA C 13 52.438 56.671 -4.233 1
1 60 . 15 1 1 A 13 13 PHE CB C 13 39.253 40.748 -1.495 1
1 61 . 15 1 1 A 13 13 PHE N N 13 117.015 119.792 -2.777 1
1 62 . 15 1 1 A 14 14 ALA H H 14 9.238 9.497 -0.259 1
1 63 . 15 1 1 A 14 14 ALA HA H 14 5.311 5.349 -0.038 1
1 67 . 15 1 1 A 14 14 ALA CA C 14 47.183 49.992 -2.809 1
1 68 . 15 1 1 A 14 14 ALA CB C 14 17.811 21.591 -3.780 1
1 69 . 15 1 1 A 14 14 ALA N N 14 123.503 126.911 -3.408 1
1 70 . 15 1 1 A 15 15 LYS H H 15 8.810 9.244 -0.434 1
1 71 . 15 1 1 A 15 15 LYS HA H 15 5.511 5.418 0.093 1
1 80 . 15 1 1 A 15 15 LYS CA C 15 51.718 54.498 -2.780 1
1 81 . 15 1 1 A 15 15 LYS CB C 15 33.635 35.385 -1.750 1
1 85 . 15 1 1 A 15 15 LYS N N 15 123.382 123.072 0.310 1
1 86 . 15 1 1 A 16 16 THR H H 16 8.830 8.786 0.044 1
1 87 . 15 1 1 A 16 16 THR HA H 16 5.212 5.120 0.092 1
1 92 . 15 1 1 A 16 16 THR CA C 16 57.614 60.985 -3.371 1
1 93 . 15 1 1 A 16 16 THR CB C 16 68.210 70.975 -2.765 1
1 95 . 15 1 1 A 16 16 THR N N 16 116.517 116.360 0.157 1
1 96 . 15 1 1 A 17 17 LEU H H 17 9.428 8.851 0.577 1
1 97 . 15 1 1 A 17 17 LEU HA H 17 4.286 4.209 0.077 1
1 107 . 15 1 1 A 17 17 LEU CA C 17 54.504 57.697 -3.193 1
1 108 . 15 1 1 A 17 17 LEU CB C 17 38.564 41.919 -3.355 1
1 112 . 15 1 1 A 17 17 LEU N N 17 121.786 123.466 -1.680 1
1 113 . 15 1 1 A 18 18 THR H H 18 7.546 7.796 -0.250 1
1 114 . 15 1 1 A 18 18 THR HA H 18 4.391 4.292 0.099 1
1 119 . 15 1 1 A 18 18 THR CA C 18 58.524 63.131 -4.607 1
1 120 . 15 1 1 A 18 18 THR CB C 18 66.166 70.531 -4.365 1
1 122 . 15 1 1 A 18 18 THR N N 18 105.598 108.165 -2.567 1
1 123 . 15 1 1 A 19 19 GLY H H 19 7.683 8.255 -0.572 1
1 124 . 15 1 1 A 19 19 GLY HA2 H 19 3.300 3.960 -0.660 1
1 125 . 15 1 1 A 19 19 GLY HA3 H 19 4.248 3.966 0.282 1
1 126 . 15 1 1 A 19 19 GLY CA C 19 42.947 45.617 -2.670 1
1 127 . 15 1 1 A 19 19 GLY N N 19 109.243 112.155 -2.912 1
1 128 . 15 1 1 A 20 20 LYS H H 20 7.375 7.491 -0.116 1
1 129 . 15 1 1 A 20 20 LYS HA H 20 4.331 4.629 -0.298 1
1 138 . 15 1 1 A 20 20 LYS CA C 20 53.829 55.189 -1.360 1
1 139 . 15 1 1 A 20 20 LYS CB C 20 30.385 34.153 -3.768 1
1 143 . 15 1 1 A 20 20 LYS N N 20 122.757 121.325 1.432 1
1 144 . 15 1 1 A 21 21 THR H H 21 8.637 8.898 -0.261 1
1 145 . 15 1 1 A 21 21 THR HA H 21 4.852 4.941 -0.089 1
1 150 . 15 1 1 A 21 21 THR CA C 21 59.846 62.372 -2.526 1
1 151 . 15 1 1 A 21 21 THR CB C 21 67.140 70.241 -3.101 1
1 153 . 15 1 1 A 21 21 THR N N 21 121.524 123.891 -2.367 1
1 154 . 15 1 1 A 22 22 ILE H H 22 9.509 9.404 0.105 1
1 155 . 15 1 1 A 22 22 ILE HA H 22 4.349 4.840 -0.491 1
1 165 . 15 1 1 A 22 22 ILE CA C 22 57.634 60.231 -2.597 1
1 166 . 15 1 1 A 22 22 ILE CB C 22 38.334 41.854 -3.520 1
1 170 . 15 1 1 A 22 22 ILE N N 22 129.772 127.161 2.611 1
1 171 . 15 1 1 A 23 23 THR H H 23 8.838 8.839 -0.001 1
1 172 . 15 1 1 A 23 23 THR HA H 23 4.653 5.012 -0.359 1
1 177 . 15 1 1 A 23 23 THR CA C 23 60.194 61.975 -1.781 1
1 178 . 15 1 1 A 23 23 THR CB C 23 66.577 69.830 -3.253 1
1 180 . 15 1 1 A 23 23 THR N N 23 124.070 123.996 0.074 1
1 181 . 15 1 1 A 24 24 LEU H H 24 8.749 8.447 0.302 1
1 182 . 15 1 1 A 24 24 LEU HA H 24 4.619 5.115 -0.496 1
1 192 . 15 1 1 A 24 24 LEU CA C 24 50.257 52.880 -2.623 1
1 193 . 15 1 1 A 24 24 LEU CB C 24 42.932 45.737 -2.805 1
1 197 . 15 1 1 A 24 24 LEU N N 24 126.499 123.573 2.926 1
1 198 . 15 1 1 A 25 25 GLU H H 25 7.990 8.534 -0.544 1
1 199 . 15 1 1 A 25 25 GLU HA H 25 4.591 4.679 -0.088 1
1 204 . 15 1 1 A 25 25 GLU CA C 25 52.845 56.233 -3.388 1
1 205 . 15 1 1 A 25 25 GLU CB C 25 27.210 30.390 -3.180 1
1 207 . 15 1 1 A 25 25 GLU N N 25 121.644 120.392 1.252 1
1 208 . 15 1 1 A 26 26 VAL H H 26 8.657 8.960 -0.303 1
1 209 . 15 1 1 A 26 26 VAL HA H 26 4.403 5.040 -0.637 1
1 217 . 15 1 1 A 26 26 VAL CA C 26 56.020 58.911 -2.891 1
1 218 . 15 1 1 A 26 26 VAL CB C 26 33.631 36.447 -2.816 1
1 221 . 15 1 1 A 26 26 VAL N N 26 116.647 117.877 -1.230 1
1 222 . 15 1 1 A 27 27 GLU H H 27 7.970 8.651 -0.681 1
1 223 . 15 1 1 A 27 27 GLU HA H 27 4.447 4.784 -0.337 1
1 228 . 15 1 1 A 27 27 GLU CA C 27 51.386 54.789 -3.403 1
1 229 . 15 1 1 A 27 27 GLU CB C 27 30.905 31.943 -1.038 1
1 231 . 15 1 1 A 27 27 GLU N N 27 115.496 121.268 -5.772 1
1 232 . 15 1 1 A 28 28 SER H H 28 9.192 8.803 0.389 1
1 233 . 15 1 1 A 28 28 SER HA H 28 4.108 4.123 -0.015 1
1 236 . 15 1 1 A 28 28 SER CA C 28 59.909 61.108 -1.199 1
1 237 . 15 1 1 A 28 28 SER CB C 28 60.399 62.754 -2.355 1
1 238 . 15 1 1 A 28 28 SER N N 28 117.720 117.180 0.540 1
1 239 . 15 1 1 A 29 29 SER H H 29 7.371 7.673 -0.302 1
1 240 . 15 1 1 A 29 29 SER HA H 29 4.327 4.488 -0.161 1
1 243 . 15 1 1 A 29 29 SER CA C 29 54.805 57.103 -2.298 1
1 244 . 15 1 1 A 29 29 SER CB C 29 60.775 64.247 -3.472 1
1 245 . 15 1 1 A 29 29 SER N N 29 108.936 109.829 -0.893 1
1 246 . 15 1 1 A 30 30 ASP H H 30 7.852 7.665 0.187 1
1 247 . 15 1 1 A 30 30 ASP HA H 30 4.591 4.495 0.096 1
1 250 . 15 1 1 A 30 30 ASP CA C 30 53.040 54.765 -1.725 1
1 251 . 15 1 1 A 30 30 ASP CB C 30 37.942 41.738 -3.796 1
1 252 . 15 1 1 A 30 30 ASP N N 30 123.735 124.012 -0.277 1
1 253 . 15 1 1 A 31 31 THR H H 31 7.852 8.392 -0.540 1
1 254 . 15 1 1 A 31 31 THR HA H 31 4.918 4.909 0.009 1
1 259 . 15 1 1 A 31 31 THR CA C 31 56.929 60.010 -3.081 1
1 260 . 15 1 1 A 31 31 THR CB C 31 68.674 71.651 -2.977 1
1 262 . 15 1 1 A 31 31 THR N N 31 109.181 113.213 -4.032 1
1 263 . 15 1 1 A 32 32 ILE H H 32 8.582 8.702 -0.120 1
1 264 . 15 1 1 A 32 32 ILE HA H 32 3.624 3.815 -0.191 1
1 274 . 15 1 1 A 32 32 ILE CA C 32 59.474 65.436 -5.962 1
1 275 . 15 1 1 A 32 32 ILE CB C 32 31.561 37.800 -6.239 1
1 279 . 15 1 1 A 32 32 ILE N N 32 121.833 122.873 -1.040 1
1 280 . 15 1 1 A 33 33 ASP H H 33 9.255 8.306 0.949 1
1 281 . 15 1 1 A 33 33 ASP HA H 33 4.201 4.303 -0.102 1
1 284 . 15 1 1 A 33 33 ASP CA C 33 54.679 57.007 -2.328 1
1 285 . 15 1 1 A 33 33 ASP CB C 33 37.700 40.377 -2.677 1
1 286 . 15 1 1 A 33 33 ASP N N 33 119.823 121.769 -1.946 1
1 287 . 15 1 1 A 34 34 ASN H H 34 8.026 7.909 0.117 1
1 288 . 15 1 1 A 34 34 ASN HA H 34 4.409 4.591 -0.182 1
1 291 . 15 1 1 A 34 34 ASN CA C 34 53.324 56.584 -3.260 1
1 292 . 15 1 1 A 34 34 ASN CB C 34 35.782 38.579 -2.797 1
1 293 . 15 1 1 A 34 34 ASN N N 34 119.540 118.195 1.345 1
1 294 . 15 1 1 A 35 35 VAL H H 35 8.167 7.939 0.228 1
1 295 . 15 1 1 A 35 35 VAL HA H 35 3.249 3.469 -0.220 1
1 303 . 15 1 1 A 35 35 VAL CA C 35 65.308 67.110 -1.802 1
1 304 . 15 1 1 A 35 35 VAL CB C 35 27.965 31.642 -3.677 1
1 307 . 15 1 1 A 35 35 VAL N N 35 122.223 120.042 2.181 1
1 308 . 15 1 1 A 36 36 LYS H H 36 8.460 8.272 0.188 1
1 313 . 15 1 1 A 36 36 LYS CB C 36 30.753 32.230 -1.477 1
1 315 . 15 1 1 A 36 36 LYS N N 36 119.438 119.263 0.175 1
1 316 . 15 1 1 A 37 37 SER H H 37 8.196 8.346 -0.150 1
1 317 . 15 1 1 A 37 37 SER HA H 37 4.130 4.204 -0.074 1
1 320 . 15 1 1 A 37 37 SER CA C 37 58.528 61.330 -2.802 1
1 321 . 15 1 1 A 37 37 SER CB C 37 59.768 62.640 -2.872 1
1 322 . 15 1 1 A 37 37 SER N N 37 117.791 114.268 3.523 1
1 323 . 15 1 1 A 38 38 LYS H H 38 8.043 7.809 0.234 1
1 324 . 15 1 1 A 38 38 LYS HA H 38 4.095 3.998 0.097 1
1 325 . 15 1 1 A 38 38 LYS CA C 38 57.377 59.391 -2.014 1
1 326 . 15 1 1 A 38 38 LYS N N 38 124.094 121.106 2.988 1
1 327 . 15 1 1 A 39 39 ILE H H 39 8.254 8.248 0.006 1
1 328 . 15 1 1 A 39 39 ILE HA H 39 3.439 3.795 -0.356 1
1 338 . 15 1 1 A 39 39 ILE CA C 39 63.977 64.584 -0.607 1
1 339 . 15 1 1 A 39 39 ILE CB C 39 33.935 37.517 -3.582 1
1 343 . 15 1 1 A 39 39 ILE N N 39 122.107 119.930 2.177 1
1 344 . 15 1 1 A 40 40 GLN H H 40 8.379 8.200 0.179 1
1 345 . 15 1 1 A 40 40 GLN HA H 40 3.746 4.033 -0.287 1
1 350 . 15 1 1 A 40 40 GLN CA C 40 57.472 58.071 -0.599 1
1 351 . 15 1 1 A 40 40 GLN CB C 40 25.072 28.300 -3.228 1
1 353 . 15 1 1 A 40 40 GLN N N 40 123.725 120.078 3.647 1
1 354 . 15 1 1 A 41 41 ASP H H 41 8.210 7.846 0.364 1
1 355 . 15 1 1 A 41 41 ASP HA H 41 4.247 4.386 -0.139 1
1 358 . 15 1 1 A 41 41 ASP CA C 41 54.646 56.413 -1.767 1
1 359 . 15 1 1 A 41 41 ASP CB C 41 38.136 40.829 -2.693 1
1 360 . 15 1 1 A 41 41 ASP N N 41 120.564 120.323 0.241 1
1 361 . 15 1 1 A 42 42 LYS H H 42 7.381 8.243 -0.862 1
1 362 . 15 1 1 A 42 42 LYS HA H 42 4.246 4.310 -0.064 1
1 369 . 15 1 1 A 42 42 LYS CA C 42 55.579 57.795 -2.216 1
1 370 . 15 1 1 A 42 42 LYS CB C 42 31.406 33.500 -2.094 1
1 373 . 15 1 1 A 42 42 LYS N N 42 115.674 116.961 -1.287 1
1 374 . 15 1 1 A 43 43 GLU H H 43 8.537 8.691 -0.154 1
1 375 . 15 1 1 A 43 43 GLU HA H 43 4.522 4.534 -0.012 1
1 380 . 15 1 1 A 43 43 GLU CA C 43 52.772 55.575 -2.803 1
1 381 . 15 1 1 A 43 43 GLU CB C 43 30.535 31.051 -0.516 1
1 383 . 15 1 1 A 43 43 GLU N N 43 114.355 116.118 -1.763 1
1 384 . 15 1 1 A 44 44 GLY H H 44 8.611 8.397 0.214 1
1 385 . 15 1 1 A 44 44 GLY HA2 H 44 4.067 3.970 0.097 1
1 386 . 15 1 1 A 44 44 GLY HA3 H 44 3.819 3.970 -0.151 1
1 387 . 15 1 1 A 44 44 GLY CA C 44 43.205 45.285 -2.080 1
1 388 . 15 1 1 A 44 44 GLY N N 44 109.406 108.243 1.163 1
1 389 . 15 1 1 A 45 45 ILE H H 45 6.092 7.928 -1.836 1
1 390 . 15 1 1 A 45 45 ILE HA H 45 4.324 4.107 0.217 1
1 400 . 15 1 1 A 45 45 ILE CA C 45 55.211 60.366 -5.155 1
1 401 . 15 1 1 A 45 45 ILE CB C 45 37.903 38.290 -0.387 1
1 405 . 15 1 1 A 45 45 ILE N N 45 120.791 122.485 -1.694 1
1 406 . 15 1 1 A 46 46 PRO HA H 46 4.547 4.667 -0.120 1
1 413 . 15 1 1 A 46 46 PRO CA C 46 58.971 62.048 -3.077 1
1 414 . 15 1 1 A 46 46 PRO CB C 46 29.142 32.187 -3.045 1
1 417 . 15 1 1 A 47 47 PRO HA H 47 4.062 4.185 -0.123 1
1 424 . 15 1 1 A 47 47 PRO CA C 47 63.476 65.788 -2.312 1
1 425 . 15 1 1 A 47 47 PRO CB C 47 30.113 31.953 -1.840 1
1 428 . 15 1 1 A 48 48 ASP H H 48 8.418 8.656 -0.238 1
1 429 . 15 1 1 A 48 48 ASP HA H 48 4.346 4.498 -0.152 1
1 432 . 15 1 1 A 48 48 ASP CA C 48 52.838 56.048 -3.210 1
1 433 . 15 1 1 A 48 48 ASP CB C 48 36.926 40.469 -3.543 1
1 434 . 15 1 1 A 48 48 ASP N N 48 113.462 116.785 -3.323 1
1 435 . 15 1 1 A 49 49 GLN H H 49 7.822 8.288 -0.466 1
1 436 . 15 1 1 A 49 49 GLN HA H 49 4.283 4.513 -0.230 1
1 439 . 15 1 1 A 49 49 GLN CA C 49 52.770 55.452 -2.682 1
1 441 . 15 1 1 A 49 49 GLN N N 49 117.377 117.964 -0.587 1
1 442 . 15 1 1 A 50 50 GLN H H 50 7.451 7.731 -0.280 1
1 443 . 15 1 1 A 50 50 GLN HA H 50 4.260 4.884 -0.624 1
1 448 . 15 1 1 A 50 50 GLN CA C 50 53.725 54.141 -0.416 1
1 449 . 15 1 1 A 50 50 GLN CB C 50 29.142 32.502 -3.360 1
1 451 . 15 1 1 A 50 50 GLN N N 50 117.526 117.100 0.426 1
1 452 . 15 1 1 A 51 51 ARG H H 51 8.534 9.138 -0.604 1
1 453 . 15 1 1 A 51 51 ARG HA H 51 4.486 5.129 -0.643 1
1 460 . 15 1 1 A 51 51 ARG CA C 51 52.492 54.259 -1.767 1
1 461 . 15 1 1 A 51 51 ARG CB C 51 29.096 34.560 -5.464 1
1 464 . 15 1 1 A 51 51 ARG N N 51 121.655 118.395 3.260 1
1 465 . 15 1 1 A 52 52 LEU H H 52 8.683 8.729 -0.046 1
1 466 . 15 1 1 A 52 52 LEU HA H 52 5.255 5.144 0.111 1
1 476 . 15 1 1 A 52 52 LEU CA C 52 50.618 53.612 -2.994 1
1 477 . 15 1 1 A 52 52 LEU CB C 52 43.007 45.796 -2.789 1
1 481 . 15 1 1 A 52 52 LEU N N 52 122.929 119.796 3.133 1
1 482 . 15 1 1 A 53 53 ILE H H 53 9.286 8.729 0.557 1
1 483 . 15 1 1 A 53 53 ILE HA H 53 5.096 5.086 0.010 1
1 492 . 15 1 1 A 53 53 ILE CA C 53 56.795 60.320 -3.525 1
1 496 . 15 1 1 A 53 53 ILE N N 53 124.718 124.392 0.326 1
1 497 . 15 1 1 A 54 54 TRP H H 54 8.871 9.125 -0.254 1
1 499 . 15 1 1 A 54 54 TRP N N 54 127.412 127.965 -0.553 1
1 501 . 15 1 1 A 55 55 ALA H H 55 8.401 8.549 -0.148 1
1 502 . 15 1 1 A 55 55 ALA HA H 55 3.183 3.395 -0.212 1
1 506 . 15 1 1 A 55 55 ALA CA C 55 49.712 52.586 -2.874 1
1 507 . 15 1 1 A 55 55 ALA CB C 55 13.252 16.849 -3.597 1
1 508 . 15 1 1 A 55 55 ALA N N 55 128.894 130.124 -1.230 1
1 509 . 15 1 1 A 56 56 GLY H H 56 8.248 8.389 -0.141 1
1 510 . 15 1 1 A 56 56 GLY HA2 H 56 3.968 3.718 0.250 1
1 511 . 15 1 1 A 56 56 GLY HA3 H 56 3.916 3.725 0.191 1
1 512 . 15 1 1 A 56 56 GLY CA C 56 43.142 45.599 -2.457 1
1 513 . 15 1 1 A 56 56 GLY N N 56 101.499 102.508 -1.009 1
1 514 . 15 1 1 A 57 57 LYS H H 57 8.028 7.250 0.778 1
1 515 . 15 1 1 A 57 57 LYS HA H 57 4.609 4.847 -0.238 1
1 522 . 15 1 1 A 57 57 LYS CA C 57 51.928 54.584 -2.656 1
1 523 . 15 1 1 A 57 57 LYS CB C 57 32.613 35.466 -2.853 1
1 526 . 15 1 1 A 57 57 LYS N N 57 118.995 120.739 -1.744 1
1 527 . 15 1 1 A 58 58 GLN H H 58 8.607 8.418 0.189 1
1 528 . 15 1 1 A 58 58 GLN HA H 58 4.617 4.473 0.144 1
1 533 . 15 1 1 A 58 58 GLN CA C 58 53.261 56.107 -2.846 1
1 534 . 15 1 1 A 58 58 GLN CB C 58 26.613 29.133 -2.520 1
1 536 . 15 1 1 A 58 58 GLN N N 58 119.825 125.108 -5.283 1
1 537 . 15 1 1 A 59 59 LEU H H 59 8.653 8.668 -0.015 1
1 538 . 15 1 1 A 59 59 LEU HA H 59 4.138 4.563 -0.425 1
1 548 . 15 1 1 A 59 59 LEU CA C 59 51.991 54.693 -2.702 1
1 549 . 15 1 1 A 59 59 LEU CB C 59 39.006 42.527 -3.521 1
1 553 . 15 1 1 A 59 59 LEU N N 59 125.484 123.296 2.188 1
1 554 . 15 1 1 A 60 60 GLU H H 60 8.461 8.520 -0.059 1
1 555 . 15 1 1 A 60 60 GLU HA H 60 4.371 4.704 -0.333 1
1 559 . 15 1 1 A 60 60 GLU CA C 60 53.436 55.969 -2.533 1
1 560 . 15 1 1 A 60 60 GLU CB C 60 29.057 33.540 -4.483 1
1 562 . 15 1 1 A 60 60 GLU N N 60 123.237 120.293 2.944 1
1 563 . 15 1 1 A 61 61 ASP H H 61 8.076 9.012 -0.936 1
1 564 . 15 1 1 A 61 61 ASP HA H 61 4.265 4.330 -0.065 1
1 567 . 15 1 1 A 61 61 ASP CA C 61 54.398 56.652 -2.254 1
1 568 . 15 1 1 A 61 61 ASP CB C 61 38.340 40.500 -2.160 1
1 569 . 15 1 1 A 61 61 ASP N N 61 120.701 125.100 -4.399 1
1 570 . 15 1 1 A 62 62 GLY HA2 H 62 4.104 3.989 0.115 1
1 571 . 15 1 1 A 62 62 GLY HA3 H 62 3.832 3.993 -0.161 1
1 572 . 15 1 1 A 62 62 GLY CA C 62 42.576 45.359 -2.783 1
1 573 . 15 1 1 A 63 63 ARG H H 63 7.319 8.577 -1.258 1
1 574 . 15 1 1 A 63 63 ARG HA H 63 4.595 4.629 -0.034 1
1 579 . 15 1 1 A 63 63 ARG CA C 63 51.971 55.457 -3.486 1
1 582 . 15 1 1 A 63 63 ARG N N 63 119.206 120.412 -1.206 1
1 583 . 15 1 1 A 64 64 THR H H 64 8.735 8.752 -0.017 1
1 584 . 15 1 1 A 64 64 THR HA H 64 5.208 5.059 0.149 1
1 589 . 15 1 1 A 64 64 THR CA C 64 57.126 59.522 -2.396 1
1 590 . 15 1 1 A 64 64 THR CB C 64 69.885 71.852 -1.967 1
1 592 . 15 1 1 A 64 64 THR N N 64 108.713 112.714 -4.001 1
1 593 . 15 1 1 A 65 65 LEU H H 65 8.241 9.324 -1.083 1
1 594 . 15 1 1 A 65 65 LEU HA H 65 4.003 3.973 0.030 1
1 604 . 15 1 1 A 65 65 LEU CA C 65 56.409 57.994 -1.585 1
1 605 . 15 1 1 A 65 65 LEU CB C 65 37.179 41.337 -4.158 1
1 609 . 15 1 1 A 65 65 LEU N N 65 118.111 122.603 -4.492 1
1 610 . 15 1 1 A 66 66 SER H H 66 8.296 8.186 0.110 1
1 611 . 15 1 1 A 66 66 SER HA H 66 4.201 4.275 -0.074 1
1 614 . 15 1 1 A 66 66 SER CA C 66 58.454 59.943 -1.489 1
1 615 . 15 1 1 A 66 66 SER CB C 66 59.969 62.880 -2.911 1
1 616 . 15 1 1 A 66 66 SER N N 66 113.148 112.888 0.260 1
1 617 . 15 1 1 A 67 67 ASP H H 67 7.984 8.249 -0.265 1
1 618 . 15 1 1 A 67 67 ASP HA H 67 4.187 4.254 -0.067 1
1 621 . 15 1 1 A 67 67 ASP CA C 67 54.744 57.280 -2.536 1
1 622 . 15 1 1 A 67 67 ASP CB C 67 37.794 41.745 -3.951 1
1 623 . 15 1 1 A 67 67 ASP N N 67 124.130 123.631 0.499 1
1 624 . 15 1 1 A 68 68 TYR H H 68 7.177 7.736 -0.559 1
1 625 . 15 1 1 A 68 68 TYR N N 68 115.334 115.825 -0.491 1
1 626 . 15 1 1 A 69 69 ASN H H 69 8.111 8.045 0.066 1
1 627 . 15 1 1 A 69 69 ASN HA H 69 4.253 4.359 -0.106 1
1 630 . 15 1 1 A 69 69 ASN CA C 69 51.386 54.454 -3.068 1
1 631 . 15 1 1 A 69 69 ASN CB C 69 34.867 36.730 -1.863 1
1 632 . 15 1 1 A 69 69 ASN N N 69 116.867 114.823 2.044 1
1 633 . 15 1 1 A 70 70 ILE H H 70 7.460 7.789 -0.329 1
1 634 . 15 1 1 A 70 70 ILE HA H 70 3.210 3.932 -0.722 1
1 644 . 15 1 1 A 70 70 ILE CA C 70 60.157 61.593 -1.436 1
1 645 . 15 1 1 A 70 70 ILE CB C 70 34.754 37.343 -2.589 1
1 649 . 15 1 1 A 70 70 ILE N N 70 119.821 119.375 0.446 1
1 650 . 15 1 1 A 71 71 GLN H H 71 7.368 8.734 -1.366 1
1 651 . 15 1 1 A 71 71 GLN HA H 71 4.099 4.352 -0.253 1
1 656 . 15 1 1 A 71 71 GLN CA C 71 50.906 55.808 -4.902 1
1 657 . 15 1 1 A 71 71 GLN CB C 71 28.793 29.680 -0.887 1
1 659 . 15 1 1 A 71 71 GLN N N 71 124.287 127.395 -3.108 1
1 660 . 15 1 1 A 72 72 ARG H H 72 7.583 8.692 -1.109 1
1 661 . 15 1 1 A 72 72 ARG HA H 72 3.907 4.021 -0.114 1
1 668 . 15 1 1 A 72 72 ARG CA C 72 54.527 59.276 -4.749 1
1 669 . 15 1 1 A 72 72 ARG CB C 72 27.470 29.907 -2.437 1
1 672 . 15 1 1 A 72 72 ARG N N 72 119.007 122.000 -2.993 1
1 673 . 15 1 1 A 73 73 GLU H H 73 9.262 8.292 0.970 1
1 674 . 15 1 1 A 73 73 GLU HA H 73 3.586 4.705 -1.119 1
1 679 . 15 1 1 A 73 73 GLU CA C 73 55.703 56.466 -0.763 1
1 680 . 15 1 1 A 73 73 GLU CB C 73 23.669 29.025 -5.356 1
1 682 . 15 1 1 A 73 73 GLU N N 73 115.180 117.016 -1.836 1
1 683 . 15 1 1 A 74 74 SER H H 74 7.551 7.668 -0.117 1
1 684 . 15 1 1 A 74 74 SER HA H 74 4.613 5.284 -0.671 1
1 687 . 15 1 1 A 74 74 SER CA C 74 58.305 57.254 1.051 1
1 688 . 15 1 1 A 74 74 SER CB C 74 62.156 66.268 -4.112 1
1 689 . 15 1 1 A 74 74 SER N N 74 115.104 116.378 -1.274 1
1 690 . 15 1 1 A 75 75 THR H H 75 8.785 8.876 -0.091 1
1 691 . 15 1 1 A 75 75 THR HA H 75 5.014 4.900 0.114 1
1 696 . 15 1 1 A 75 75 THR CA C 75 59.835 62.118 -2.283 1
1 697 . 15 1 1 A 75 75 THR CB C 75 67.258 68.805 -1.547 1
1 699 . 15 1 1 A 75 75 THR N N 75 118.401 119.412 -1.011 1
1 700 . 15 1 1 A 76 76 LEU H H 76 9.447 9.995 -0.548 1
1 701 . 15 1 1 A 76 76 LEU HA H 76 4.930 4.720 0.210 1
1 711 . 15 1 1 A 76 76 LEU CA C 76 51.107 54.405 -3.298 1
1 712 . 15 1 1 A 76 76 LEU CB C 76 40.841 42.817 -1.976 1
1 716 . 15 1 1 A 76 76 LEU N N 76 127.905 127.982 -0.077 1
1 717 . 15 1 1 A 77 77 HIS HA H 77 4.976 5.370 -0.394 1
1 720 . 15 1 1 A 77 77 HIS CA C 77 53.776 54.208 -0.432 1
1 721 . 15 1 1 A 77 77 HIS CB C 77 28.438 31.500 -3.062 1
1 722 . 15 1 1 A 78 78 LEU H H 78 8.450 8.609 -0.159 1
1 723 . 15 1 1 A 78 78 LEU HA H 78 5.085 5.061 0.024 1
1 733 . 15 1 1 A 78 78 LEU CA C 78 50.896 53.785 -2.889 1
1 734 . 15 1 1 A 78 78 LEU CB C 78 41.916 45.075 -3.159 1
1 738 . 15 1 1 A 78 78 LEU N N 78 126.178 126.318 -0.140 1
1 739 . 15 1 1 A 79 79 VAL H H 79 9.093 9.037 0.056 1
1 740 . 15 1 1 A 79 79 VAL HA H 79 4.053 4.703 -0.650 1
1 748 . 15 1 1 A 79 79 VAL CA C 79 59.054 61.066 -2.012 1
1 749 . 15 1 1 A 79 79 VAL CB C 79 32.115 34.032 -1.917 1
1 752 . 15 1 1 A 79 79 VAL N N 79 128.372 125.801 2.571 1
1 753 . 15 1 1 A 80 80 LEU H H 80 8.000 9.085 -1.085 1
1 754 . 15 1 1 A 80 80 LEU HA H 80 5.105 4.969 0.136 1
1 764 . 15 1 1 A 80 80 LEU CA C 80 50.556 53.361 -2.805 1
1 765 . 15 1 1 A 80 80 LEU CB C 80 39.597 43.566 -3.969 1
1 769 . 15 1 1 A 80 80 LEU N N 80 126.145 127.038 -0.893 1
1 770 . 15 1 1 A 81 81 ARG H H 81 8.470 8.203 0.267 1
1 771 . 15 1 1 A 81 81 ARG HA H 81 4.197 4.586 -0.389 1
1 778 . 15 1 1 A 81 81 ARG CA C 81 53.133 56.345 -3.212 1
1 779 . 15 1 1 A 81 81 ARG CB C 81 28.413 30.970 -2.557 1
1 782 . 15 1 1 A 81 81 ARG N N 81 121.625 126.221 -4.596 1
1 783 . 15 1 1 A 82 82 LEU H H 82 8.454 8.438 0.016 1
1 784 . 15 1 1 A 82 82 LEU HA H 82 4.339 4.686 -0.347 1
1 794 . 15 1 1 A 82 82 LEU CA C 82 52.081 54.527 -2.446 1
1 795 . 15 1 1 A 82 82 LEU CB C 82 39.810 44.211 -4.401 1
1 799 . 15 1 1 A 82 82 LEU N N 82 123.832 126.441 -2.609 1
1 800 . 15 1 1 A 83 83 ARG H H 83 8.404 8.943 -0.539 1
1 801 . 15 1 1 A 83 83 ARG HA H 83 4.308 4.638 -0.330 1
1 808 . 15 1 1 A 83 83 ARG CA C 83 53.258 55.665 -2.407 1
1 809 . 15 1 1 A 83 83 ARG CB C 83 28.160 32.237 -4.077 1
1 812 . 15 1 1 A 83 83 ARG N N 83 121.447 122.961 -1.514 1
1 813 . 15 1 1 A 84 84 GLY H H 84 8.410 7.423 0.987 1
1 814 . 15 1 1 A 84 84 GLY HA2 H 84 3.929 4.101 -0.172 1
1 815 . 15 1 1 A 84 84 GLY HA3 H 84 3.929 4.101 -0.172 1
1 816 . 15 1 1 A 84 84 GLY CA C 84 42.751 45.503 -2.752 1
1 817 . 15 1 1 A 84 84 GLY N N 84 110.030 106.901 3.129 1
1 818 . 15 1 1 A 85 85 GLY H H 85 8.295 8.461 -0.166 1
1 819 . 15 1 1 A 85 85 GLY HA2 H 85 3.950 3.984 -0.034 1
1 820 . 15 1 1 A 85 85 GLY HA3 H 85 3.950 3.985 -0.035 1
1 821 . 15 1 1 A 85 85 GLY CA C 85 42.831 45.941 -3.110 1
1 822 . 15 1 1 A 85 85 GLY N N 85 108.838 111.091 -2.253 1
1 823 . 15 1 1 A 86 86 SER H H 86 8.292 8.006 0.286 1
1 824 . 15 1 1 A 86 86 SER HA H 86 4.405 4.909 -0.504 1
1 827 . 15 1 1 A 86 86 SER CA C 86 55.965 56.669 -0.704 1
1 828 . 15 1 1 A 86 86 SER CB C 86 61.232 63.349 -2.117 1
1 829 . 15 1 1 A 86 86 SER N N 86 116.028 111.427 4.601 1
1 830 . 15 1 1 A 87 87 MET H H 87 8.470 7.993 0.477 1
1 831 . 15 1 1 A 87 87 MET HA H 87 4.447 4.216 0.231 1
1 836 . 15 1 1 A 87 87 MET CA C 87 53.281 58.097 -4.816 1
1 837 . 15 1 1 A 87 87 MET CB C 87 29.788 32.588 -2.800 1
1 839 . 15 1 1 A 87 87 MET N N 87 121.625 120.827 0.798 1
1 840 . 15 1 1 A 88 88 GLY H H 88 8.320 7.995 0.325 1
1 841 . 15 1 1 A 88 88 GLY HA2 H 88 3.919 3.756 0.163 1
1 842 . 15 1 1 A 88 88 GLY HA3 H 88 3.896 3.756 0.140 1
1 843 . 15 1 1 A 88 88 GLY CA C 88 43.060 46.458 -3.398 1
1 844 . 15 1 1 A 88 88 GLY N N 88 109.625 106.131 3.494 1
1 845 . 15 1 1 A 89 89 GLY H H 89 8.256 8.325 -0.069 1
1 846 . 15 1 1 A 89 89 GLY HA2 H 89 3.940 4.247 -0.307 1
1 847 . 15 1 1 A 89 89 GLY HA3 H 89 3.910 4.248 -0.338 1
1 848 . 15 1 1 A 89 89 GLY CA C 89 42.678 45.464 -2.786 1
1 849 . 15 1 1 A 89 89 GLY N N 89 108.982 111.245 -2.263 1
1 850 . 15 1 1 A 90 90 ALA H H 90 8.203 8.716 -0.513 1
1 851 . 15 1 1 A 90 90 ALA HA H 90 4.255 4.089 0.166 1
1 855 . 15 1 1 A 90 90 ALA CA C 90 50.763 54.952 -4.189 1
1 856 . 15 1 1 A 90 90 ALA CB C 90 16.364 18.522 -2.158 1
1 857 . 15 1 1 A 90 90 ALA N N 90 124.065 122.634 1.431 1
1 858 . 15 1 1 A 91 91 ALA H H 91 8.273 7.772 0.501 1
1 859 . 15 1 1 A 91 91 ALA HA H 91 4.204 4.289 -0.085 1
1 863 . 15 1 1 A 91 91 ALA CA C 91 51.080 52.016 -0.936 1
1 864 . 15 1 1 A 91 91 ALA CB C 91 16.036 19.879 -3.843 1
1 865 . 15 1 1 A 91 91 ALA N N 91 121.985 119.379 2.606 1
1 866 . 15 1 1 A 92 92 ASP H H 92 8.022 9.124 -1.102 1
1 867 . 15 1 1 A 92 92 ASP HA H 92 4.455 4.965 -0.510 1
1 870 . 15 1 1 A 92 92 ASP CA C 92 52.664 55.190 -2.526 1
1 871 . 15 1 1 A 92 92 ASP CB C 92 37.925 43.557 -5.632 1
1 872 . 15 1 1 A 92 92 ASP N N 92 118.621 121.404 -2.783 1
1 873 . 15 1 1 A 93 93 GLU H H 93 8.282 7.703 0.579 1
1 874 . 15 1 1 A 93 93 GLU HA H 93 3.912 4.493 -0.581 1
1 879 . 15 1 1 A 93 93 GLU CA C 93 56.947 57.882 -0.935 1
1 880 . 15 1 1 A 93 93 GLU CB C 93 27.413 31.731 -4.318 1
1 882 . 15 1 1 A 93 93 GLU N N 93 122.247 115.939 6.308 1
1 883 . 15 1 1 A 94 94 GLU H H 94 8.194 8.650 -0.456 1
1 884 . 15 1 1 A 94 94 GLU HA H 94 3.940 4.397 -0.457 1
1 889 . 15 1 1 A 94 94 GLU CA C 94 56.681 57.913 -1.232 1
1 890 . 15 1 1 A 94 94 GLU CB C 94 26.127 30.798 -4.671 1
1 892 . 15 1 1 A 94 94 GLU N N 94 118.024 119.387 -1.363 1
1 893 . 15 1 1 A 95 95 GLU H H 95 7.816 8.188 -0.372 1
1 894 . 15 1 1 A 95 95 GLU HA H 95 4.121 4.084 0.037 1
1 898 . 15 1 1 A 95 95 GLU CA C 95 56.162 59.063 -2.901 1
1 899 . 15 1 1 A 95 95 GLU CB C 95 26.403 29.305 -2.902 1
1 901 . 15 1 1 A 95 95 GLU N N 95 120.028 118.688 1.340 1
1 902 . 15 1 1 A 96 96 LEU H H 96 7.637 8.012 -0.375 1
1 903 . 15 1 1 A 96 96 LEU HA H 96 3.988 4.033 -0.045 1
1 913 . 15 1 1 A 96 96 LEU CA C 96 55.303 57.978 -2.675 1
1 914 . 15 1 1 A 96 96 LEU CB C 96 39.038 41.620 -2.582 1
1 918 . 15 1 1 A 96 96 LEU N N 96 119.866 117.775 2.091 1
1 919 . 15 1 1 A 97 97 ILE H H 97 8.044 7.652 0.392 1
1 920 . 15 1 1 A 97 97 ILE HA H 97 3.478 3.694 -0.216 1
1 930 . 15 1 1 A 97 97 ILE CA C 97 62.054 64.908 -2.854 1
1 931 . 15 1 1 A 97 97 ILE CB C 97 34.541 37.654 -3.113 1
1 935 . 15 1 1 A 97 97 ILE N N 97 119.088 119.604 -0.516 1
1 936 . 15 1 1 A 98 98 ARG H H 98 7.991 8.301 -0.310 1
1 937 . 15 1 1 A 98 98 ARG HA H 98 3.793 4.038 -0.245 1
1 944 . 15 1 1 A 98 98 ARG CA C 98 57.509 58.151 -0.642 1
1 945 . 15 1 1 A 98 98 ARG CB C 98 27.191 29.604 -2.413 1
1 948 . 15 1 1 A 98 98 ARG N N 98 119.225 120.740 -1.515 1
1 949 . 15 1 1 A 99 99 LYS H H 99 8.101 8.714 -0.613 1
1 950 . 15 1 1 A 99 99 LYS HA H 99 3.968 4.111 -0.143 1
1 959 . 15 1 1 A 99 99 LYS CA C 99 56.455 58.541 -2.086 1
1 960 . 15 1 1 A 99 99 LYS CB C 99 29.531 32.355 -2.824 1
1 964 . 15 1 1 A 99 99 LYS N N 99 119.464 119.897 -0.433 1
1 965 . 15 1 1 A 100 100 ALA H H 100 8.167 7.817 0.350 1
1 966 . 15 1 1 A 100 100 ALA HA H 100 3.789 4.098 -0.309 1
1 970 . 15 1 1 A 100 100 ALA CA C 100 52.451 54.440 -1.989 1
1 971 . 15 1 1 A 100 100 ALA CB C 100 16.259 18.282 -2.023 1
1 972 . 15 1 1 A 100 100 ALA N N 100 122.398 120.475 1.923 1
1 973 . 15 1 1 A 101 101 ILE H H 101 8.777 7.829 0.948 1
1 974 . 15 1 1 A 101 101 ILE HA H 101 3.191 3.661 -0.470 1
1 984 . 15 1 1 A 101 101 ILE CA C 101 62.910 64.945 -2.035 1
1 985 . 15 1 1 A 101 101 ILE CB C 101 34.544 37.275 -2.731 1
1 989 . 15 1 1 A 101 101 ILE N N 101 120.431 119.081 1.350 1
1 990 . 15 1 1 A 102 102 GLU H H 102 7.890 7.775 0.115 1
1 991 . 15 1 1 A 102 102 GLU HA H 102 3.848 4.214 -0.366 1
1 996 . 15 1 1 A 102 102 GLU CA C 102 57.079 57.946 -0.867 1
1 997 . 15 1 1 A 102 102 GLU CB C 102 26.769 29.800 -3.031 1
1 999 . 15 1 1 A 102 102 GLU N N 102 120.248 121.419 -1.171 1
1 1000 . 15 1 1 A 103 103 LEU H H 103 8.194 7.731 0.463 1
1 1001 . 15 1 1 A 103 103 LEU HA H 103 3.912 4.231 -0.319 1
1 1011 . 15 1 1 A 103 103 LEU CA C 103 55.078 57.158 -2.080 1
1 1012 . 15 1 1 A 103 103 LEU CB C 103 38.963 42.157 -3.194 1
1 1016 . 15 1 1 A 103 103 LEU N N 103 120.341 120.039 0.302 1
1 1017 . 15 1 1 A 104 104 SER H H 104 8.268 7.521 0.747 1
1 1018 . 15 1 1 A 104 104 SER HA H 104 4.120 4.477 -0.357 1
1 1021 . 15 1 1 A 104 104 SER CA C 104 58.301 59.584 -1.283 1
1 1022 . 15 1 1 A 104 104 SER CB C 104 60.193 64.296 -4.103 1
1 1023 . 15 1 1 A 104 104 SER N N 104 115.150 114.602 0.548 1
1 1024 . 15 1 1 A 105 105 LEU H H 105 7.501 7.274 0.227 1
1 1025 . 15 1 1 A 105 105 LEU HA H 105 4.041 3.979 0.062 1
1 1035 . 15 1 1 A 105 105 LEU CA C 105 53.995 56.145 -2.150 1
1 1036 . 15 1 1 A 105 105 LEU CB C 105 39.597 42.048 -2.451 1
1 1040 . 15 1 1 A 105 105 LEU N N 105 124.223 119.844 4.379 1
1 1041 . 15 1 1 A 106 106 LYS H H 106 7.542 7.999 -0.457 1
1 1042 . 15 1 1 A 106 106 LYS HA H 106 4.090 4.006 0.084 1
1 1050 . 15 1 1 A 106 106 LYS CA C 106 55.495 58.965 -3.470 1
1 1051 . 15 1 1 A 106 106 LYS CB C 106 29.941 31.845 -1.904 1
1 1055 . 15 1 1 A 106 106 LYS N N 106 120.328 117.441 2.887 1
1 1056 . 15 1 1 A 107 107 GLU H H 107 7.884 8.369 -0.485 1
1 1057 . 15 1 1 A 107 107 GLU HA H 107 4.210 4.016 0.194 1
1 1060 . 15 1 1 A 107 107 GLU CA C 107 54.509 59.573 -5.064 1
1 1061 . 15 1 1 A 107 107 GLU CB C 107 27.239 29.448 -2.209 1
1 1062 . 15 1 1 A 107 107 GLU N N 107 118.621 119.906 -1.285 1
1 1063 . 15 1 1 A 108 108 SER H H 108 7.923 8.289 -0.366 1
1 1064 . 15 1 1 A 108 108 SER HA H 108 4.385 3.987 0.398 1
1 1067 . 15 1 1 A 108 108 SER CA C 108 56.442 61.435 -4.993 1
1 1068 . 15 1 1 A 108 108 SER CB C 108 60.953 62.728 -1.775 1
1 1069 . 15 1 1 A 108 108 SER N N 108 115.670 113.990 1.680 1
1 1070 . 15 1 1 A 109 109 ARG H H 109 8.068 7.752 0.316 1
1 1071 . 15 1 1 A 109 109 ARG HA H 109 4.307 4.087 0.220 1
1 1078 . 15 1 1 A 109 109 ARG CA C 109 53.732 58.975 -5.243 1
1 1079 . 15 1 1 A 109 109 ARG CB C 109 27.968 29.972 -2.004 1
1 1082 . 15 1 1 A 109 109 ARG N N 109 122.313 121.838 0.475 1
1 1083 . 15 1 1 A 110 110 ASN H H 110 8.292 8.731 -0.439 1
1 1084 . 15 1 1 A 110 110 ASN HA H 110 4.720 4.420 0.300 1
1 1087 . 15 1 1 A 110 110 ASN CA C 110 50.750 56.296 -5.546 1
1 1088 . 15 1 1 A 110 110 ASN CB C 110 36.197 38.245 -2.048 1
1 1089 . 15 1 1 A 110 110 ASN N N 110 119.304 118.200 1.104 1
1 1090 . 15 1 1 A 111 111 SER H H 111 8.244 8.004 0.240 1
1 1091 . 15 1 1 A 111 111 SER HA H 111 4.423 4.368 0.055 1
1 1094 . 15 1 1 A 111 111 SER CA C 111 55.990 60.288 -4.298 1
1 1095 . 15 1 1 A 111 111 SER CB C 111 61.027 63.708 -2.681 1
1 1096 . 15 1 1 A 111 111 SER N N 111 116.119 115.025 1.094 1
1 1097 . 15 1 1 A 112 112 GLY H H 112 8.327 7.964 0.363 1
1 1098 . 15 1 1 A 112 112 GLY HA2 H 112 3.944 3.923 0.021 1
1 1099 . 15 1 1 A 112 112 GLY HA3 H 112 3.912 3.946 -0.034 1
1 1100 . 15 1 1 A 112 112 GLY CA C 112 42.733 45.305 -2.572 1
1 1101 . 15 1 1 A 112 112 GLY N N 112 110.442 108.964 1.478 1
1 1102 . 15 1 1 A 113 113 GLY H H 113 8.097 8.378 -0.281 1
1 1103 . 15 1 1 A 113 113 GLY HA2 H 113 3.831 3.639 0.192 1
1 1104 . 15 1 1 A 113 113 GLY HA3 H 113 3.785 3.729 0.056 1
1 1105 . 15 1 1 A 113 113 GLY CA C 113 42.435 46.892 -4.457 1
1 1106 . 15 1 1 A 113 113 GLY N N 113 108.745 109.196 -0.451 1
1 2 . 16 1 1 A 3 3 HIS CB C 3 33.709 31.695 2.014 1
1 3 . 16 1 1 A 7 7 HIS H H 7 8.731 7.658 1.073 1
1 4 . 16 1 1 A 7 7 HIS HA H 7 4.564 5.123 -0.559 1
1 7 . 16 1 1 A 7 7 HIS CA C 7 53.649 53.553 0.096 1
1 8 . 16 1 1 A 7 7 HIS CB C 7 26.268 33.649 -7.381 1
1 9 . 16 1 1 A 7 7 HIS N N 7 121.126 115.792 5.334 1
1 10 . 16 1 1 A 8 8 GLY H H 8 8.540 8.489 0.051 1
1 11 . 16 1 1 A 8 8 GLY HA2 H 8 3.973 4.146 -0.173 1
1 12 . 16 1 1 A 8 8 GLY HA3 H 8 3.811 4.189 -0.378 1
1 13 . 16 1 1 A 8 8 GLY CA C 8 42.618 45.245 -2.627 1
1 14 . 16 1 1 A 8 8 GLY N N 8 110.662 108.685 1.977 1
1 15 . 16 1 1 A 9 9 GLU H H 9 8.239 8.442 -0.203 1
1 16 . 16 1 1 A 9 9 GLU HA H 9 4.568 4.352 0.216 1
1 18 . 16 1 1 A 9 9 GLU CA C 9 53.605 57.520 -3.915 1
1 19 . 16 1 1 A 9 9 GLU CB C 9 28.019 32.886 -4.867 1
1 20 . 16 1 1 A 9 9 GLU N N 9 121.669 124.211 -2.542 1
1 21 . 16 1 1 A 10 10 PHE H H 10 8.785 7.275 1.510 1
1 22 . 16 1 1 A 10 10 PHE HA H 10 4.850 5.108 -0.258 1
1 25 . 16 1 1 A 10 10 PHE CA C 10 52.630 56.381 -3.751 1
1 26 . 16 1 1 A 10 10 PHE CB C 10 37.906 43.086 -5.180 1
1 27 . 16 1 1 A 10 10 PHE N N 10 118.401 116.016 2.385 1
1 28 . 16 1 1 A 11 11 GLN H H 11 8.552 9.052 -0.500 1
1 29 . 16 1 1 A 11 11 GLN HA H 11 5.425 5.271 0.154 1
1 34 . 16 1 1 A 11 11 GLN CA C 11 51.663 53.560 -1.897 1
1 35 . 16 1 1 A 11 11 GLN CB C 11 28.427 32.952 -4.525 1
1 37 . 16 1 1 A 11 11 GLN N N 11 117.519 120.108 -2.589 1
1 38 . 16 1 1 A 12 12 ILE H H 12 8.239 8.445 -0.206 1
1 39 . 16 1 1 A 12 12 ILE HA H 12 4.103 5.280 -1.177 1
1 49 . 16 1 1 A 12 12 ILE CA C 12 57.134 59.396 -2.262 1
1 50 . 16 1 1 A 12 12 ILE CB C 12 39.491 42.200 -2.709 1
1 54 . 16 1 1 A 12 12 ILE N N 12 114.043 117.423 -3.380 1
1 55 . 16 1 1 A 13 13 PHE H H 13 8.538 8.456 0.082 1
1 56 . 16 1 1 A 13 13 PHE HA H 13 5.620 5.189 0.431 1
1 59 . 16 1 1 A 13 13 PHE CA C 13 52.438 56.806 -4.368 1
1 60 . 16 1 1 A 13 13 PHE CB C 13 39.253 40.962 -1.709 1
1 61 . 16 1 1 A 13 13 PHE N N 13 117.015 120.029 -3.014 1
1 62 . 16 1 1 A 14 14 ALA H H 14 9.238 9.799 -0.561 1
1 63 . 16 1 1 A 14 14 ALA HA H 14 5.311 5.172 0.139 1
1 67 . 16 1 1 A 14 14 ALA CA C 14 47.183 50.254 -3.071 1
1 68 . 16 1 1 A 14 14 ALA CB C 14 17.811 21.215 -3.404 1
1 69 . 16 1 1 A 14 14 ALA N N 14 123.503 126.805 -3.302 1
1 70 . 16 1 1 A 15 15 LYS H H 15 8.810 9.976 -1.166 1
1 71 . 16 1 1 A 15 15 LYS HA H 15 5.511 5.489 0.022 1
1 80 . 16 1 1 A 15 15 LYS CA C 15 51.718 54.809 -3.091 1
1 81 . 16 1 1 A 15 15 LYS CB C 15 33.635 34.460 -0.825 1
1 85 . 16 1 1 A 15 15 LYS N N 15 123.382 125.039 -1.657 1
1 86 . 16 1 1 A 16 16 THR H H 16 8.830 8.341 0.489 1
1 87 . 16 1 1 A 16 16 THR HA H 16 5.212 5.369 -0.157 1
1 92 . 16 1 1 A 16 16 THR CA C 16 57.614 59.448 -1.834 1
1 93 . 16 1 1 A 16 16 THR CB C 16 68.210 72.080 -3.870 1
1 95 . 16 1 1 A 16 16 THR N N 16 116.517 115.892 0.625 1
1 96 . 16 1 1 A 17 17 LEU H H 17 9.428 8.397 1.031 1
1 97 . 16 1 1 A 17 17 LEU HA H 17 4.286 3.979 0.307 1
1 107 . 16 1 1 A 17 17 LEU CA C 17 54.504 58.601 -4.097 1
1 108 . 16 1 1 A 17 17 LEU CB C 17 38.564 41.684 -3.120 1
1 112 . 16 1 1 A 17 17 LEU N N 17 121.786 123.656 -1.870 1
1 113 . 16 1 1 A 18 18 THR H H 18 7.546 7.837 -0.291 1
1 114 . 16 1 1 A 18 18 THR HA H 18 4.391 4.237 0.154 1
1 119 . 16 1 1 A 18 18 THR CA C 18 58.524 63.450 -4.926 1
1 120 . 16 1 1 A 18 18 THR CB C 18 66.166 70.465 -4.299 1
1 122 . 16 1 1 A 18 18 THR N N 18 105.598 108.857 -3.259 1
1 123 . 16 1 1 A 19 19 GLY H H 19 7.683 8.319 -0.636 1
1 124 . 16 1 1 A 19 19 GLY HA2 H 19 3.300 3.938 -0.638 1
1 125 . 16 1 1 A 19 19 GLY HA3 H 19 4.248 3.948 0.300 1
1 126 . 16 1 1 A 19 19 GLY CA C 19 42.947 46.135 -3.188 1
1 127 . 16 1 1 A 19 19 GLY N N 19 109.243 112.083 -2.840 1
1 128 . 16 1 1 A 20 20 LYS H H 20 7.375 8.025 -0.650 1
1 129 . 16 1 1 A 20 20 LYS HA H 20 4.331 4.685 -0.354 1
1 138 . 16 1 1 A 20 20 LYS CA C 20 53.829 55.142 -1.313 1
1 139 . 16 1 1 A 20 20 LYS CB C 20 30.385 34.564 -4.179 1
1 143 . 16 1 1 A 20 20 LYS N N 20 122.757 120.071 2.686 1
1 144 . 16 1 1 A 21 21 THR H H 21 8.637 8.965 -0.328 1
1 145 . 16 1 1 A 21 21 THR HA H 21 4.852 4.872 -0.020 1
1 150 . 16 1 1 A 21 21 THR CA C 21 59.846 62.255 -2.409 1
1 151 . 16 1 1 A 21 21 THR CB C 21 67.140 69.917 -2.777 1
1 153 . 16 1 1 A 21 21 THR N N 21 121.524 123.077 -1.553 1
1 154 . 16 1 1 A 22 22 ILE H H 22 9.509 9.239 0.270 1
1 155 . 16 1 1 A 22 22 ILE HA H 22 4.349 4.900 -0.551 1
1 165 . 16 1 1 A 22 22 ILE CA C 22 57.634 60.073 -2.439 1
1 166 . 16 1 1 A 22 22 ILE CB C 22 38.334 42.252 -3.918 1
1 170 . 16 1 1 A 22 22 ILE N N 22 129.772 127.188 2.584 1
1 171 . 16 1 1 A 23 23 THR H H 23 8.838 8.671 0.167 1
1 172 . 16 1 1 A 23 23 THR HA H 23 4.653 4.894 -0.241 1
1 177 . 16 1 1 A 23 23 THR CA C 23 60.194 61.759 -1.565 1
1 178 . 16 1 1 A 23 23 THR CB C 23 66.577 70.052 -3.475 1
1 180 . 16 1 1 A 23 23 THR N N 23 124.070 124.558 -0.488 1
1 181 . 16 1 1 A 24 24 LEU H H 24 8.749 8.632 0.117 1
1 182 . 16 1 1 A 24 24 LEU HA H 24 4.619 5.226 -0.607 1
1 192 . 16 1 1 A 24 24 LEU CA C 24 50.257 52.891 -2.634 1
1 193 . 16 1 1 A 24 24 LEU CB C 24 42.932 45.706 -2.774 1
1 197 . 16 1 1 A 24 24 LEU N N 24 126.499 123.208 3.291 1
1 198 . 16 1 1 A 25 25 GLU H H 25 7.990 8.562 -0.572 1
1 199 . 16 1 1 A 25 25 GLU HA H 25 4.591 4.914 -0.323 1
1 204 . 16 1 1 A 25 25 GLU CA C 25 52.845 56.076 -3.231 1
1 205 . 16 1 1 A 25 25 GLU CB C 25 27.210 29.485 -2.275 1
1 207 . 16 1 1 A 25 25 GLU N N 25 121.644 120.403 1.241 1
1 208 . 16 1 1 A 26 26 VAL H H 26 8.657 8.182 0.475 1
1 209 . 16 1 1 A 26 26 VAL HA H 26 4.403 4.971 -0.568 1
1 217 . 16 1 1 A 26 26 VAL CA C 26 56.020 58.631 -2.611 1
1 218 . 16 1 1 A 26 26 VAL CB C 26 33.631 35.468 -1.837 1
1 221 . 16 1 1 A 26 26 VAL N N 26 116.647 117.224 -0.577 1
1 222 . 16 1 1 A 27 27 GLU H H 27 7.970 8.706 -0.736 1
1 223 . 16 1 1 A 27 27 GLU HA H 27 4.447 4.135 0.312 1
1 228 . 16 1 1 A 27 27 GLU CA C 27 51.386 56.598 -5.212 1
1 229 . 16 1 1 A 27 27 GLU CB C 27 30.905 30.003 0.902 1
1 231 . 16 1 1 A 27 27 GLU N N 27 115.496 122.386 -6.890 1
1 232 . 16 1 1 A 28 28 SER H H 28 9.192 8.258 0.934 1
1 233 . 16 1 1 A 28 28 SER HA H 28 4.108 4.184 -0.076 1
1 236 . 16 1 1 A 28 28 SER CA C 28 59.909 60.856 -0.947 1
1 237 . 16 1 1 A 28 28 SER CB C 28 60.399 62.715 -2.316 1
1 238 . 16 1 1 A 28 28 SER N N 28 117.720 117.252 0.468 1
1 239 . 16 1 1 A 29 29 SER H H 29 7.371 7.566 -0.195 1
1 240 . 16 1 1 A 29 29 SER HA H 29 4.327 4.458 -0.131 1
1 243 . 16 1 1 A 29 29 SER CA C 29 54.805 57.075 -2.270 1
1 244 . 16 1 1 A 29 29 SER CB C 29 60.775 64.287 -3.512 1
1 245 . 16 1 1 A 29 29 SER N N 29 108.936 110.545 -1.609 1
1 246 . 16 1 1 A 30 30 ASP H H 30 7.852 7.711 0.141 1
1 247 . 16 1 1 A 30 30 ASP HA H 30 4.591 4.546 0.045 1
1 250 . 16 1 1 A 30 30 ASP CA C 30 53.040 54.589 -1.549 1
1 251 . 16 1 1 A 30 30 ASP CB C 30 37.942 41.536 -3.594 1
1 252 . 16 1 1 A 30 30 ASP N N 30 123.735 124.018 -0.283 1
1 253 . 16 1 1 A 31 31 THR H H 31 7.852 8.381 -0.529 1
1 254 . 16 1 1 A 31 31 THR HA H 31 4.918 4.951 -0.033 1
1 259 . 16 1 1 A 31 31 THR CA C 31 56.929 59.989 -3.060 1
1 260 . 16 1 1 A 31 31 THR CB C 31 68.674 71.775 -3.101 1
1 262 . 16 1 1 A 31 31 THR N N 31 109.181 112.871 -3.690 1
1 263 . 16 1 1 A 32 32 ILE H H 32 8.582 8.761 -0.179 1
1 264 . 16 1 1 A 32 32 ILE HA H 32 3.624 3.778 -0.154 1
1 274 . 16 1 1 A 32 32 ILE CA C 32 59.474 64.666 -5.192 1
1 275 . 16 1 1 A 32 32 ILE CB C 32 31.561 37.190 -5.629 1
1 279 . 16 1 1 A 32 32 ILE N N 32 121.833 122.531 -0.698 1
1 280 . 16 1 1 A 33 33 ASP H H 33 9.255 8.175 1.080 1
1 281 . 16 1 1 A 33 33 ASP HA H 33 4.201 4.273 -0.072 1
1 284 . 16 1 1 A 33 33 ASP CA C 33 54.679 57.923 -3.244 1
1 285 . 16 1 1 A 33 33 ASP CB C 33 37.700 42.033 -4.333 1
1 286 . 16 1 1 A 33 33 ASP N N 33 119.823 121.580 -1.757 1
1 287 . 16 1 1 A 34 34 ASN H H 34 8.026 7.591 0.435 1
1 288 . 16 1 1 A 34 34 ASN HA H 34 4.409 4.596 -0.187 1
1 291 . 16 1 1 A 34 34 ASN CA C 34 53.324 57.153 -3.829 1
1 292 . 16 1 1 A 34 34 ASN CB C 34 35.782 38.259 -2.477 1
1 293 . 16 1 1 A 34 34 ASN N N 34 119.540 117.751 1.789 1
1 294 . 16 1 1 A 35 35 VAL H H 35 8.167 8.071 0.096 1
1 295 . 16 1 1 A 35 35 VAL HA H 35 3.249 3.455 -0.206 1
1 303 . 16 1 1 A 35 35 VAL CA C 35 65.308 67.379 -2.071 1
1 304 . 16 1 1 A 35 35 VAL CB C 35 27.965 31.367 -3.402 1
1 307 . 16 1 1 A 35 35 VAL N N 35 122.223 120.924 1.299 1
1 308 . 16 1 1 A 36 36 LYS H H 36 8.460 8.665 -0.205 1
1 313 . 16 1 1 A 36 36 LYS CB C 36 30.753 32.319 -1.566 1
1 315 . 16 1 1 A 36 36 LYS N N 36 119.438 119.345 0.093 1
1 316 . 16 1 1 A 37 37 SER H H 37 8.196 8.919 -0.723 1
1 317 . 16 1 1 A 37 37 SER HA H 37 4.130 4.183 -0.053 1
1 320 . 16 1 1 A 37 37 SER CA C 37 58.528 61.184 -2.656 1
1 321 . 16 1 1 A 37 37 SER CB C 37 59.768 62.587 -2.819 1
1 322 . 16 1 1 A 37 37 SER N N 37 117.791 114.231 3.560 1
1 323 . 16 1 1 A 38 38 LYS H H 38 8.043 8.183 -0.140 1
1 324 . 16 1 1 A 38 38 LYS HA H 38 4.095 4.009 0.086 1
1 325 . 16 1 1 A 38 38 LYS CA C 38 57.377 58.717 -1.340 1
1 326 . 16 1 1 A 38 38 LYS N N 38 124.094 121.673 2.421 1
1 327 . 16 1 1 A 39 39 ILE H H 39 8.254 8.464 -0.210 1
1 328 . 16 1 1 A 39 39 ILE HA H 39 3.439 3.692 -0.253 1
1 338 . 16 1 1 A 39 39 ILE CA C 39 63.977 64.868 -0.891 1
1 339 . 16 1 1 A 39 39 ILE CB C 39 33.935 37.545 -3.610 1
1 343 . 16 1 1 A 39 39 ILE N N 39 122.107 120.234 1.873 1
1 344 . 16 1 1 A 40 40 GLN H H 40 8.379 8.222 0.157 1
1 345 . 16 1 1 A 40 40 GLN HA H 40 3.746 4.272 -0.526 1
1 350 . 16 1 1 A 40 40 GLN CA C 40 57.472 57.937 -0.465 1
1 351 . 16 1 1 A 40 40 GLN CB C 40 25.072 27.141 -2.069 1
1 353 . 16 1 1 A 40 40 GLN N N 40 123.725 119.978 3.747 1
1 354 . 16 1 1 A 41 41 ASP H H 41 8.210 7.764 0.446 1
1 355 . 16 1 1 A 41 41 ASP HA H 41 4.247 4.355 -0.108 1
1 358 . 16 1 1 A 41 41 ASP CA C 41 54.646 57.164 -2.518 1
1 359 . 16 1 1 A 41 41 ASP CB C 41 38.136 41.064 -2.928 1
1 360 . 16 1 1 A 41 41 ASP N N 41 120.564 120.978 -0.414 1
1 361 . 16 1 1 A 42 42 LYS H H 42 7.381 7.854 -0.473 1
1 362 . 16 1 1 A 42 42 LYS HA H 42 4.246 4.274 -0.028 1
1 369 . 16 1 1 A 42 42 LYS CA C 42 55.579 58.334 -2.755 1
1 370 . 16 1 1 A 42 42 LYS CB C 42 31.406 33.527 -2.121 1
1 373 . 16 1 1 A 42 42 LYS N N 42 115.674 118.302 -2.628 1
1 374 . 16 1 1 A 43 43 GLU H H 43 8.537 8.783 -0.246 1
1 375 . 16 1 1 A 43 43 GLU HA H 43 4.522 4.522 0.000 1
1 380 . 16 1 1 A 43 43 GLU CA C 43 52.772 55.798 -3.026 1
1 381 . 16 1 1 A 43 43 GLU CB C 43 30.535 30.841 -0.306 1
1 383 . 16 1 1 A 43 43 GLU N N 43 114.355 116.175 -1.820 1
1 384 . 16 1 1 A 44 44 GLY H H 44 8.611 7.960 0.651 1
1 385 . 16 1 1 A 44 44 GLY HA2 H 44 4.067 3.971 0.096 1
1 386 . 16 1 1 A 44 44 GLY HA3 H 44 3.819 3.972 -0.153 1
1 387 . 16 1 1 A 44 44 GLY CA C 44 43.205 45.608 -2.403 1
1 388 . 16 1 1 A 44 44 GLY N N 44 109.406 108.808 0.598 1
1 389 . 16 1 1 A 45 45 ILE H H 45 6.092 8.870 -2.778 1
1 390 . 16 1 1 A 45 45 ILE HA H 45 4.324 4.109 0.215 1
1 400 . 16 1 1 A 45 45 ILE CA C 45 55.211 60.232 -5.021 1
1 401 . 16 1 1 A 45 45 ILE CB C 45 37.903 38.091 -0.188 1
1 405 . 16 1 1 A 45 45 ILE N N 45 120.791 122.217 -1.426 1
1 406 . 16 1 1 A 46 46 PRO HA H 46 4.547 4.548 -0.001 1
1 413 . 16 1 1 A 46 46 PRO CA C 46 58.971 62.287 -3.316 1
1 414 . 16 1 1 A 46 46 PRO CB C 46 29.142 32.501 -3.359 1
1 417 . 16 1 1 A 47 47 PRO HA H 47 4.062 4.201 -0.139 1
1 424 . 16 1 1 A 47 47 PRO CA C 47 63.476 65.294 -1.818 1
1 425 . 16 1 1 A 47 47 PRO CB C 47 30.113 32.080 -1.967 1
1 428 . 16 1 1 A 48 48 ASP H H 48 8.418 8.240 0.178 1
1 429 . 16 1 1 A 48 48 ASP HA H 48 4.346 4.426 -0.080 1
1 432 . 16 1 1 A 48 48 ASP CA C 48 52.838 56.941 -4.103 1
1 433 . 16 1 1 A 48 48 ASP CB C 48 36.926 40.643 -3.717 1
1 434 . 16 1 1 A 48 48 ASP N N 48 113.462 117.343 -3.881 1
1 435 . 16 1 1 A 49 49 GLN H H 49 7.822 7.712 0.110 1
1 436 . 16 1 1 A 49 49 GLN HA H 49 4.283 4.127 0.156 1
1 439 . 16 1 1 A 49 49 GLN CA C 49 52.770 57.635 -4.865 1
1 441 . 16 1 1 A 49 49 GLN N N 49 117.377 117.133 0.244 1
1 442 . 16 1 1 A 50 50 GLN H H 50 7.451 7.519 -0.068 1
1 443 . 16 1 1 A 50 50 GLN HA H 50 4.260 4.777 -0.517 1
1 448 . 16 1 1 A 50 50 GLN CA C 50 53.725 54.542 -0.817 1
1 449 . 16 1 1 A 50 50 GLN CB C 50 29.142 32.279 -3.137 1
1 451 . 16 1 1 A 50 50 GLN N N 50 117.526 118.106 -0.580 1
1 452 . 16 1 1 A 51 51 ARG H H 51 8.534 8.402 0.132 1
1 453 . 16 1 1 A 51 51 ARG HA H 51 4.486 5.242 -0.756 1
1 460 . 16 1 1 A 51 51 ARG CA C 51 52.492 54.335 -1.843 1
1 461 . 16 1 1 A 51 51 ARG CB C 51 29.096 34.837 -5.741 1
1 464 . 16 1 1 A 51 51 ARG N N 51 121.655 119.953 1.702 1
1 465 . 16 1 1 A 52 52 LEU H H 52 8.683 8.915 -0.232 1
1 466 . 16 1 1 A 52 52 LEU HA H 52 5.255 4.956 0.299 1
1 476 . 16 1 1 A 52 52 LEU CA C 52 50.618 53.999 -3.381 1
1 477 . 16 1 1 A 52 52 LEU CB C 52 43.007 44.100 -1.093 1
1 481 . 16 1 1 A 52 52 LEU N N 52 122.929 121.633 1.296 1
1 482 . 16 1 1 A 53 53 ILE H H 53 9.286 8.937 0.349 1
1 483 . 16 1 1 A 53 53 ILE HA H 53 5.096 5.099 -0.003 1
1 492 . 16 1 1 A 53 53 ILE CA C 53 56.795 60.286 -3.491 1
1 496 . 16 1 1 A 53 53 ILE N N 53 124.718 125.789 -1.071 1
1 497 . 16 1 1 A 54 54 TRP H H 54 8.871 8.740 0.131 1
1 499 . 16 1 1 A 54 54 TRP N N 54 127.412 128.072 -0.660 1
1 501 . 16 1 1 A 55 55 ALA H H 55 8.401 8.336 0.065 1
1 502 . 16 1 1 A 55 55 ALA HA H 55 3.183 3.419 -0.236 1
1 506 . 16 1 1 A 55 55 ALA CA C 55 49.712 52.674 -2.962 1
1 507 . 16 1 1 A 55 55 ALA CB C 55 13.252 16.954 -3.702 1
1 508 . 16 1 1 A 55 55 ALA N N 55 128.894 129.826 -0.932 1
1 509 . 16 1 1 A 56 56 GLY H H 56 8.248 8.447 -0.199 1
1 510 . 16 1 1 A 56 56 GLY HA2 H 56 3.968 3.740 0.228 1
1 511 . 16 1 1 A 56 56 GLY HA3 H 56 3.916 3.761 0.155 1
1 512 . 16 1 1 A 56 56 GLY CA C 56 43.142 45.384 -2.242 1
1 513 . 16 1 1 A 56 56 GLY N N 56 101.499 102.258 -0.759 1
1 514 . 16 1 1 A 57 57 LYS H H 57 8.028 7.608 0.420 1
1 515 . 16 1 1 A 57 57 LYS HA H 57 4.609 4.505 0.104 1
1 522 . 16 1 1 A 57 57 LYS CA C 57 51.928 54.862 -2.934 1
1 523 . 16 1 1 A 57 57 LYS CB C 57 32.613 34.675 -2.062 1
1 526 . 16 1 1 A 57 57 LYS N N 57 118.995 120.786 -1.791 1
1 527 . 16 1 1 A 58 58 GLN H H 58 8.607 8.425 0.182 1
1 528 . 16 1 1 A 58 58 GLN HA H 58 4.617 4.506 0.111 1
1 533 . 16 1 1 A 58 58 GLN CA C 58 53.261 55.912 -2.651 1
1 534 . 16 1 1 A 58 58 GLN CB C 58 26.613 29.401 -2.788 1
1 536 . 16 1 1 A 58 58 GLN N N 58 119.825 123.470 -3.645 1
1 537 . 16 1 1 A 59 59 LEU H H 59 8.653 9.006 -0.353 1
1 538 . 16 1 1 A 59 59 LEU HA H 59 4.138 4.835 -0.697 1
1 548 . 16 1 1 A 59 59 LEU CA C 59 51.991 53.866 -1.875 1
1 549 . 16 1 1 A 59 59 LEU CB C 59 39.006 43.090 -4.084 1
1 553 . 16 1 1 A 59 59 LEU N N 59 125.484 124.803 0.681 1
1 554 . 16 1 1 A 60 60 GLU H H 60 8.461 8.526 -0.065 1
1 555 . 16 1 1 A 60 60 GLU HA H 60 4.371 4.756 -0.385 1
1 559 . 16 1 1 A 60 60 GLU CA C 60 53.436 54.185 -0.749 1
1 560 . 16 1 1 A 60 60 GLU CB C 60 29.057 32.712 -3.655 1
1 562 . 16 1 1 A 60 60 GLU N N 60 123.237 121.423 1.814 1
1 563 . 16 1 1 A 61 61 ASP H H 61 8.076 9.021 -0.945 1
1 564 . 16 1 1 A 61 61 ASP HA H 61 4.265 4.392 -0.127 1
1 567 . 16 1 1 A 61 61 ASP CA C 61 54.398 56.586 -2.188 1
1 568 . 16 1 1 A 61 61 ASP CB C 61 38.340 40.037 -1.697 1
1 569 . 16 1 1 A 61 61 ASP N N 61 120.701 118.653 2.048 1
1 570 . 16 1 1 A 62 62 GLY HA2 H 62 4.104 3.985 0.119 1
1 571 . 16 1 1 A 62 62 GLY HA3 H 62 3.832 3.990 -0.158 1
1 572 . 16 1 1 A 62 62 GLY CA C 62 42.576 46.121 -3.545 1
1 573 . 16 1 1 A 63 63 ARG H H 63 7.319 7.782 -0.463 1
1 574 . 16 1 1 A 63 63 ARG HA H 63 4.595 4.335 0.260 1
1 579 . 16 1 1 A 63 63 ARG CA C 63 51.971 56.280 -4.309 1
1 582 . 16 1 1 A 63 63 ARG N N 63 119.206 121.663 -2.457 1
1 583 . 16 1 1 A 64 64 THR H H 64 8.735 8.445 0.290 1
1 584 . 16 1 1 A 64 64 THR HA H 64 5.208 5.046 0.162 1
1 589 . 16 1 1 A 64 64 THR CA C 64 57.126 59.511 -2.385 1
1 590 . 16 1 1 A 64 64 THR CB C 64 69.885 71.832 -1.947 1
1 592 . 16 1 1 A 64 64 THR N N 64 108.713 115.686 -6.973 1
1 593 . 16 1 1 A 65 65 LEU H H 65 8.241 9.469 -1.228 1
1 594 . 16 1 1 A 65 65 LEU HA H 65 4.003 4.009 -0.006 1
1 604 . 16 1 1 A 65 65 LEU CA C 65 56.409 57.858 -1.449 1
1 605 . 16 1 1 A 65 65 LEU CB C 65 37.179 41.742 -4.563 1
1 609 . 16 1 1 A 65 65 LEU N N 65 118.111 122.760 -4.649 1
1 610 . 16 1 1 A 66 66 SER H H 66 8.296 8.007 0.289 1
1 611 . 16 1 1 A 66 66 SER HA H 66 4.201 4.240 -0.039 1
1 614 . 16 1 1 A 66 66 SER CA C 66 58.454 60.803 -2.349 1
1 615 . 16 1 1 A 66 66 SER CB C 66 59.969 62.862 -2.893 1
1 616 . 16 1 1 A 66 66 SER N N 66 113.148 113.727 -0.579 1
1 617 . 16 1 1 A 67 67 ASP H H 67 7.984 8.259 -0.275 1
1 618 . 16 1 1 A 67 67 ASP HA H 67 4.187 4.213 -0.026 1
1 621 . 16 1 1 A 67 67 ASP CA C 67 54.744 56.180 -1.436 1
1 622 . 16 1 1 A 67 67 ASP CB C 67 37.794 40.250 -2.456 1
1 623 . 16 1 1 A 67 67 ASP N N 67 124.130 120.841 3.289 1
1 624 . 16 1 1 A 68 68 TYR H H 68 7.177 7.233 -0.056 1
1 625 . 16 1 1 A 68 68 TYR N N 68 115.334 114.246 1.088 1
1 626 . 16 1 1 A 69 69 ASN H H 69 8.111 8.024 0.087 1
1 627 . 16 1 1 A 69 69 ASN HA H 69 4.253 4.419 -0.166 1
1 630 . 16 1 1 A 69 69 ASN CA C 69 51.386 54.334 -2.948 1
1 631 . 16 1 1 A 69 69 ASN CB C 69 34.867 36.496 -1.629 1
1 632 . 16 1 1 A 69 69 ASN N N 69 116.867 114.324 2.543 1
1 633 . 16 1 1 A 70 70 ILE H H 70 7.460 7.670 -0.210 1
1 634 . 16 1 1 A 70 70 ILE HA H 70 3.210 4.100 -0.890 1
1 644 . 16 1 1 A 70 70 ILE CA C 70 60.157 61.472 -1.315 1
1 645 . 16 1 1 A 70 70 ILE CB C 70 34.754 36.568 -1.814 1
1 649 . 16 1 1 A 70 70 ILE N N 70 119.821 119.476 0.345 1
1 650 . 16 1 1 A 71 71 GLN H H 71 7.368 8.260 -0.892 1
1 651 . 16 1 1 A 71 71 GLN HA H 71 4.099 4.620 -0.521 1
1 656 . 16 1 1 A 71 71 GLN CA C 71 50.906 54.463 -3.557 1
1 657 . 16 1 1 A 71 71 GLN CB C 71 28.793 29.133 -0.340 1
1 659 . 16 1 1 A 71 71 GLN N N 71 124.287 127.491 -3.204 1
1 660 . 16 1 1 A 72 72 ARG H H 72 7.583 8.633 -1.050 1
1 661 . 16 1 1 A 72 72 ARG HA H 72 3.907 4.890 -0.983 1
1 668 . 16 1 1 A 72 72 ARG CA C 72 54.527 57.936 -3.409 1
1 669 . 16 1 1 A 72 72 ARG CB C 72 27.470 31.381 -3.911 1
1 672 . 16 1 1 A 72 72 ARG N N 72 119.007 118.384 0.623 1
1 673 . 16 1 1 A 73 73 GLU H H 73 9.262 7.816 1.446 1
1 674 . 16 1 1 A 73 73 GLU HA H 73 3.586 4.601 -1.015 1
1 679 . 16 1 1 A 73 73 GLU CA C 73 55.703 56.312 -0.609 1
1 680 . 16 1 1 A 73 73 GLU CB C 73 23.669 28.329 -4.660 1
1 682 . 16 1 1 A 73 73 GLU N N 73 115.180 118.419 -3.239 1
1 683 . 16 1 1 A 74 74 SER H H 74 7.551 7.953 -0.402 1
1 684 . 16 1 1 A 74 74 SER HA H 74 4.613 5.228 -0.615 1
1 687 . 16 1 1 A 74 74 SER CA C 74 58.305 57.239 1.066 1
1 688 . 16 1 1 A 74 74 SER CB C 74 62.156 65.312 -3.156 1
1 689 . 16 1 1 A 74 74 SER N N 74 115.104 116.469 -1.365 1
1 690 . 16 1 1 A 75 75 THR H H 75 8.785 8.778 0.007 1
1 691 . 16 1 1 A 75 75 THR HA H 75 5.014 4.859 0.155 1
1 696 . 16 1 1 A 75 75 THR CA C 75 59.835 62.421 -2.586 1
1 697 . 16 1 1 A 75 75 THR CB C 75 67.258 69.085 -1.827 1
1 699 . 16 1 1 A 75 75 THR N N 75 118.401 121.951 -3.550 1
1 700 . 16 1 1 A 76 76 LEU H H 76 9.447 9.800 -0.353 1
1 701 . 16 1 1 A 76 76 LEU HA H 76 4.930 4.597 0.333 1
1 711 . 16 1 1 A 76 76 LEU CA C 76 51.107 54.711 -3.604 1
1 712 . 16 1 1 A 76 76 LEU CB C 76 40.841 42.272 -1.431 1
1 716 . 16 1 1 A 76 76 LEU N N 76 127.905 128.588 -0.683 1
1 717 . 16 1 1 A 77 77 HIS HA H 77 4.976 5.162 -0.186 1
1 720 . 16 1 1 A 77 77 HIS CA C 77 53.776 55.526 -1.750 1
1 721 . 16 1 1 A 77 77 HIS CB C 77 28.438 30.965 -2.527 1
1 722 . 16 1 1 A 78 78 LEU H H 78 8.450 9.585 -1.135 1
1 723 . 16 1 1 A 78 78 LEU HA H 78 5.085 5.253 -0.168 1
1 733 . 16 1 1 A 78 78 LEU CA C 78 50.896 53.479 -2.583 1
1 734 . 16 1 1 A 78 78 LEU CB C 78 41.916 46.036 -4.120 1
1 738 . 16 1 1 A 78 78 LEU N N 78 126.178 125.601 0.577 1
1 739 . 16 1 1 A 79 79 VAL H H 79 9.093 9.331 -0.238 1
1 740 . 16 1 1 A 79 79 VAL HA H 79 4.053 4.940 -0.887 1
1 748 . 16 1 1 A 79 79 VAL CA C 79 59.054 60.007 -0.953 1
1 749 . 16 1 1 A 79 79 VAL CB C 79 32.115 34.602 -2.487 1
1 752 . 16 1 1 A 79 79 VAL N N 79 128.372 119.849 8.523 1
1 753 . 16 1 1 A 80 80 LEU H H 80 8.000 8.956 -0.956 1
1 754 . 16 1 1 A 80 80 LEU HA H 80 5.105 4.954 0.151 1
1 764 . 16 1 1 A 80 80 LEU CA C 80 50.556 53.628 -3.072 1
1 765 . 16 1 1 A 80 80 LEU CB C 80 39.597 43.849 -4.252 1
1 769 . 16 1 1 A 80 80 LEU N N 80 126.145 128.167 -2.022 1
1 770 . 16 1 1 A 81 81 ARG H H 81 8.470 8.025 0.445 1
1 771 . 16 1 1 A 81 81 ARG HA H 81 4.197 4.644 -0.447 1
1 778 . 16 1 1 A 81 81 ARG CA C 81 53.133 55.075 -1.942 1
1 779 . 16 1 1 A 81 81 ARG CB C 81 28.413 31.910 -3.497 1
1 782 . 16 1 1 A 81 81 ARG N N 81 121.625 122.817 -1.192 1
1 783 . 16 1 1 A 82 82 LEU H H 82 8.454 8.598 -0.144 1
1 784 . 16 1 1 A 82 82 LEU HA H 82 4.339 4.997 -0.658 1
1 794 . 16 1 1 A 82 82 LEU CA C 82 52.081 53.842 -1.761 1
1 795 . 16 1 1 A 82 82 LEU CB C 82 39.810 44.637 -4.827 1
1 799 . 16 1 1 A 82 82 LEU N N 82 123.832 121.725 2.107 1
1 800 . 16 1 1 A 83 83 ARG H H 83 8.404 8.722 -0.318 1
1 801 . 16 1 1 A 83 83 ARG HA H 83 4.308 4.477 -0.169 1
1 808 . 16 1 1 A 83 83 ARG CA C 83 53.258 55.503 -2.245 1
1 809 . 16 1 1 A 83 83 ARG CB C 83 28.160 30.505 -2.345 1
1 812 . 16 1 1 A 83 83 ARG N N 83 121.447 127.590 -6.143 1
1 813 . 16 1 1 A 84 84 GLY H H 84 8.410 8.072 0.338 1
1 814 . 16 1 1 A 84 84 GLY HA2 H 84 3.929 3.972 -0.043 1
1 815 . 16 1 1 A 84 84 GLY HA3 H 84 3.929 3.972 -0.043 1
1 816 . 16 1 1 A 84 84 GLY CA C 84 42.751 45.227 -2.476 1
1 817 . 16 1 1 A 84 84 GLY N N 84 110.030 106.962 3.068 1
1 818 . 16 1 1 A 85 85 GLY H H 85 8.295 8.097 0.198 1
1 819 . 16 1 1 A 85 85 GLY HA2 H 85 3.950 3.969 -0.019 1
1 820 . 16 1 1 A 85 85 GLY HA3 H 85 3.950 3.970 -0.020 1
1 821 . 16 1 1 A 85 85 GLY CA C 85 42.831 47.223 -4.392 1
1 822 . 16 1 1 A 85 85 GLY N N 85 108.838 108.874 -0.036 1
1 823 . 16 1 1 A 86 86 SER H H 86 8.292 7.853 0.439 1
1 824 . 16 1 1 A 86 86 SER HA H 86 4.405 4.682 -0.277 1
1 827 . 16 1 1 A 86 86 SER CA C 86 55.965 57.031 -1.066 1
1 828 . 16 1 1 A 86 86 SER CB C 86 61.232 65.672 -4.440 1
1 829 . 16 1 1 A 86 86 SER N N 86 116.028 109.775 6.253 1
1 830 . 16 1 1 A 87 87 MET H H 87 8.470 8.373 0.097 1
1 831 . 16 1 1 A 87 87 MET HA H 87 4.447 4.395 0.052 1
1 836 . 16 1 1 A 87 87 MET CA C 87 53.281 56.265 -2.984 1
1 837 . 16 1 1 A 87 87 MET CB C 87 29.788 33.735 -3.947 1
1 839 . 16 1 1 A 87 87 MET N N 87 121.625 121.080 0.545 1
1 840 . 16 1 1 A 88 88 GLY H H 88 8.320 8.422 -0.102 1
1 841 . 16 1 1 A 88 88 GLY HA2 H 88 3.919 3.914 0.005 1
1 842 . 16 1 1 A 88 88 GLY HA3 H 88 3.896 3.915 -0.019 1
1 843 . 16 1 1 A 88 88 GLY CA C 88 43.060 45.734 -2.674 1
1 844 . 16 1 1 A 88 88 GLY N N 88 109.625 109.569 0.056 1
1 845 . 16 1 1 A 89 89 GLY H H 89 8.256 8.636 -0.380 1
1 846 . 16 1 1 A 89 89 GLY HA2 H 89 3.940 3.910 0.030 1
1 847 . 16 1 1 A 89 89 GLY HA3 H 89 3.910 3.911 -0.001 1
1 848 . 16 1 1 A 89 89 GLY CA C 89 42.678 47.274 -4.596 1
1 849 . 16 1 1 A 89 89 GLY N N 89 108.982 108.371 0.611 1
1 850 . 16 1 1 A 90 90 ALA H H 90 8.203 8.463 -0.260 1
1 851 . 16 1 1 A 90 90 ALA HA H 90 4.255 4.037 0.218 1
1 855 . 16 1 1 A 90 90 ALA CA C 90 50.763 55.034 -4.271 1
1 856 . 16 1 1 A 90 90 ALA CB C 90 16.364 18.767 -2.403 1
1 857 . 16 1 1 A 90 90 ALA N N 90 124.065 128.814 -4.749 1
1 858 . 16 1 1 A 91 91 ALA H H 91 8.273 7.893 0.380 1
1 859 . 16 1 1 A 91 91 ALA HA H 91 4.204 4.271 -0.067 1
1 863 . 16 1 1 A 91 91 ALA CA C 91 51.080 53.082 -2.002 1
1 864 . 16 1 1 A 91 91 ALA CB C 91 16.036 19.120 -3.084 1
1 865 . 16 1 1 A 91 91 ALA N N 91 121.985 120.217 1.768 1
1 866 . 16 1 1 A 92 92 ASP H H 92 8.022 8.673 -0.651 1
1 867 . 16 1 1 A 92 92 ASP HA H 92 4.455 4.927 -0.472 1
1 870 . 16 1 1 A 92 92 ASP CA C 92 52.664 53.086 -0.422 1
1 871 . 16 1 1 A 92 92 ASP CB C 92 37.925 42.121 -4.196 1
1 872 . 16 1 1 A 92 92 ASP N N 92 118.621 120.286 -1.665 1
1 873 . 16 1 1 A 93 93 GLU H H 93 8.282 8.228 0.054 1
1 874 . 16 1 1 A 93 93 GLU HA H 93 3.912 3.962 -0.050 1
1 879 . 16 1 1 A 93 93 GLU CA C 93 56.947 57.457 -0.510 1
1 880 . 16 1 1 A 93 93 GLU CB C 93 27.413 28.690 -1.277 1
1 882 . 16 1 1 A 93 93 GLU N N 93 122.247 117.696 4.551 1
1 883 . 16 1 1 A 94 94 GLU H H 94 8.194 7.887 0.307 1
1 884 . 16 1 1 A 94 94 GLU HA H 94 3.940 4.545 -0.605 1
1 889 . 16 1 1 A 94 94 GLU CA C 94 56.681 57.380 -0.699 1
1 890 . 16 1 1 A 94 94 GLU CB C 94 26.127 31.343 -5.216 1
1 892 . 16 1 1 A 94 94 GLU N N 94 118.024 117.238 0.786 1
1 893 . 16 1 1 A 95 95 GLU H H 95 7.816 8.652 -0.836 1
1 894 . 16 1 1 A 95 95 GLU HA H 95 4.121 4.129 -0.008 1
1 898 . 16 1 1 A 95 95 GLU CA C 95 56.162 59.043 -2.881 1
1 899 . 16 1 1 A 95 95 GLU CB C 95 26.403 28.776 -2.373 1
1 901 . 16 1 1 A 95 95 GLU N N 95 120.028 119.669 0.359 1
1 902 . 16 1 1 A 96 96 LEU H H 96 7.637 7.979 -0.342 1
1 903 . 16 1 1 A 96 96 LEU HA H 96 3.988 4.045 -0.057 1
1 913 . 16 1 1 A 96 96 LEU CA C 96 55.303 58.109 -2.806 1
1 914 . 16 1 1 A 96 96 LEU CB C 96 39.038 41.615 -2.577 1
1 918 . 16 1 1 A 96 96 LEU N N 96 119.866 118.262 1.604 1
1 919 . 16 1 1 A 97 97 ILE H H 97 8.044 7.423 0.621 1
1 920 . 16 1 1 A 97 97 ILE HA H 97 3.478 3.916 -0.438 1
1 930 . 16 1 1 A 97 97 ILE CA C 97 62.054 64.356 -2.302 1
1 931 . 16 1 1 A 97 97 ILE CB C 97 34.541 37.827 -3.286 1
1 935 . 16 1 1 A 97 97 ILE N N 97 119.088 119.148 -0.060 1
1 936 . 16 1 1 A 98 98 ARG H H 98 7.991 8.333 -0.342 1
1 937 . 16 1 1 A 98 98 ARG HA H 98 3.793 4.023 -0.230 1
1 944 . 16 1 1 A 98 98 ARG CA C 98 57.509 58.782 -1.273 1
1 945 . 16 1 1 A 98 98 ARG CB C 98 27.191 30.108 -2.917 1
1 948 . 16 1 1 A 98 98 ARG N N 98 119.225 121.061 -1.836 1
1 949 . 16 1 1 A 99 99 LYS H H 99 8.101 8.820 -0.719 1
1 950 . 16 1 1 A 99 99 LYS HA H 99 3.968 4.094 -0.126 1
1 959 . 16 1 1 A 99 99 LYS CA C 99 56.455 59.172 -2.717 1
1 960 . 16 1 1 A 99 99 LYS CB C 99 29.531 32.045 -2.514 1
1 964 . 16 1 1 A 99 99 LYS N N 99 119.464 118.413 1.051 1
1 965 . 16 1 1 A 100 100 ALA H H 100 8.167 7.930 0.237 1
1 966 . 16 1 1 A 100 100 ALA HA H 100 3.789 4.144 -0.355 1
1 970 . 16 1 1 A 100 100 ALA CA C 100 52.451 54.428 -1.977 1
1 971 . 16 1 1 A 100 100 ALA CB C 100 16.259 18.281 -2.022 1
1 972 . 16 1 1 A 100 100 ALA N N 100 122.398 121.392 1.006 1
1 973 . 16 1 1 A 101 101 ILE H H 101 8.777 7.766 1.011 1
1 974 . 16 1 1 A 101 101 ILE HA H 101 3.191 3.749 -0.558 1
1 984 . 16 1 1 A 101 101 ILE CA C 101 62.910 65.009 -2.099 1
1 985 . 16 1 1 A 101 101 ILE CB C 101 34.544 37.048 -2.504 1
1 989 . 16 1 1 A 101 101 ILE N N 101 120.431 118.578 1.853 1
1 990 . 16 1 1 A 102 102 GLU H H 102 7.890 7.769 0.121 1
1 991 . 16 1 1 A 102 102 GLU HA H 102 3.848 4.223 -0.375 1
1 996 . 16 1 1 A 102 102 GLU CA C 102 57.079 57.878 -0.799 1
1 997 . 16 1 1 A 102 102 GLU CB C 102 26.769 29.647 -2.878 1
1 999 . 16 1 1 A 102 102 GLU N N 102 120.248 121.578 -1.330 1
1 1000 . 16 1 1 A 103 103 LEU H H 103 8.194 7.705 0.489 1
1 1001 . 16 1 1 A 103 103 LEU HA H 103 3.912 4.274 -0.362 1
1 1011 . 16 1 1 A 103 103 LEU CA C 103 55.078 57.066 -1.988 1
1 1012 . 16 1 1 A 103 103 LEU CB C 103 38.963 42.232 -3.269 1
1 1016 . 16 1 1 A 103 103 LEU N N 103 120.341 119.812 0.529 1
1 1017 . 16 1 1 A 104 104 SER H H 104 8.268 7.657 0.611 1
1 1018 . 16 1 1 A 104 104 SER HA H 104 4.120 4.471 -0.351 1
1 1021 . 16 1 1 A 104 104 SER CA C 104 58.301 59.611 -1.310 1
1 1022 . 16 1 1 A 104 104 SER CB C 104 60.193 63.891 -3.698 1
1 1023 . 16 1 1 A 104 104 SER N N 104 115.150 112.581 2.569 1
1 1024 . 16 1 1 A 105 105 LEU H H 105 7.501 7.425 0.076 1
1 1025 . 16 1 1 A 105 105 LEU HA H 105 4.041 4.161 -0.120 1
1 1035 . 16 1 1 A 105 105 LEU CA C 105 53.995 56.812 -2.817 1
1 1036 . 16 1 1 A 105 105 LEU CB C 105 39.597 42.596 -2.999 1
1 1040 . 16 1 1 A 105 105 LEU N N 105 124.223 123.064 1.159 1
1 1041 . 16 1 1 A 106 106 LYS H H 106 7.542 8.268 -0.726 1
1 1042 . 16 1 1 A 106 106 LYS HA H 106 4.090 3.997 0.093 1
1 1050 . 16 1 1 A 106 106 LYS CA C 106 55.495 58.802 -3.307 1
1 1051 . 16 1 1 A 106 106 LYS CB C 106 29.941 31.665 -1.724 1
1 1055 . 16 1 1 A 106 106 LYS N N 106 120.328 118.375 1.953 1
1 1056 . 16 1 1 A 107 107 GLU H H 107 7.884 8.497 -0.613 1
1 1057 . 16 1 1 A 107 107 GLU HA H 107 4.210 3.992 0.218 1
1 1060 . 16 1 1 A 107 107 GLU CA C 107 54.509 59.379 -4.870 1
1 1061 . 16 1 1 A 107 107 GLU CB C 107 27.239 29.399 -2.160 1
1 1062 . 16 1 1 A 107 107 GLU N N 107 118.621 119.795 -1.174 1
1 1063 . 16 1 1 A 108 108 SER H H 108 7.923 7.627 0.296 1
1 1064 . 16 1 1 A 108 108 SER HA H 108 4.385 4.221 0.164 1
1 1067 . 16 1 1 A 108 108 SER CA C 108 56.442 61.240 -4.798 1
1 1068 . 16 1 1 A 108 108 SER CB C 108 60.953 62.779 -1.826 1
1 1069 . 16 1 1 A 108 108 SER N N 108 115.670 115.676 -0.006 1
1 1070 . 16 1 1 A 109 109 ARG H H 109 8.068 7.371 0.697 1
1 1071 . 16 1 1 A 109 109 ARG HA H 109 4.307 4.088 0.219 1
1 1078 . 16 1 1 A 109 109 ARG CA C 109 53.732 58.988 -5.256 1
1 1079 . 16 1 1 A 109 109 ARG CB C 109 27.968 29.726 -1.758 1
1 1082 . 16 1 1 A 109 109 ARG N N 109 122.313 121.936 0.377 1
1 1083 . 16 1 1 A 110 110 ASN H H 110 8.292 8.938 -0.646 1
1 1084 . 16 1 1 A 110 110 ASN HA H 110 4.720 4.459 0.261 1
1 1087 . 16 1 1 A 110 110 ASN CA C 110 50.750 56.723 -5.973 1
1 1088 . 16 1 1 A 110 110 ASN CB C 110 36.197 39.572 -3.375 1
1 1089 . 16 1 1 A 110 110 ASN N N 110 119.304 118.348 0.956 1
1 1090 . 16 1 1 A 111 111 SER H H 111 8.244 7.932 0.312 1
1 1091 . 16 1 1 A 111 111 SER HA H 111 4.423 4.428 -0.005 1
1 1094 . 16 1 1 A 111 111 SER CA C 111 55.990 60.554 -4.564 1
1 1095 . 16 1 1 A 111 111 SER CB C 111 61.027 63.099 -2.072 1
1 1096 . 16 1 1 A 111 111 SER N N 111 116.119 115.527 0.592 1
1 1097 . 16 1 1 A 112 112 GLY H H 112 8.327 8.127 0.200 1
1 1098 . 16 1 1 A 112 112 GLY HA2 H 112 3.944 3.823 0.121 1
1 1099 . 16 1 1 A 112 112 GLY HA3 H 112 3.912 3.824 0.088 1
1 1100 . 16 1 1 A 112 112 GLY CA C 112 42.733 47.223 -4.490 1
1 1101 . 16 1 1 A 112 112 GLY N N 112 110.442 110.556 -0.114 1
1 1102 . 16 1 1 A 113 113 GLY H H 113 8.097 8.037 0.060 1
1 1103 . 16 1 1 A 113 113 GLY HA2 H 113 3.831 3.752 0.079 1
1 1104 . 16 1 1 A 113 113 GLY HA3 H 113 3.785 3.776 0.009 1
1 1105 . 16 1 1 A 113 113 GLY CA C 113 42.435 47.202 -4.767 1
1 1106 . 16 1 1 A 113 113 GLY N N 113 108.745 109.508 -0.763 1
1 2 . 17 1 1 A 3 3 HIS CB C 3 33.709 34.675 -0.966 1
1 3 . 17 1 1 A 7 7 HIS H H 7 8.731 8.865 -0.134 1
1 4 . 17 1 1 A 7 7 HIS HA H 7 4.564 4.759 -0.195 1
1 7 . 17 1 1 A 7 7 HIS CA C 7 53.649 55.011 -1.362 1
1 8 . 17 1 1 A 7 7 HIS CB C 7 26.268 29.303 -3.035 1
1 9 . 17 1 1 A 7 7 HIS N N 7 121.126 125.962 -4.836 1
1 10 . 17 1 1 A 8 8 GLY H H 8 8.540 8.474 0.066 1
1 11 . 17 1 1 A 8 8 GLY HA2 H 8 3.973 3.712 0.261 1
1 12 . 17 1 1 A 8 8 GLY HA3 H 8 3.811 3.729 0.082 1
1 13 . 17 1 1 A 8 8 GLY CA C 8 42.618 47.381 -4.763 1
1 14 . 17 1 1 A 8 8 GLY N N 8 110.662 113.019 -2.357 1
1 15 . 17 1 1 A 9 9 GLU H H 9 8.239 8.421 -0.182 1
1 16 . 17 1 1 A 9 9 GLU HA H 9 4.568 4.646 -0.078 1
1 18 . 17 1 1 A 9 9 GLU CA C 9 53.605 55.884 -2.279 1
1 19 . 17 1 1 A 9 9 GLU CB C 9 28.019 29.899 -1.880 1
1 20 . 17 1 1 A 9 9 GLU N N 9 121.669 120.987 0.682 1
1 21 . 17 1 1 A 10 10 PHE H H 10 8.785 7.855 0.930 1
1 22 . 17 1 1 A 10 10 PHE HA H 10 4.850 5.046 -0.196 1
1 25 . 17 1 1 A 10 10 PHE CA C 10 52.630 56.852 -4.222 1
1 26 . 17 1 1 A 10 10 PHE CB C 10 37.906 42.380 -4.474 1
1 27 . 17 1 1 A 10 10 PHE N N 10 118.401 118.818 -0.417 1
1 28 . 17 1 1 A 11 11 GLN H H 11 8.552 8.710 -0.158 1
1 29 . 17 1 1 A 11 11 GLN HA H 11 5.425 4.556 0.869 1
1 34 . 17 1 1 A 11 11 GLN CA C 11 51.663 56.318 -4.655 1
1 35 . 17 1 1 A 11 11 GLN CB C 11 28.427 28.991 -0.564 1
1 37 . 17 1 1 A 11 11 GLN N N 11 117.519 121.579 -4.060 1
1 38 . 17 1 1 A 12 12 ILE H H 12 8.239 7.989 0.250 1
1 39 . 17 1 1 A 12 12 ILE HA H 12 4.103 4.716 -0.613 1
1 49 . 17 1 1 A 12 12 ILE CA C 12 57.134 59.737 -2.603 1
1 50 . 17 1 1 A 12 12 ILE CB C 12 39.491 39.657 -0.166 1
1 54 . 17 1 1 A 12 12 ILE N N 12 114.043 121.412 -7.369 1
1 55 . 17 1 1 A 13 13 PHE H H 13 8.538 8.622 -0.084 1
1 56 . 17 1 1 A 13 13 PHE HA H 13 5.620 5.273 0.347 1
1 59 . 17 1 1 A 13 13 PHE CA C 13 52.438 56.335 -3.897 1
1 60 . 17 1 1 A 13 13 PHE CB C 13 39.253 41.995 -2.742 1
1 61 . 17 1 1 A 13 13 PHE N N 13 117.015 119.686 -2.671 1
1 62 . 17 1 1 A 14 14 ALA H H 14 9.238 9.720 -0.482 1
1 63 . 17 1 1 A 14 14 ALA HA H 14 5.311 5.629 -0.318 1
1 67 . 17 1 1 A 14 14 ALA CA C 14 47.183 49.947 -2.764 1
1 68 . 17 1 1 A 14 14 ALA CB C 14 17.811 21.831 -4.020 1
1 69 . 17 1 1 A 14 14 ALA N N 14 123.503 126.161 -2.658 1
1 70 . 17 1 1 A 15 15 LYS H H 15 8.810 9.410 -0.600 1
1 71 . 17 1 1 A 15 15 LYS HA H 15 5.511 5.327 0.184 1
1 80 . 17 1 1 A 15 15 LYS CA C 15 51.718 54.296 -2.578 1
1 81 . 17 1 1 A 15 15 LYS CB C 15 33.635 34.869 -1.234 1
1 85 . 17 1 1 A 15 15 LYS N N 15 123.382 123.105 0.277 1
1 86 . 17 1 1 A 16 16 THR H H 16 8.830 8.543 0.287 1
1 87 . 17 1 1 A 16 16 THR HA H 16 5.212 4.906 0.306 1
1 92 . 17 1 1 A 16 16 THR CA C 16 57.614 60.883 -3.269 1
1 93 . 17 1 1 A 16 16 THR CB C 16 68.210 71.057 -2.847 1
1 95 . 17 1 1 A 16 16 THR N N 16 116.517 116.191 0.326 1
1 96 . 17 1 1 A 17 17 LEU H H 17 9.428 8.837 0.591 1
1 97 . 17 1 1 A 17 17 LEU HA H 17 4.286 4.419 -0.133 1
1 107 . 17 1 1 A 17 17 LEU CA C 17 54.504 57.721 -3.217 1
1 108 . 17 1 1 A 17 17 LEU CB C 17 38.564 41.804 -3.240 1
1 112 . 17 1 1 A 17 17 LEU N N 17 121.786 123.372 -1.586 1
1 113 . 17 1 1 A 18 18 THR H H 18 7.546 7.807 -0.261 1
1 114 . 17 1 1 A 18 18 THR HA H 18 4.391 4.334 0.057 1
1 119 . 17 1 1 A 18 18 THR CA C 18 58.524 62.898 -4.374 1
1 120 . 17 1 1 A 18 18 THR CB C 18 66.166 70.536 -4.370 1
1 122 . 17 1 1 A 18 18 THR N N 18 105.598 107.610 -2.012 1
1 123 . 17 1 1 A 19 19 GLY H H 19 7.683 7.928 -0.245 1
1 124 . 17 1 1 A 19 19 GLY HA2 H 19 3.300 3.961 -0.661 1
1 125 . 17 1 1 A 19 19 GLY HA3 H 19 4.248 3.976 0.272 1
1 126 . 17 1 1 A 19 19 GLY CA C 19 42.947 45.950 -3.003 1
1 127 . 17 1 1 A 19 19 GLY N N 19 109.243 112.097 -2.854 1
1 128 . 17 1 1 A 20 20 LYS H H 20 7.375 7.499 -0.124 1
1 129 . 17 1 1 A 20 20 LYS HA H 20 4.331 4.689 -0.358 1
1 138 . 17 1 1 A 20 20 LYS CA C 20 53.829 54.991 -1.162 1
1 139 . 17 1 1 A 20 20 LYS CB C 20 30.385 34.378 -3.993 1
1 143 . 17 1 1 A 20 20 LYS N N 20 122.757 120.623 2.134 1
1 144 . 17 1 1 A 21 21 THR H H 21 8.637 8.808 -0.171 1
1 145 . 17 1 1 A 21 21 THR HA H 21 4.852 4.625 0.227 1
1 150 . 17 1 1 A 21 21 THR CA C 21 59.846 62.503 -2.657 1
1 151 . 17 1 1 A 21 21 THR CB C 21 67.140 69.286 -2.146 1
1 153 . 17 1 1 A 21 21 THR N N 21 121.524 123.469 -1.945 1
1 154 . 17 1 1 A 22 22 ILE H H 22 9.509 9.122 0.387 1
1 155 . 17 1 1 A 22 22 ILE HA H 22 4.349 4.851 -0.502 1
1 165 . 17 1 1 A 22 22 ILE CA C 22 57.634 60.236 -2.602 1
1 166 . 17 1 1 A 22 22 ILE CB C 22 38.334 41.950 -3.616 1
1 170 . 17 1 1 A 22 22 ILE N N 22 129.772 127.510 2.262 1
1 171 . 17 1 1 A 23 23 THR H H 23 8.838 8.780 0.058 1
1 172 . 17 1 1 A 23 23 THR HA H 23 4.653 4.728 -0.075 1
1 177 . 17 1 1 A 23 23 THR CA C 23 60.194 61.780 -1.586 1
1 178 . 17 1 1 A 23 23 THR CB C 23 66.577 69.888 -3.311 1
1 180 . 17 1 1 A 23 23 THR N N 23 124.070 124.013 0.057 1
1 181 . 17 1 1 A 24 24 LEU H H 24 8.749 8.542 0.207 1
1 182 . 17 1 1 A 24 24 LEU HA H 24 4.619 5.070 -0.451 1
1 192 . 17 1 1 A 24 24 LEU CA C 24 50.257 52.755 -2.498 1
1 193 . 17 1 1 A 24 24 LEU CB C 24 42.932 45.668 -2.736 1
1 197 . 17 1 1 A 24 24 LEU N N 24 126.499 123.442 3.057 1
1 198 . 17 1 1 A 25 25 GLU H H 25 7.990 8.722 -0.732 1
1 199 . 17 1 1 A 25 25 GLU HA H 25 4.591 4.521 0.070 1
1 204 . 17 1 1 A 25 25 GLU CA C 25 52.845 55.955 -3.110 1
1 205 . 17 1 1 A 25 25 GLU CB C 25 27.210 29.993 -2.783 1
1 207 . 17 1 1 A 25 25 GLU N N 25 121.644 120.763 0.881 1
1 208 . 17 1 1 A 26 26 VAL H H 26 8.657 8.668 -0.011 1
1 209 . 17 1 1 A 26 26 VAL HA H 26 4.403 4.824 -0.421 1
1 217 . 17 1 1 A 26 26 VAL CA C 26 56.020 58.758 -2.738 1
1 218 . 17 1 1 A 26 26 VAL CB C 26 33.631 35.388 -1.757 1
1 221 . 17 1 1 A 26 26 VAL N N 26 116.647 120.897 -4.250 1
1 222 . 17 1 1 A 27 27 GLU H H 27 7.970 9.077 -1.107 1
1 223 . 17 1 1 A 27 27 GLU HA H 27 4.447 4.361 0.086 1
1 228 . 17 1 1 A 27 27 GLU CA C 27 51.386 56.397 -5.011 1
1 229 . 17 1 1 A 27 27 GLU CB C 27 30.905 30.891 0.014 1
1 231 . 17 1 1 A 27 27 GLU N N 27 115.496 123.446 -7.950 1
1 232 . 17 1 1 A 28 28 SER H H 28 9.192 8.788 0.404 1
1 233 . 17 1 1 A 28 28 SER HA H 28 4.108 4.186 -0.078 1
1 236 . 17 1 1 A 28 28 SER CA C 28 59.909 60.684 -0.775 1
1 237 . 17 1 1 A 28 28 SER CB C 28 60.399 63.078 -2.679 1
1 238 . 17 1 1 A 28 28 SER N N 28 117.720 118.520 -0.800 1
1 239 . 17 1 1 A 29 29 SER H H 29 7.371 7.818 -0.447 1
1 240 . 17 1 1 A 29 29 SER HA H 29 4.327 4.573 -0.246 1
1 243 . 17 1 1 A 29 29 SER CA C 29 54.805 57.357 -2.552 1
1 244 . 17 1 1 A 29 29 SER CB C 29 60.775 63.851 -3.076 1
1 245 . 17 1 1 A 29 29 SER N N 29 108.936 115.769 -6.833 1
1 246 . 17 1 1 A 30 30 ASP H H 30 7.852 7.808 0.044 1
1 247 . 17 1 1 A 30 30 ASP HA H 30 4.591 4.519 0.072 1
1 250 . 17 1 1 A 30 30 ASP CA C 30 53.040 54.749 -1.709 1
1 251 . 17 1 1 A 30 30 ASP CB C 30 37.942 41.365 -3.423 1
1 252 . 17 1 1 A 30 30 ASP N N 30 123.735 121.780 1.955 1
1 253 . 17 1 1 A 31 31 THR H H 31 7.852 8.400 -0.548 1
1 254 . 17 1 1 A 31 31 THR HA H 31 4.918 4.917 0.001 1
1 259 . 17 1 1 A 31 31 THR CA C 31 56.929 60.006 -3.077 1
1 260 . 17 1 1 A 31 31 THR CB C 31 68.674 71.546 -2.872 1
1 262 . 17 1 1 A 31 31 THR N N 31 109.181 113.020 -3.839 1
1 263 . 17 1 1 A 32 32 ILE H H 32 8.582 8.986 -0.404 1
1 264 . 17 1 1 A 32 32 ILE HA H 32 3.624 3.800 -0.176 1
1 274 . 17 1 1 A 32 32 ILE CA C 32 59.474 65.578 -6.104 1
1 275 . 17 1 1 A 32 32 ILE CB C 32 31.561 37.622 -6.061 1
1 279 . 17 1 1 A 32 32 ILE N N 32 121.833 122.809 -0.976 1
1 280 . 17 1 1 A 33 33 ASP H H 33 9.255 7.657 1.598 1
1 281 . 17 1 1 A 33 33 ASP HA H 33 4.201 4.297 -0.096 1
1 284 . 17 1 1 A 33 33 ASP CA C 33 54.679 58.039 -3.360 1
1 285 . 17 1 1 A 33 33 ASP CB C 33 37.700 41.922 -4.222 1
1 286 . 17 1 1 A 33 33 ASP N N 33 119.823 120.543 -0.720 1
1 287 . 17 1 1 A 34 34 ASN H H 34 8.026 7.655 0.371 1
1 288 . 17 1 1 A 34 34 ASN HA H 34 4.409 4.630 -0.221 1
1 291 . 17 1 1 A 34 34 ASN CA C 34 53.324 56.755 -3.431 1
1 292 . 17 1 1 A 34 34 ASN CB C 34 35.782 38.301 -2.519 1
1 293 . 17 1 1 A 34 34 ASN N N 34 119.540 117.240 2.300 1
1 294 . 17 1 1 A 35 35 VAL H H 35 8.167 8.363 -0.196 1
1 295 . 17 1 1 A 35 35 VAL HA H 35 3.249 3.427 -0.178 1
1 303 . 17 1 1 A 35 35 VAL CA C 35 65.308 67.345 -2.037 1
1 304 . 17 1 1 A 35 35 VAL CB C 35 27.965 31.361 -3.396 1
1 307 . 17 1 1 A 35 35 VAL N N 35 122.223 120.804 1.419 1
1 308 . 17 1 1 A 36 36 LYS H H 36 8.460 8.444 0.016 1
1 313 . 17 1 1 A 36 36 LYS CB C 36 30.753 32.305 -1.552 1
1 315 . 17 1 1 A 36 36 LYS N N 36 119.438 119.334 0.104 1
1 316 . 17 1 1 A 37 37 SER H H 37 8.196 8.757 -0.561 1
1 317 . 17 1 1 A 37 37 SER HA H 37 4.130 4.177 -0.047 1
1 320 . 17 1 1 A 37 37 SER CA C 37 58.528 61.236 -2.708 1
1 321 . 17 1 1 A 37 37 SER CB C 37 59.768 62.659 -2.891 1
1 322 . 17 1 1 A 37 37 SER N N 37 117.791 114.328 3.463 1
1 323 . 17 1 1 A 38 38 LYS H H 38 8.043 8.252 -0.209 1
1 324 . 17 1 1 A 38 38 LYS HA H 38 4.095 3.996 0.099 1
1 325 . 17 1 1 A 38 38 LYS CA C 38 57.377 59.191 -1.814 1
1 326 . 17 1 1 A 38 38 LYS N N 38 124.094 120.891 3.203 1
1 327 . 17 1 1 A 39 39 ILE H H 39 8.254 8.074 0.180 1
1 328 . 17 1 1 A 39 39 ILE HA H 39 3.439 3.764 -0.325 1
1 338 . 17 1 1 A 39 39 ILE CA C 39 63.977 64.216 -0.239 1
1 339 . 17 1 1 A 39 39 ILE CB C 39 33.935 37.238 -3.303 1
1 343 . 17 1 1 A 39 39 ILE N N 39 122.107 119.128 2.979 1
1 344 . 17 1 1 A 40 40 GLN H H 40 8.379 8.250 0.129 1
1 345 . 17 1 1 A 40 40 GLN HA H 40 3.746 4.209 -0.463 1
1 350 . 17 1 1 A 40 40 GLN CA C 40 57.472 58.003 -0.531 1
1 351 . 17 1 1 A 40 40 GLN CB C 40 25.072 28.195 -3.123 1
1 353 . 17 1 1 A 40 40 GLN N N 40 123.725 120.013 3.712 1
1 354 . 17 1 1 A 41 41 ASP H H 41 8.210 7.736 0.474 1
1 355 . 17 1 1 A 41 41 ASP HA H 41 4.247 4.379 -0.132 1
1 358 . 17 1 1 A 41 41 ASP CA C 41 54.646 56.576 -1.930 1
1 359 . 17 1 1 A 41 41 ASP CB C 41 38.136 40.714 -2.578 1
1 360 . 17 1 1 A 41 41 ASP N N 41 120.564 120.432 0.132 1
1 361 . 17 1 1 A 42 42 LYS H H 42 7.381 7.875 -0.494 1
1 362 . 17 1 1 A 42 42 LYS HA H 42 4.246 4.131 0.115 1
1 369 . 17 1 1 A 42 42 LYS CA C 42 55.579 58.441 -2.862 1
1 370 . 17 1 1 A 42 42 LYS CB C 42 31.406 33.237 -1.831 1
1 373 . 17 1 1 A 42 42 LYS N N 42 115.674 119.459 -3.785 1
1 374 . 17 1 1 A 43 43 GLU H H 43 8.537 9.141 -0.604 1
1 375 . 17 1 1 A 43 43 GLU HA H 43 4.522 4.556 -0.034 1
1 380 . 17 1 1 A 43 43 GLU CA C 43 52.772 55.558 -2.786 1
1 381 . 17 1 1 A 43 43 GLU CB C 43 30.535 30.898 -0.363 1
1 383 . 17 1 1 A 43 43 GLU N N 43 114.355 115.547 -1.192 1
1 384 . 17 1 1 A 44 44 GLY H H 44 8.611 8.197 0.414 1
1 385 . 17 1 1 A 44 44 GLY HA2 H 44 4.067 3.968 0.099 1
1 386 . 17 1 1 A 44 44 GLY HA3 H 44 3.819 3.969 -0.150 1
1 387 . 17 1 1 A 44 44 GLY CA C 44 43.205 45.381 -2.176 1
1 388 . 17 1 1 A 44 44 GLY N N 44 109.406 108.245 1.161 1
1 389 . 17 1 1 A 45 45 ILE H H 45 6.092 8.050 -1.958 1
1 390 . 17 1 1 A 45 45 ILE HA H 45 4.324 4.128 0.196 1
1 400 . 17 1 1 A 45 45 ILE CA C 45 55.211 60.175 -4.964 1
1 401 . 17 1 1 A 45 45 ILE CB C 45 37.903 38.187 -0.284 1
1 405 . 17 1 1 A 45 45 ILE N N 45 120.791 122.486 -1.695 1
1 406 . 17 1 1 A 46 46 PRO HA H 46 4.547 4.659 -0.112 1
1 413 . 17 1 1 A 46 46 PRO CA C 46 58.971 61.985 -3.014 1
1 414 . 17 1 1 A 46 46 PRO CB C 46 29.142 32.294 -3.152 1
1 417 . 17 1 1 A 47 47 PRO HA H 47 4.062 4.374 -0.312 1
1 424 . 17 1 1 A 47 47 PRO CA C 47 63.476 65.817 -2.341 1
1 425 . 17 1 1 A 47 47 PRO CB C 47 30.113 31.982 -1.869 1
1 428 . 17 1 1 A 48 48 ASP H H 48 8.418 8.397 0.021 1
1 429 . 17 1 1 A 48 48 ASP HA H 48 4.346 4.356 -0.010 1
1 432 . 17 1 1 A 48 48 ASP CA C 48 52.838 56.972 -4.134 1
1 433 . 17 1 1 A 48 48 ASP CB C 48 36.926 40.142 -3.216 1
1 434 . 17 1 1 A 48 48 ASP N N 48 113.462 117.089 -3.627 1
1 435 . 17 1 1 A 49 49 GLN H H 49 7.822 7.563 0.259 1
1 436 . 17 1 1 A 49 49 GLN HA H 49 4.283 4.108 0.175 1
1 439 . 17 1 1 A 49 49 GLN CA C 49 52.770 57.930 -5.160 1
1 441 . 17 1 1 A 49 49 GLN N N 49 117.377 117.967 -0.590 1
1 442 . 17 1 1 A 50 50 GLN H H 50 7.451 7.765 -0.314 1
1 443 . 17 1 1 A 50 50 GLN HA H 50 4.260 4.959 -0.699 1
1 448 . 17 1 1 A 50 50 GLN CA C 50 53.725 53.736 -0.011 1
1 449 . 17 1 1 A 50 50 GLN CB C 50 29.142 31.802 -2.660 1
1 451 . 17 1 1 A 50 50 GLN N N 50 117.526 115.589 1.937 1
1 452 . 17 1 1 A 51 51 ARG H H 51 8.534 8.832 -0.298 1
1 453 . 17 1 1 A 51 51 ARG HA H 51 4.486 5.152 -0.666 1
1 460 . 17 1 1 A 51 51 ARG CA C 51 52.492 54.468 -1.976 1
1 461 . 17 1 1 A 51 51 ARG CB C 51 29.096 34.366 -5.270 1
1 464 . 17 1 1 A 51 51 ARG N N 51 121.655 119.234 2.421 1
1 465 . 17 1 1 A 52 52 LEU H H 52 8.683 8.743 -0.060 1
1 466 . 17 1 1 A 52 52 LEU HA H 52 5.255 5.075 0.180 1
1 476 . 17 1 1 A 52 52 LEU CA C 52 50.618 53.575 -2.957 1
1 477 . 17 1 1 A 52 52 LEU CB C 52 43.007 43.418 -0.411 1
1 481 . 17 1 1 A 52 52 LEU N N 52 122.929 121.050 1.879 1
1 482 . 17 1 1 A 53 53 ILE H H 53 9.286 9.094 0.192 1
1 483 . 17 1 1 A 53 53 ILE HA H 53 5.096 4.888 0.208 1
1 492 . 17 1 1 A 53 53 ILE CA C 53 56.795 60.590 -3.795 1
1 496 . 17 1 1 A 53 53 ILE N N 53 124.718 125.221 -0.503 1
1 497 . 17 1 1 A 54 54 TRP H H 54 8.871 9.036 -0.165 1
1 499 . 17 1 1 A 54 54 TRP N N 54 127.412 128.565 -1.153 1
1 501 . 17 1 1 A 55 55 ALA H H 55 8.401 8.352 0.049 1
1 502 . 17 1 1 A 55 55 ALA HA H 55 3.183 3.370 -0.187 1
1 506 . 17 1 1 A 55 55 ALA CA C 55 49.712 52.661 -2.949 1
1 507 . 17 1 1 A 55 55 ALA CB C 55 13.252 17.174 -3.922 1
1 508 . 17 1 1 A 55 55 ALA N N 55 128.894 130.064 -1.170 1
1 509 . 17 1 1 A 56 56 GLY H H 56 8.248 8.409 -0.161 1
1 510 . 17 1 1 A 56 56 GLY HA2 H 56 3.968 3.741 0.227 1
1 511 . 17 1 1 A 56 56 GLY HA3 H 56 3.916 3.752 0.164 1
1 512 . 17 1 1 A 56 56 GLY CA C 56 43.142 45.592 -2.450 1
1 513 . 17 1 1 A 56 56 GLY N N 56 101.499 102.494 -0.995 1
1 514 . 17 1 1 A 57 57 LYS H H 57 8.028 7.607 0.421 1
1 515 . 17 1 1 A 57 57 LYS HA H 57 4.609 4.687 -0.078 1
1 522 . 17 1 1 A 57 57 LYS CA C 57 51.928 54.380 -2.452 1
1 523 . 17 1 1 A 57 57 LYS CB C 57 32.613 35.089 -2.476 1
1 526 . 17 1 1 A 57 57 LYS N N 57 118.995 120.673 -1.678 1
1 527 . 17 1 1 A 58 58 GLN H H 58 8.607 8.560 0.047 1
1 528 . 17 1 1 A 58 58 GLN HA H 58 4.617 4.681 -0.064 1
1 533 . 17 1 1 A 58 58 GLN CA C 58 53.261 56.125 -2.864 1
1 534 . 17 1 1 A 58 58 GLN CB C 58 26.613 29.513 -2.900 1
1 536 . 17 1 1 A 58 58 GLN N N 58 119.825 124.244 -4.419 1
1 537 . 17 1 1 A 59 59 LEU H H 59 8.653 9.374 -0.721 1
1 538 . 17 1 1 A 59 59 LEU HA H 59 4.138 4.590 -0.452 1
1 548 . 17 1 1 A 59 59 LEU CA C 59 51.991 54.041 -2.050 1
1 549 . 17 1 1 A 59 59 LEU CB C 59 39.006 42.788 -3.782 1
1 553 . 17 1 1 A 59 59 LEU N N 59 125.484 126.889 -1.405 1
1 554 . 17 1 1 A 60 60 GLU H H 60 8.461 8.506 -0.045 1
1 555 . 17 1 1 A 60 60 GLU HA H 60 4.371 4.686 -0.315 1
1 559 . 17 1 1 A 60 60 GLU CA C 60 53.436 55.205 -1.769 1
1 560 . 17 1 1 A 60 60 GLU CB C 60 29.057 31.035 -1.978 1
1 562 . 17 1 1 A 60 60 GLU N N 60 123.237 121.158 2.079 1
1 563 . 17 1 1 A 61 61 ASP H H 61 8.076 8.939 -0.863 1
1 564 . 17 1 1 A 61 61 ASP HA H 61 4.265 4.380 -0.115 1
1 567 . 17 1 1 A 61 61 ASP CA C 61 54.398 56.204 -1.806 1
1 568 . 17 1 1 A 61 61 ASP CB C 61 38.340 39.921 -1.581 1
1 569 . 17 1 1 A 61 61 ASP N N 61 120.701 122.353 -1.652 1
1 570 . 17 1 1 A 62 62 GLY HA2 H 62 4.104 3.977 0.127 1
1 571 . 17 1 1 A 62 62 GLY HA3 H 62 3.832 3.980 -0.148 1
1 572 . 17 1 1 A 62 62 GLY CA C 62 42.576 45.257 -2.681 1
1 573 . 17 1 1 A 63 63 ARG H H 63 7.319 8.398 -1.079 1
1 574 . 17 1 1 A 63 63 ARG HA H 63 4.595 4.378 0.217 1
1 579 . 17 1 1 A 63 63 ARG CA C 63 51.971 56.342 -4.371 1
1 582 . 17 1 1 A 63 63 ARG N N 63 119.206 120.810 -1.604 1
1 583 . 17 1 1 A 64 64 THR H H 64 8.735 8.517 0.218 1
1 584 . 17 1 1 A 64 64 THR HA H 64 5.208 4.964 0.244 1
1 589 . 17 1 1 A 64 64 THR CA C 64 57.126 59.586 -2.460 1
1 590 . 17 1 1 A 64 64 THR CB C 64 69.885 71.760 -1.875 1
1 592 . 17 1 1 A 64 64 THR N N 64 108.713 113.511 -4.798 1
1 593 . 17 1 1 A 65 65 LEU H H 65 8.241 9.188 -0.947 1
1 594 . 17 1 1 A 65 65 LEU HA H 65 4.003 3.972 0.031 1
1 604 . 17 1 1 A 65 65 LEU CA C 65 56.409 57.444 -1.035 1
1 605 . 17 1 1 A 65 65 LEU CB C 65 37.179 41.634 -4.455 1
1 609 . 17 1 1 A 65 65 LEU N N 65 118.111 122.459 -4.348 1
1 610 . 17 1 1 A 66 66 SER H H 66 8.296 8.245 0.051 1
1 611 . 17 1 1 A 66 66 SER HA H 66 4.201 4.270 -0.069 1
1 614 . 17 1 1 A 66 66 SER CA C 66 58.454 60.390 -1.936 1
1 615 . 17 1 1 A 66 66 SER CB C 66 59.969 62.707 -2.738 1
1 616 . 17 1 1 A 66 66 SER N N 66 113.148 113.318 -0.170 1
1 617 . 17 1 1 A 67 67 ASP H H 67 7.984 8.331 -0.347 1
1 618 . 17 1 1 A 67 67 ASP HA H 67 4.187 4.276 -0.089 1
1 621 . 17 1 1 A 67 67 ASP CA C 67 54.744 57.161 -2.417 1
1 622 . 17 1 1 A 67 67 ASP CB C 67 37.794 41.755 -3.961 1
1 623 . 17 1 1 A 67 67 ASP N N 67 124.130 123.552 0.578 1
1 624 . 17 1 1 A 68 68 TYR H H 68 7.177 7.660 -0.483 1
1 625 . 17 1 1 A 68 68 TYR N N 68 115.334 117.102 -1.768 1
1 626 . 17 1 1 A 69 69 ASN H H 69 8.111 8.161 -0.050 1
1 627 . 17 1 1 A 69 69 ASN HA H 69 4.253 4.360 -0.107 1
1 630 . 17 1 1 A 69 69 ASN CA C 69 51.386 54.563 -3.177 1
1 631 . 17 1 1 A 69 69 ASN CB C 69 34.867 37.022 -2.155 1
1 632 . 17 1 1 A 69 69 ASN N N 69 116.867 116.724 0.143 1
1 633 . 17 1 1 A 70 70 ILE H H 70 7.460 7.844 -0.384 1
1 634 . 17 1 1 A 70 70 ILE HA H 70 3.210 3.979 -0.769 1
1 644 . 17 1 1 A 70 70 ILE CA C 70 60.157 62.150 -1.993 1
1 645 . 17 1 1 A 70 70 ILE CB C 70 34.754 37.508 -2.754 1
1 649 . 17 1 1 A 70 70 ILE N N 70 119.821 120.120 -0.299 1
1 650 . 17 1 1 A 71 71 GLN H H 71 7.368 8.609 -1.241 1
1 651 . 17 1 1 A 71 71 GLN HA H 71 4.099 4.466 -0.367 1
1 656 . 17 1 1 A 71 71 GLN CA C 71 50.906 54.664 -3.758 1
1 657 . 17 1 1 A 71 71 GLN CB C 71 28.793 30.703 -1.910 1
1 659 . 17 1 1 A 71 71 GLN N N 71 124.287 128.049 -3.762 1
1 660 . 17 1 1 A 72 72 ARG H H 72 7.583 8.693 -1.110 1
1 661 . 17 1 1 A 72 72 ARG HA H 72 3.907 4.207 -0.300 1
1 668 . 17 1 1 A 72 72 ARG CA C 72 54.527 58.974 -4.447 1
1 669 . 17 1 1 A 72 72 ARG CB C 72 27.470 30.468 -2.998 1
1 672 . 17 1 1 A 72 72 ARG N N 72 119.007 120.878 -1.871 1
1 673 . 17 1 1 A 73 73 GLU H H 73 9.262 7.713 1.549 1
1 674 . 17 1 1 A 73 73 GLU HA H 73 3.586 4.581 -0.995 1
1 679 . 17 1 1 A 73 73 GLU CA C 73 55.703 56.268 -0.565 1
1 680 . 17 1 1 A 73 73 GLU CB C 73 23.669 28.264 -4.595 1
1 682 . 17 1 1 A 73 73 GLU N N 73 115.180 118.205 -3.025 1
1 683 . 17 1 1 A 74 74 SER H H 74 7.551 8.212 -0.661 1
1 684 . 17 1 1 A 74 74 SER HA H 74 4.613 5.180 -0.567 1
1 687 . 17 1 1 A 74 74 SER CA C 74 58.305 56.196 2.109 1
1 688 . 17 1 1 A 74 74 SER CB C 74 62.156 64.853 -2.697 1
1 689 . 17 1 1 A 74 74 SER N N 74 115.104 113.889 1.215 1
1 690 . 17 1 1 A 75 75 THR H H 75 8.785 8.777 0.008 1
1 691 . 17 1 1 A 75 75 THR HA H 75 5.014 4.747 0.267 1
1 696 . 17 1 1 A 75 75 THR CA C 75 59.835 62.339 -2.504 1
1 697 . 17 1 1 A 75 75 THR CB C 75 67.258 68.541 -1.283 1
1 699 . 17 1 1 A 75 75 THR N N 75 118.401 120.876 -2.475 1
1 700 . 17 1 1 A 76 76 LEU H H 76 9.447 9.496 -0.049 1
1 701 . 17 1 1 A 76 76 LEU HA H 76 4.930 4.494 0.436 1
1 711 . 17 1 1 A 76 76 LEU CA C 76 51.107 54.514 -3.407 1
1 712 . 17 1 1 A 76 76 LEU CB C 76 40.841 42.953 -2.112 1
1 716 . 17 1 1 A 76 76 LEU N N 76 127.905 128.154 -0.249 1
1 717 . 17 1 1 A 77 77 HIS HA H 77 4.976 5.497 -0.521 1
1 720 . 17 1 1 A 77 77 HIS CA C 77 53.776 53.858 -0.082 1
1 721 . 17 1 1 A 77 77 HIS CB C 77 28.438 32.049 -3.611 1
1 722 . 17 1 1 A 78 78 LEU H H 78 8.450 8.684 -0.234 1
1 723 . 17 1 1 A 78 78 LEU HA H 78 5.085 4.992 0.093 1
1 733 . 17 1 1 A 78 78 LEU CA C 78 50.896 53.864 -2.968 1
1 734 . 17 1 1 A 78 78 LEU CB C 78 41.916 44.986 -3.070 1
1 738 . 17 1 1 A 78 78 LEU N N 78 126.178 128.308 -2.130 1
1 739 . 17 1 1 A 79 79 VAL H H 79 9.093 9.222 -0.129 1
1 740 . 17 1 1 A 79 79 VAL HA H 79 4.053 4.793 -0.740 1
1 748 . 17 1 1 A 79 79 VAL CA C 79 59.054 61.364 -2.310 1
1 749 . 17 1 1 A 79 79 VAL CB C 79 32.115 33.160 -1.045 1
1 752 . 17 1 1 A 79 79 VAL N N 79 128.372 127.075 1.297 1
1 753 . 17 1 1 A 80 80 LEU H H 80 8.000 9.147 -1.147 1
1 754 . 17 1 1 A 80 80 LEU HA H 80 5.105 5.121 -0.016 1
1 764 . 17 1 1 A 80 80 LEU CA C 80 50.556 53.016 -2.460 1
1 765 . 17 1 1 A 80 80 LEU CB C 80 39.597 44.205 -4.608 1
1 769 . 17 1 1 A 80 80 LEU N N 80 126.145 126.935 -0.790 1
1 770 . 17 1 1 A 81 81 ARG H H 81 8.470 8.186 0.284 1
1 771 . 17 1 1 A 81 81 ARG HA H 81 4.197 4.629 -0.432 1
1 778 . 17 1 1 A 81 81 ARG CA C 81 53.133 56.472 -3.339 1
1 779 . 17 1 1 A 81 81 ARG CB C 81 28.413 30.798 -2.385 1
1 782 . 17 1 1 A 81 81 ARG N N 81 121.625 125.945 -4.320 1
1 783 . 17 1 1 A 82 82 LEU H H 82 8.454 8.542 -0.088 1
1 784 . 17 1 1 A 82 82 LEU HA H 82 4.339 4.348 -0.009 1
1 794 . 17 1 1 A 82 82 LEU CA C 82 52.081 53.841 -1.760 1
1 795 . 17 1 1 A 82 82 LEU CB C 82 39.810 40.736 -0.926 1
1 799 . 17 1 1 A 82 82 LEU N N 82 123.832 127.692 -3.860 1
1 800 . 17 1 1 A 83 83 ARG H H 83 8.404 8.658 -0.254 1
1 801 . 17 1 1 A 83 83 ARG HA H 83 4.308 4.191 0.117 1
1 808 . 17 1 1 A 83 83 ARG CA C 83 53.258 58.968 -5.710 1
1 809 . 17 1 1 A 83 83 ARG CB C 83 28.160 30.236 -2.076 1
1 812 . 17 1 1 A 83 83 ARG N N 83 121.447 127.406 -5.959 1
1 813 . 17 1 1 A 84 84 GLY H H 84 8.410 8.037 0.373 1
1 814 . 17 1 1 A 84 84 GLY HA2 H 84 3.929 4.065 -0.136 1
1 815 . 17 1 1 A 84 84 GLY HA3 H 84 3.929 4.066 -0.137 1
1 816 . 17 1 1 A 84 84 GLY CA C 84 42.751 45.162 -2.411 1
1 817 . 17 1 1 A 84 84 GLY N N 84 110.030 107.415 2.615 1
1 818 . 17 1 1 A 85 85 GLY H H 85 8.295 8.744 -0.449 1
1 819 . 17 1 1 A 85 85 GLY HA2 H 85 3.950 3.848 0.102 1
1 820 . 17 1 1 A 85 85 GLY HA3 H 85 3.950 3.848 0.102 1
1 821 . 17 1 1 A 85 85 GLY CA C 85 42.831 46.222 -3.391 1
1 822 . 17 1 1 A 85 85 GLY N N 85 108.838 108.863 -0.025 1
1 823 . 17 1 1 A 86 86 SER H H 86 8.292 7.941 0.351 1
1 824 . 17 1 1 A 86 86 SER HA H 86 4.405 4.454 -0.049 1
1 827 . 17 1 1 A 86 86 SER CA C 86 55.965 57.729 -1.764 1
1 828 . 17 1 1 A 86 86 SER CB C 86 61.232 62.317 -1.085 1
1 829 . 17 1 1 A 86 86 SER N N 86 116.028 113.794 2.234 1
1 830 . 17 1 1 A 87 87 MET H H 87 8.470 8.130 0.340 1
1 831 . 17 1 1 A 87 87 MET HA H 87 4.447 4.399 0.048 1
1 836 . 17 1 1 A 87 87 MET CA C 87 53.281 57.561 -4.280 1
1 837 . 17 1 1 A 87 87 MET CB C 87 29.788 32.034 -2.246 1
1 839 . 17 1 1 A 87 87 MET N N 87 121.625 125.614 -3.989 1
1 840 . 17 1 1 A 88 88 GLY H H 88 8.320 8.055 0.265 1
1 841 . 17 1 1 A 88 88 GLY HA2 H 88 3.919 3.785 0.134 1
1 842 . 17 1 1 A 88 88 GLY HA3 H 88 3.896 3.785 0.111 1
1 843 . 17 1 1 A 88 88 GLY CA C 88 43.060 46.958 -3.898 1
1 844 . 17 1 1 A 88 88 GLY N N 88 109.625 107.520 2.105 1
1 845 . 17 1 1 A 89 89 GLY H H 89 8.256 8.051 0.205 1
1 846 . 17 1 1 A 89 89 GLY HA2 H 89 3.940 4.250 -0.310 1
1 847 . 17 1 1 A 89 89 GLY HA3 H 89 3.910 4.250 -0.340 1
1 848 . 17 1 1 A 89 89 GLY CA C 89 42.678 45.833 -3.155 1
1 849 . 17 1 1 A 89 89 GLY N N 89 108.982 111.830 -2.848 1
1 850 . 17 1 1 A 90 90 ALA H H 90 8.203 8.746 -0.543 1
1 851 . 17 1 1 A 90 90 ALA HA H 90 4.255 4.088 0.167 1
1 855 . 17 1 1 A 90 90 ALA CA C 90 50.763 54.875 -4.112 1
1 856 . 17 1 1 A 90 90 ALA CB C 90 16.364 18.604 -2.240 1
1 857 . 17 1 1 A 90 90 ALA N N 90 124.065 123.031 1.034 1
1 858 . 17 1 1 A 91 91 ALA H H 91 8.273 7.820 0.453 1
1 859 . 17 1 1 A 91 91 ALA HA H 91 4.204 4.268 -0.064 1
1 863 . 17 1 1 A 91 91 ALA CA C 91 51.080 52.900 -1.820 1
1 864 . 17 1 1 A 91 91 ALA CB C 91 16.036 19.279 -3.243 1
1 865 . 17 1 1 A 91 91 ALA N N 91 121.985 120.293 1.692 1
1 866 . 17 1 1 A 92 92 ASP H H 92 8.022 8.746 -0.724 1
1 867 . 17 1 1 A 92 92 ASP HA H 92 4.455 4.952 -0.497 1
1 870 . 17 1 1 A 92 92 ASP CA C 92 52.664 53.064 -0.400 1
1 871 . 17 1 1 A 92 92 ASP CB C 92 37.925 41.902 -3.977 1
1 872 . 17 1 1 A 92 92 ASP N N 92 118.621 122.473 -3.852 1
1 873 . 17 1 1 A 93 93 GLU H H 93 8.282 8.189 0.093 1
1 874 . 17 1 1 A 93 93 GLU HA H 93 3.912 3.918 -0.006 1
1 879 . 17 1 1 A 93 93 GLU CA C 93 56.947 57.601 -0.654 1
1 880 . 17 1 1 A 93 93 GLU CB C 93 27.413 27.295 0.118 1
1 882 . 17 1 1 A 93 93 GLU N N 93 122.247 115.642 6.605 1
1 883 . 17 1 1 A 94 94 GLU H H 94 8.194 7.896 0.298 1
1 884 . 17 1 1 A 94 94 GLU HA H 94 3.940 4.491 -0.551 1
1 889 . 17 1 1 A 94 94 GLU CA C 94 56.681 57.624 -0.943 1
1 890 . 17 1 1 A 94 94 GLU CB C 94 26.127 30.820 -4.693 1
1 892 . 17 1 1 A 94 94 GLU N N 94 118.024 118.181 -0.157 1
1 893 . 17 1 1 A 95 95 GLU H H 95 7.816 8.614 -0.798 1
1 894 . 17 1 1 A 95 95 GLU HA H 95 4.121 4.107 0.014 1
1 898 . 17 1 1 A 95 95 GLU CA C 95 56.162 59.117 -2.955 1
1 899 . 17 1 1 A 95 95 GLU CB C 95 26.403 29.140 -2.737 1
1 901 . 17 1 1 A 95 95 GLU N N 95 120.028 119.779 0.249 1
1 902 . 17 1 1 A 96 96 LEU H H 96 7.637 8.106 -0.469 1
1 903 . 17 1 1 A 96 96 LEU HA H 96 3.988 4.057 -0.069 1
1 913 . 17 1 1 A 96 96 LEU CA C 96 55.303 58.023 -2.720 1
1 914 . 17 1 1 A 96 96 LEU CB C 96 39.038 41.541 -2.503 1
1 918 . 17 1 1 A 96 96 LEU N N 96 119.866 117.834 2.032 1
1 919 . 17 1 1 A 97 97 ILE H H 97 8.044 7.302 0.742 1
1 920 . 17 1 1 A 97 97 ILE HA H 97 3.478 3.977 -0.499 1
1 930 . 17 1 1 A 97 97 ILE CA C 97 62.054 63.781 -1.727 1
1 931 . 17 1 1 A 97 97 ILE CB C 97 34.541 37.970 -3.429 1
1 935 . 17 1 1 A 97 97 ILE N N 97 119.088 120.058 -0.970 1
1 936 . 17 1 1 A 98 98 ARG H H 98 7.991 8.254 -0.263 1
1 937 . 17 1 1 A 98 98 ARG HA H 98 3.793 4.067 -0.274 1
1 944 . 17 1 1 A 98 98 ARG CA C 98 57.509 58.930 -1.421 1
1 945 . 17 1 1 A 98 98 ARG CB C 98 27.191 30.194 -3.003 1
1 948 . 17 1 1 A 98 98 ARG N N 98 119.225 120.792 -1.567 1
1 949 . 17 1 1 A 99 99 LYS H H 99 8.101 7.980 0.121 1
1 950 . 17 1 1 A 99 99 LYS HA H 99 3.968 4.070 -0.102 1
1 959 . 17 1 1 A 99 99 LYS CA C 99 56.455 59.098 -2.643 1
1 960 . 17 1 1 A 99 99 LYS CB C 99 29.531 32.168 -2.637 1
1 964 . 17 1 1 A 99 99 LYS N N 99 119.464 118.336 1.128 1
1 965 . 17 1 1 A 100 100 ALA H H 100 8.167 8.256 -0.089 1
1 966 . 17 1 1 A 100 100 ALA HA H 100 3.789 3.979 -0.190 1
1 970 . 17 1 1 A 100 100 ALA CA C 100 52.451 55.190 -2.739 1
1 971 . 17 1 1 A 100 100 ALA CB C 100 16.259 18.604 -2.345 1
1 972 . 17 1 1 A 100 100 ALA N N 100 122.398 121.245 1.153 1
1 973 . 17 1 1 A 101 101 ILE H H 101 8.777 7.810 0.967 1
1 974 . 17 1 1 A 101 101 ILE HA H 101 3.191 3.441 -0.250 1
1 984 . 17 1 1 A 101 101 ILE CA C 101 62.910 65.344 -2.434 1
1 985 . 17 1 1 A 101 101 ILE CB C 101 34.544 37.965 -3.421 1
1 989 . 17 1 1 A 101 101 ILE N N 101 120.431 118.700 1.731 1
1 990 . 17 1 1 A 102 102 GLU H H 102 7.890 8.304 -0.414 1
1 991 . 17 1 1 A 102 102 GLU HA H 102 3.848 4.166 -0.318 1
1 996 . 17 1 1 A 102 102 GLU CA C 102 57.079 58.286 -1.207 1
1 997 . 17 1 1 A 102 102 GLU CB C 102 26.769 29.870 -3.101 1
1 999 . 17 1 1 A 102 102 GLU N N 102 120.248 117.746 2.502 1
1 1000 . 17 1 1 A 103 103 LEU H H 103 8.194 8.381 -0.187 1
1 1001 . 17 1 1 A 103 103 LEU HA H 103 3.912 4.171 -0.259 1
1 1011 . 17 1 1 A 103 103 LEU CA C 103 55.078 57.208 -2.130 1
1 1012 . 17 1 1 A 103 103 LEU CB C 103 38.963 41.841 -2.878 1
1 1016 . 17 1 1 A 103 103 LEU N N 103 120.341 119.199 1.142 1
1 1017 . 17 1 1 A 104 104 SER H H 104 8.268 7.598 0.670 1
1 1018 . 17 1 1 A 104 104 SER HA H 104 4.120 4.437 -0.317 1
1 1021 . 17 1 1 A 104 104 SER CA C 104 58.301 58.664 -0.363 1
1 1022 . 17 1 1 A 104 104 SER CB C 104 60.193 63.650 -3.457 1
1 1023 . 17 1 1 A 104 104 SER N N 104 115.150 112.953 2.197 1
1 1024 . 17 1 1 A 105 105 LEU H H 105 7.501 7.428 0.073 1
1 1025 . 17 1 1 A 105 105 LEU HA H 105 4.041 4.027 0.014 1
1 1035 . 17 1 1 A 105 105 LEU CA C 105 53.995 56.881 -2.886 1
1 1036 . 17 1 1 A 105 105 LEU CB C 105 39.597 42.187 -2.590 1
1 1040 . 17 1 1 A 105 105 LEU N N 105 124.223 119.423 4.800 1
1 1041 . 17 1 1 A 106 106 LYS H H 106 7.542 8.067 -0.525 1
1 1042 . 17 1 1 A 106 106 LYS HA H 106 4.090 4.034 0.056 1
1 1050 . 17 1 1 A 106 106 LYS CA C 106 55.495 58.541 -3.046 1
1 1051 . 17 1 1 A 106 106 LYS CB C 106 29.941 31.828 -1.887 1
1 1055 . 17 1 1 A 106 106 LYS N N 106 120.328 119.203 1.125 1
1 1056 . 17 1 1 A 107 107 GLU H H 107 7.884 8.116 -0.232 1
1 1057 . 17 1 1 A 107 107 GLU HA H 107 4.210 4.020 0.190 1
1 1060 . 17 1 1 A 107 107 GLU CA C 107 54.509 58.760 -4.251 1
1 1061 . 17 1 1 A 107 107 GLU CB C 107 27.239 29.499 -2.260 1
1 1062 . 17 1 1 A 107 107 GLU N N 107 118.621 120.272 -1.651 1
1 1063 . 17 1 1 A 108 108 SER H H 108 7.923 7.949 -0.026 1
1 1064 . 17 1 1 A 108 108 SER HA H 108 4.385 4.138 0.247 1
1 1067 . 17 1 1 A 108 108 SER CA C 108 56.442 61.101 -4.659 1
1 1068 . 17 1 1 A 108 108 SER CB C 108 60.953 63.066 -2.113 1
1 1069 . 17 1 1 A 108 108 SER N N 108 115.670 115.862 -0.192 1
1 1070 . 17 1 1 A 109 109 ARG H H 109 8.068 7.710 0.358 1
1 1071 . 17 1 1 A 109 109 ARG HA H 109 4.307 4.054 0.253 1
1 1078 . 17 1 1 A 109 109 ARG CA C 109 53.732 59.075 -5.343 1
1 1079 . 17 1 1 A 109 109 ARG CB C 109 27.968 29.727 -1.759 1
1 1082 . 17 1 1 A 109 109 ARG N N 109 122.313 121.749 0.564 1
1 1083 . 17 1 1 A 110 110 ASN H H 110 8.292 8.184 0.108 1
1 1084 . 17 1 1 A 110 110 ASN HA H 110 4.720 4.564 0.156 1
1 1087 . 17 1 1 A 110 110 ASN CA C 110 50.750 55.793 -5.043 1
1 1088 . 17 1 1 A 110 110 ASN CB C 110 36.197 38.627 -2.430 1
1 1089 . 17 1 1 A 110 110 ASN N N 110 119.304 118.783 0.521 1
1 1090 . 17 1 1 A 111 111 SER H H 111 8.244 7.739 0.505 1
1 1091 . 17 1 1 A 111 111 SER HA H 111 4.423 4.236 0.187 1
1 1094 . 17 1 1 A 111 111 SER CA C 111 55.990 60.663 -4.673 1
1 1095 . 17 1 1 A 111 111 SER CB C 111 61.027 63.093 -2.066 1
1 1096 . 17 1 1 A 111 111 SER N N 111 116.119 114.837 1.282 1
1 1097 . 17 1 1 A 112 112 GLY H H 112 8.327 8.150 0.177 1
1 1098 . 17 1 1 A 112 112 GLY HA2 H 112 3.944 3.964 -0.020 1
1 1099 . 17 1 1 A 112 112 GLY HA3 H 112 3.912 3.986 -0.074 1
1 1100 . 17 1 1 A 112 112 GLY CA C 112 42.733 45.849 -3.116 1
1 1101 . 17 1 1 A 112 112 GLY N N 112 110.442 107.217 3.225 1
1 1102 . 17 1 1 A 113 113 GLY H H 113 8.097 8.163 -0.066 1
1 1103 . 17 1 1 A 113 113 GLY HA2 H 113 3.831 3.876 -0.045 1
1 1104 . 17 1 1 A 113 113 GLY HA3 H 113 3.785 3.880 -0.095 1
1 1105 . 17 1 1 A 113 113 GLY CA C 113 42.435 46.760 -4.325 1
1 1106 . 17 1 1 A 113 113 GLY N N 113 108.745 109.712 -0.967 1
1 2 . 18 1 1 A 3 3 HIS CB C 3 33.709 29.315 4.394 1
1 3 . 18 1 1 A 7 7 HIS H H 7 8.731 7.675 1.056 1
1 4 . 18 1 1 A 7 7 HIS HA H 7 4.564 4.539 0.025 1
1 7 . 18 1 1 A 7 7 HIS CA C 7 53.649 55.450 -1.801 1
1 8 . 18 1 1 A 7 7 HIS CB C 7 26.268 31.077 -4.809 1
1 9 . 18 1 1 A 7 7 HIS N N 7 121.126 114.461 6.665 1
1 10 . 18 1 1 A 8 8 GLY H H 8 8.540 8.544 -0.004 1
1 11 . 18 1 1 A 8 8 GLY HA2 H 8 3.973 3.968 0.005 1
1 12 . 18 1 1 A 8 8 GLY HA3 H 8 3.811 3.986 -0.175 1
1 13 . 18 1 1 A 8 8 GLY CA C 8 42.618 44.715 -2.097 1
1 14 . 18 1 1 A 8 8 GLY N N 8 110.662 109.619 1.043 1
1 15 . 18 1 1 A 9 9 GLU H H 9 8.239 8.164 0.075 1
1 16 . 18 1 1 A 9 9 GLU HA H 9 4.568 4.015 0.553 1
1 18 . 18 1 1 A 9 9 GLU CA C 9 53.605 57.908 -4.303 1
1 19 . 18 1 1 A 9 9 GLU CB C 9 28.019 28.866 -0.847 1
1 20 . 18 1 1 A 9 9 GLU N N 9 121.669 120.944 0.725 1
1 21 . 18 1 1 A 10 10 PHE H H 10 8.785 7.176 1.609 1
1 22 . 18 1 1 A 10 10 PHE HA H 10 4.850 5.248 -0.398 1
1 25 . 18 1 1 A 10 10 PHE CA C 10 52.630 56.533 -3.903 1
1 26 . 18 1 1 A 10 10 PHE CB C 10 37.906 41.743 -3.837 1
1 27 . 18 1 1 A 10 10 PHE N N 10 118.401 115.565 2.836 1
1 28 . 18 1 1 A 11 11 GLN H H 11 8.552 8.715 -0.163 1
1 29 . 18 1 1 A 11 11 GLN HA H 11 5.425 5.029 0.396 1
1 34 . 18 1 1 A 11 11 GLN CA C 11 51.663 54.793 -3.130 1
1 35 . 18 1 1 A 11 11 GLN CB C 11 28.427 30.751 -2.324 1
1 37 . 18 1 1 A 11 11 GLN N N 11 117.519 121.458 -3.939 1
1 38 . 18 1 1 A 12 12 ILE H H 12 8.239 8.262 -0.023 1
1 39 . 18 1 1 A 12 12 ILE HA H 12 4.103 4.901 -0.798 1
1 49 . 18 1 1 A 12 12 ILE CA C 12 57.134 60.055 -2.921 1
1 50 . 18 1 1 A 12 12 ILE CB C 12 39.491 39.923 -0.432 1
1 54 . 18 1 1 A 12 12 ILE N N 12 114.043 121.992 -7.949 1
1 55 . 18 1 1 A 13 13 PHE H H 13 8.538 8.776 -0.238 1
1 56 . 18 1 1 A 13 13 PHE HA H 13 5.620 5.278 0.342 1
1 59 . 18 1 1 A 13 13 PHE CA C 13 52.438 56.332 -3.894 1
1 60 . 18 1 1 A 13 13 PHE CB C 13 39.253 42.670 -3.417 1
1 61 . 18 1 1 A 13 13 PHE N N 13 117.015 119.763 -2.748 1
1 62 . 18 1 1 A 14 14 ALA H H 14 9.238 9.447 -0.209 1
1 63 . 18 1 1 A 14 14 ALA HA H 14 5.311 5.568 -0.257 1
1 67 . 18 1 1 A 14 14 ALA CA C 14 47.183 49.967 -2.784 1
1 68 . 18 1 1 A 14 14 ALA CB C 14 17.811 22.342 -4.531 1
1 69 . 18 1 1 A 14 14 ALA N N 14 123.503 124.486 -0.983 1
1 70 . 18 1 1 A 15 15 LYS H H 15 8.810 9.373 -0.563 1
1 71 . 18 1 1 A 15 15 LYS HA H 15 5.511 5.492 0.019 1
1 80 . 18 1 1 A 15 15 LYS CA C 15 51.718 54.702 -2.984 1
1 81 . 18 1 1 A 15 15 LYS CB C 15 33.635 35.797 -2.162 1
1 85 . 18 1 1 A 15 15 LYS N N 15 123.382 122.629 0.753 1
1 86 . 18 1 1 A 16 16 THR H H 16 8.830 8.448 0.382 1
1 87 . 18 1 1 A 16 16 THR HA H 16 5.212 5.038 0.174 1
1 92 . 18 1 1 A 16 16 THR CA C 16 57.614 60.724 -3.110 1
1 93 . 18 1 1 A 16 16 THR CB C 16 68.210 71.266 -3.056 1
1 95 . 18 1 1 A 16 16 THR N N 16 116.517 116.016 0.501 1
1 96 . 18 1 1 A 17 17 LEU H H 17 9.428 8.888 0.540 1
1 97 . 18 1 1 A 17 17 LEU HA H 17 4.286 4.038 0.248 1
1 107 . 18 1 1 A 17 17 LEU CA C 17 54.504 58.455 -3.951 1
1 108 . 18 1 1 A 17 17 LEU CB C 17 38.564 41.419 -2.855 1
1 112 . 18 1 1 A 17 17 LEU N N 17 121.786 123.309 -1.523 1
1 113 . 18 1 1 A 18 18 THR H H 18 7.546 7.867 -0.321 1
1 114 . 18 1 1 A 18 18 THR HA H 18 4.391 4.242 0.149 1
1 119 . 18 1 1 A 18 18 THR CA C 18 58.524 63.394 -4.870 1
1 120 . 18 1 1 A 18 18 THR CB C 18 66.166 70.407 -4.241 1
1 122 . 18 1 1 A 18 18 THR N N 18 105.598 108.667 -3.069 1
1 123 . 18 1 1 A 19 19 GLY H H 19 7.683 7.922 -0.239 1
1 124 . 18 1 1 A 19 19 GLY HA2 H 19 3.300 3.936 -0.636 1
1 125 . 18 1 1 A 19 19 GLY HA3 H 19 4.248 3.949 0.299 1
1 126 . 18 1 1 A 19 19 GLY CA C 19 42.947 46.100 -3.153 1
1 127 . 18 1 1 A 19 19 GLY N N 19 109.243 112.165 -2.922 1
1 128 . 18 1 1 A 20 20 LYS H H 20 7.375 7.811 -0.436 1
1 129 . 18 1 1 A 20 20 LYS HA H 20 4.331 4.588 -0.257 1
1 138 . 18 1 1 A 20 20 LYS CA C 20 53.829 55.559 -1.730 1
1 139 . 18 1 1 A 20 20 LYS CB C 20 30.385 33.730 -3.345 1
1 143 . 18 1 1 A 20 20 LYS N N 20 122.757 121.189 1.568 1
1 144 . 18 1 1 A 21 21 THR H H 21 8.637 8.855 -0.218 1
1 145 . 18 1 1 A 21 21 THR HA H 21 4.852 4.740 0.112 1
1 150 . 18 1 1 A 21 21 THR CA C 21 59.846 62.643 -2.797 1
1 151 . 18 1 1 A 21 21 THR CB C 21 67.140 69.068 -1.928 1
1 153 . 18 1 1 A 21 21 THR N N 21 121.524 123.394 -1.870 1
1 154 . 18 1 1 A 22 22 ILE H H 22 9.509 9.258 0.251 1
1 155 . 18 1 1 A 22 22 ILE HA H 22 4.349 4.861 -0.512 1
1 165 . 18 1 1 A 22 22 ILE CA C 22 57.634 60.054 -2.420 1
1 166 . 18 1 1 A 22 22 ILE CB C 22 38.334 41.602 -3.268 1
1 170 . 18 1 1 A 22 22 ILE N N 22 129.772 127.312 2.460 1
1 171 . 18 1 1 A 23 23 THR H H 23 8.838 8.747 0.091 1
1 172 . 18 1 1 A 23 23 THR HA H 23 4.653 4.491 0.162 1
1 177 . 18 1 1 A 23 23 THR CA C 23 60.194 61.493 -1.299 1
1 178 . 18 1 1 A 23 23 THR CB C 23 66.577 69.663 -3.086 1
1 180 . 18 1 1 A 23 23 THR N N 23 124.070 123.675 0.395 1
1 181 . 18 1 1 A 24 24 LEU H H 24 8.749 8.581 0.168 1
1 182 . 18 1 1 A 24 24 LEU HA H 24 4.619 5.051 -0.432 1
1 192 . 18 1 1 A 24 24 LEU CA C 24 50.257 52.806 -2.549 1
1 193 . 18 1 1 A 24 24 LEU CB C 24 42.932 45.508 -2.576 1
1 197 . 18 1 1 A 24 24 LEU N N 24 126.499 123.239 3.260 1
1 198 . 18 1 1 A 25 25 GLU H H 25 7.990 8.806 -0.816 1
1 199 . 18 1 1 A 25 25 GLU HA H 25 4.591 4.606 -0.015 1
1 204 . 18 1 1 A 25 25 GLU CA C 25 52.845 56.085 -3.240 1
1 205 . 18 1 1 A 25 25 GLU CB C 25 27.210 30.336 -3.126 1
1 207 . 18 1 1 A 25 25 GLU N N 25 121.644 123.081 -1.437 1
1 208 . 18 1 1 A 26 26 VAL H H 26 8.657 8.369 0.288 1
1 209 . 18 1 1 A 26 26 VAL HA H 26 4.403 5.027 -0.624 1
1 217 . 18 1 1 A 26 26 VAL CA C 26 56.020 58.800 -2.780 1
1 218 . 18 1 1 A 26 26 VAL CB C 26 33.631 35.419 -1.788 1
1 221 . 18 1 1 A 26 26 VAL N N 26 116.647 120.593 -3.946 1
1 222 . 18 1 1 A 27 27 GLU H H 27 7.970 8.997 -1.027 1
1 223 . 18 1 1 A 27 27 GLU HA H 27 4.447 4.740 -0.293 1
1 228 . 18 1 1 A 27 27 GLU CA C 27 51.386 56.210 -4.824 1
1 229 . 18 1 1 A 27 27 GLU CB C 27 30.905 30.491 0.414 1
1 231 . 18 1 1 A 27 27 GLU N N 27 115.496 121.214 -5.718 1
1 232 . 18 1 1 A 28 28 SER H H 28 9.192 9.016 0.176 1
1 233 . 18 1 1 A 28 28 SER HA H 28 4.108 4.114 -0.006 1
1 236 . 18 1 1 A 28 28 SER CA C 28 59.909 60.883 -0.974 1
1 237 . 18 1 1 A 28 28 SER CB C 28 60.399 62.502 -2.103 1
1 238 . 18 1 1 A 28 28 SER N N 28 117.720 118.868 -1.148 1
1 239 . 18 1 1 A 29 29 SER H H 29 7.371 7.811 -0.440 1
1 240 . 18 1 1 A 29 29 SER HA H 29 4.327 4.646 -0.319 1
1 243 . 18 1 1 A 29 29 SER CA C 29 54.805 57.957 -3.152 1
1 244 . 18 1 1 A 29 29 SER CB C 29 60.775 64.368 -3.593 1
1 245 . 18 1 1 A 29 29 SER N N 29 108.936 114.635 -5.699 1
1 246 . 18 1 1 A 30 30 ASP H H 30 7.852 7.600 0.252 1
1 247 . 18 1 1 A 30 30 ASP HA H 30 4.591 4.549 0.042 1
1 250 . 18 1 1 A 30 30 ASP CA C 30 53.040 54.609 -1.569 1
1 251 . 18 1 1 A 30 30 ASP CB C 30 37.942 41.556 -3.614 1
1 252 . 18 1 1 A 30 30 ASP N N 30 123.735 123.281 0.454 1
1 253 . 18 1 1 A 31 31 THR H H 31 7.852 8.430 -0.578 1
1 254 . 18 1 1 A 31 31 THR HA H 31 4.918 4.798 0.120 1
1 259 . 18 1 1 A 31 31 THR CA C 31 56.929 60.078 -3.149 1
1 260 . 18 1 1 A 31 31 THR CB C 31 68.674 71.603 -2.929 1
1 262 . 18 1 1 A 31 31 THR N N 31 109.181 112.980 -3.799 1
1 263 . 18 1 1 A 32 32 ILE H H 32 8.582 8.947 -0.365 1
1 264 . 18 1 1 A 32 32 ILE HA H 32 3.624 3.792 -0.168 1
1 274 . 18 1 1 A 32 32 ILE CA C 32 59.474 65.471 -5.997 1
1 275 . 18 1 1 A 32 32 ILE CB C 32 31.561 37.593 -6.032 1
1 279 . 18 1 1 A 32 32 ILE N N 32 121.833 122.700 -0.867 1
1 280 . 18 1 1 A 33 33 ASP H H 33 9.255 8.243 1.012 1
1 281 . 18 1 1 A 33 33 ASP HA H 33 4.201 4.374 -0.173 1
1 284 . 18 1 1 A 33 33 ASP CA C 33 54.679 57.841 -3.162 1
1 285 . 18 1 1 A 33 33 ASP CB C 33 37.700 41.808 -4.108 1
1 286 . 18 1 1 A 33 33 ASP N N 33 119.823 120.672 -0.849 1
1 287 . 18 1 1 A 34 34 ASN H H 34 8.026 7.732 0.294 1
1 288 . 18 1 1 A 34 34 ASN HA H 34 4.409 4.602 -0.193 1
1 291 . 18 1 1 A 34 34 ASN CA C 34 53.324 56.429 -3.105 1
1 292 . 18 1 1 A 34 34 ASN CB C 34 35.782 39.169 -3.387 1
1 293 . 18 1 1 A 34 34 ASN N N 34 119.540 117.815 1.725 1
1 294 . 18 1 1 A 35 35 VAL H H 35 8.167 8.066 0.101 1
1 295 . 18 1 1 A 35 35 VAL HA H 35 3.249 3.453 -0.204 1
1 303 . 18 1 1 A 35 35 VAL CA C 35 65.308 67.086 -1.778 1
1 304 . 18 1 1 A 35 35 VAL CB C 35 27.965 31.514 -3.549 1
1 307 . 18 1 1 A 35 35 VAL N N 35 122.223 120.061 2.162 1
1 308 . 18 1 1 A 36 36 LYS H H 36 8.460 8.167 0.293 1
1 313 . 18 1 1 A 36 36 LYS CB C 36 30.753 32.225 -1.472 1
1 315 . 18 1 1 A 36 36 LYS N N 36 119.438 119.152 0.286 1
1 316 . 18 1 1 A 37 37 SER H H 37 8.196 8.694 -0.498 1
1 317 . 18 1 1 A 37 37 SER HA H 37 4.130 4.223 -0.093 1
1 320 . 18 1 1 A 37 37 SER CA C 37 58.528 61.386 -2.858 1
1 321 . 18 1 1 A 37 37 SER CB C 37 59.768 62.613 -2.845 1
1 322 . 18 1 1 A 37 37 SER N N 37 117.791 114.255 3.536 1
1 323 . 18 1 1 A 38 38 LYS H H 38 8.043 8.086 -0.043 1
1 324 . 18 1 1 A 38 38 LYS HA H 38 4.095 3.969 0.126 1
1 325 . 18 1 1 A 38 38 LYS CA C 38 57.377 59.446 -2.069 1
1 326 . 18 1 1 A 38 38 LYS N N 38 124.094 121.342 2.752 1
1 327 . 18 1 1 A 39 39 ILE H H 39 8.254 8.236 0.018 1
1 328 . 18 1 1 A 39 39 ILE HA H 39 3.439 3.668 -0.229 1
1 338 . 18 1 1 A 39 39 ILE CA C 39 63.977 64.999 -1.022 1
1 339 . 18 1 1 A 39 39 ILE CB C 39 33.935 37.411 -3.476 1
1 343 . 18 1 1 A 39 39 ILE N N 39 122.107 120.711 1.396 1
1 344 . 18 1 1 A 40 40 GLN H H 40 8.379 8.382 -0.003 1
1 345 . 18 1 1 A 40 40 GLN HA H 40 3.746 4.197 -0.451 1
1 350 . 18 1 1 A 40 40 GLN CA C 40 57.472 58.210 -0.738 1
1 351 . 18 1 1 A 40 40 GLN CB C 40 25.072 28.053 -2.981 1
1 353 . 18 1 1 A 40 40 GLN N N 40 123.725 119.631 4.094 1
1 354 . 18 1 1 A 41 41 ASP H H 41 8.210 7.883 0.327 1
1 355 . 18 1 1 A 41 41 ASP HA H 41 4.247 4.373 -0.126 1
1 358 . 18 1 1 A 41 41 ASP CA C 41 54.646 56.835 -2.189 1
1 359 . 18 1 1 A 41 41 ASP CB C 41 38.136 40.820 -2.684 1
1 360 . 18 1 1 A 41 41 ASP N N 41 120.564 120.823 -0.259 1
1 361 . 18 1 1 A 42 42 LYS H H 42 7.381 7.740 -0.359 1
1 362 . 18 1 1 A 42 42 LYS HA H 42 4.246 4.306 -0.060 1
1 369 . 18 1 1 A 42 42 LYS CA C 42 55.579 57.844 -2.265 1
1 370 . 18 1 1 A 42 42 LYS CB C 42 31.406 33.457 -2.051 1
1 373 . 18 1 1 A 42 42 LYS N N 42 115.674 117.589 -1.915 1
1 374 . 18 1 1 A 43 43 GLU H H 43 8.537 8.970 -0.433 1
1 375 . 18 1 1 A 43 43 GLU HA H 43 4.522 4.528 -0.006 1
1 380 . 18 1 1 A 43 43 GLU CA C 43 52.772 55.733 -2.961 1
1 381 . 18 1 1 A 43 43 GLU CB C 43 30.535 31.108 -0.573 1
1 383 . 18 1 1 A 43 43 GLU N N 43 114.355 116.165 -1.810 1
1 384 . 18 1 1 A 44 44 GLY H H 44 8.611 8.303 0.308 1
1 385 . 18 1 1 A 44 44 GLY HA2 H 44 4.067 3.970 0.097 1
1 386 . 18 1 1 A 44 44 GLY HA3 H 44 3.819 3.971 -0.152 1
1 387 . 18 1 1 A 44 44 GLY CA C 44 43.205 45.584 -2.379 1
1 388 . 18 1 1 A 44 44 GLY N N 44 109.406 108.583 0.823 1
1 389 . 18 1 1 A 45 45 ILE H H 45 6.092 8.173 -2.081 1
1 390 . 18 1 1 A 45 45 ILE HA H 45 4.324 4.125 0.199 1
1 400 . 18 1 1 A 45 45 ILE CA C 45 55.211 60.097 -4.886 1
1 401 . 18 1 1 A 45 45 ILE CB C 45 37.903 38.481 -0.578 1
1 405 . 18 1 1 A 45 45 ILE N N 45 120.791 122.478 -1.687 1
1 406 . 18 1 1 A 46 46 PRO HA H 46 4.547 4.546 0.001 1
1 413 . 18 1 1 A 46 46 PRO CA C 46 58.971 62.075 -3.104 1
1 414 . 18 1 1 A 46 46 PRO CB C 46 29.142 32.453 -3.311 1
1 417 . 18 1 1 A 47 47 PRO HA H 47 4.062 4.193 -0.131 1
1 424 . 18 1 1 A 47 47 PRO CA C 47 63.476 65.815 -2.339 1
1 425 . 18 1 1 A 47 47 PRO CB C 47 30.113 31.964 -1.851 1
1 428 . 18 1 1 A 48 48 ASP H H 48 8.418 8.477 -0.059 1
1 429 . 18 1 1 A 48 48 ASP HA H 48 4.346 4.343 0.003 1
1 432 . 18 1 1 A 48 48 ASP CA C 48 52.838 56.923 -4.085 1
1 433 . 18 1 1 A 48 48 ASP CB C 48 36.926 40.154 -3.228 1
1 434 . 18 1 1 A 48 48 ASP N N 48 113.462 116.974 -3.512 1
1 435 . 18 1 1 A 49 49 GLN H H 49 7.822 7.470 0.352 1
1 436 . 18 1 1 A 49 49 GLN HA H 49 4.283 4.091 0.192 1
1 439 . 18 1 1 A 49 49 GLN CA C 49 52.770 57.788 -5.018 1
1 441 . 18 1 1 A 49 49 GLN N N 49 117.377 117.560 -0.183 1
1 442 . 18 1 1 A 50 50 GLN H H 50 7.451 7.624 -0.173 1
1 443 . 18 1 1 A 50 50 GLN HA H 50 4.260 4.885 -0.625 1
1 448 . 18 1 1 A 50 50 GLN CA C 50 53.725 54.813 -1.088 1
1 449 . 18 1 1 A 50 50 GLN CB C 50 29.142 31.437 -2.295 1
1 451 . 18 1 1 A 50 50 GLN N N 50 117.526 118.181 -0.655 1
1 452 . 18 1 1 A 51 51 ARG H H 51 8.534 9.109 -0.575 1
1 453 . 18 1 1 A 51 51 ARG HA H 51 4.486 5.106 -0.620 1
1 460 . 18 1 1 A 51 51 ARG CA C 51 52.492 54.201 -1.709 1
1 461 . 18 1 1 A 51 51 ARG CB C 51 29.096 34.218 -5.122 1
1 464 . 18 1 1 A 51 51 ARG N N 51 121.655 119.038 2.617 1
1 465 . 18 1 1 A 52 52 LEU H H 52 8.683 8.851 -0.168 1
1 466 . 18 1 1 A 52 52 LEU HA H 52 5.255 5.226 0.029 1
1 476 . 18 1 1 A 52 52 LEU CA C 52 50.618 53.484 -2.866 1
1 477 . 18 1 1 A 52 52 LEU CB C 52 43.007 43.737 -0.730 1
1 481 . 18 1 1 A 52 52 LEU N N 52 122.929 122.626 0.303 1
1 482 . 18 1 1 A 53 53 ILE H H 53 9.286 8.861 0.425 1
1 483 . 18 1 1 A 53 53 ILE HA H 53 5.096 5.133 -0.037 1
1 492 . 18 1 1 A 53 53 ILE CA C 53 56.795 60.184 -3.389 1
1 496 . 18 1 1 A 53 53 ILE N N 53 124.718 124.188 0.530 1
1 497 . 18 1 1 A 54 54 TRP H H 54 8.871 9.131 -0.260 1
1 499 . 18 1 1 A 54 54 TRP N N 54 127.412 128.480 -1.068 1
1 501 . 18 1 1 A 55 55 ALA H H 55 8.401 8.283 0.118 1
1 502 . 18 1 1 A 55 55 ALA HA H 55 3.183 3.358 -0.175 1
1 506 . 18 1 1 A 55 55 ALA CA C 55 49.712 52.660 -2.948 1
1 507 . 18 1 1 A 55 55 ALA CB C 55 13.252 16.952 -3.700 1
1 508 . 18 1 1 A 55 55 ALA N N 55 128.894 129.521 -0.627 1
1 509 . 18 1 1 A 56 56 GLY H H 56 8.248 8.395 -0.147 1
1 510 . 18 1 1 A 56 56 GLY HA2 H 56 3.968 3.730 0.238 1
1 511 . 18 1 1 A 56 56 GLY HA3 H 56 3.916 3.750 0.166 1
1 512 . 18 1 1 A 56 56 GLY CA C 56 43.142 45.508 -2.366 1
1 513 . 18 1 1 A 56 56 GLY N N 56 101.499 102.478 -0.979 1
1 514 . 18 1 1 A 57 57 LYS H H 57 8.028 7.233 0.795 1
1 515 . 18 1 1 A 57 57 LYS HA H 57 4.609 4.840 -0.231 1
1 522 . 18 1 1 A 57 57 LYS CA C 57 51.928 54.596 -2.668 1
1 523 . 18 1 1 A 57 57 LYS CB C 57 32.613 35.541 -2.928 1
1 526 . 18 1 1 A 57 57 LYS N N 57 118.995 120.366 -1.371 1
1 527 . 18 1 1 A 58 58 GLN H H 58 8.607 8.563 0.044 1
1 528 . 18 1 1 A 58 58 GLN HA H 58 4.617 4.634 -0.017 1
1 533 . 18 1 1 A 58 58 GLN CA C 58 53.261 55.694 -2.433 1
1 534 . 18 1 1 A 58 58 GLN CB C 58 26.613 29.623 -3.010 1
1 536 . 18 1 1 A 58 58 GLN N N 58 119.825 125.345 -5.520 1
1 537 . 18 1 1 A 59 59 LEU H H 59 8.653 9.038 -0.385 1
1 538 . 18 1 1 A 59 59 LEU HA H 59 4.138 4.384 -0.246 1
1 548 . 18 1 1 A 59 59 LEU CA C 59 51.991 54.836 -2.845 1
1 549 . 18 1 1 A 59 59 LEU CB C 59 39.006 42.175 -3.169 1
1 553 . 18 1 1 A 59 59 LEU N N 59 125.484 126.733 -1.249 1
1 554 . 18 1 1 A 60 60 GLU H H 60 8.461 8.945 -0.484 1
1 555 . 18 1 1 A 60 60 GLU HA H 60 4.371 4.331 0.040 1
1 559 . 18 1 1 A 60 60 GLU CA C 60 53.436 56.432 -2.996 1
1 560 . 18 1 1 A 60 60 GLU CB C 60 29.057 29.937 -0.880 1
1 562 . 18 1 1 A 60 60 GLU N N 60 123.237 123.780 -0.543 1
1 563 . 18 1 1 A 61 61 ASP H H 61 8.076 9.292 -1.216 1
1 564 . 18 1 1 A 61 61 ASP HA H 61 4.265 4.356 -0.091 1
1 567 . 18 1 1 A 61 61 ASP CA C 61 54.398 57.190 -2.792 1
1 568 . 18 1 1 A 61 61 ASP CB C 61 38.340 40.452 -2.112 1
1 569 . 18 1 1 A 61 61 ASP N N 61 120.701 125.936 -5.235 1
1 570 . 18 1 1 A 62 62 GLY HA2 H 62 4.104 3.990 0.114 1
1 571 . 18 1 1 A 62 62 GLY HA3 H 62 3.832 3.992 -0.160 1
1 572 . 18 1 1 A 62 62 GLY CA C 62 42.576 45.406 -2.830 1
1 573 . 18 1 1 A 63 63 ARG H H 63 7.319 8.282 -0.963 1
1 574 . 18 1 1 A 63 63 ARG HA H 63 4.595 4.454 0.141 1
1 579 . 18 1 1 A 63 63 ARG CA C 63 51.971 56.013 -4.042 1
1 582 . 18 1 1 A 63 63 ARG N N 63 119.206 121.726 -2.520 1
1 583 . 18 1 1 A 64 64 THR H H 64 8.735 8.532 0.203 1
1 584 . 18 1 1 A 64 64 THR HA H 64 5.208 5.069 0.139 1
1 589 . 18 1 1 A 64 64 THR CA C 64 57.126 59.547 -2.421 1
1 590 . 18 1 1 A 64 64 THR CB C 64 69.885 71.911 -2.026 1
1 592 . 18 1 1 A 64 64 THR N N 64 108.713 115.793 -7.080 1
1 593 . 18 1 1 A 65 65 LEU H H 65 8.241 9.465 -1.224 1
1 594 . 18 1 1 A 65 65 LEU HA H 65 4.003 3.960 0.043 1
1 604 . 18 1 1 A 65 65 LEU CA C 65 56.409 57.774 -1.365 1
1 605 . 18 1 1 A 65 65 LEU CB C 65 37.179 41.489 -4.310 1
1 609 . 18 1 1 A 65 65 LEU N N 65 118.111 122.313 -4.202 1
1 610 . 18 1 1 A 66 66 SER H H 66 8.296 8.233 0.063 1
1 611 . 18 1 1 A 66 66 SER HA H 66 4.201 4.268 -0.067 1
1 614 . 18 1 1 A 66 66 SER CA C 66 58.454 60.545 -2.091 1
1 615 . 18 1 1 A 66 66 SER CB C 66 59.969 62.889 -2.920 1
1 616 . 18 1 1 A 66 66 SER N N 66 113.148 113.642 -0.494 1
1 617 . 18 1 1 A 67 67 ASP H H 67 7.984 8.250 -0.266 1
1 618 . 18 1 1 A 67 67 ASP HA H 67 4.187 4.370 -0.183 1
1 621 . 18 1 1 A 67 67 ASP CA C 67 54.744 56.828 -2.084 1
1 622 . 18 1 1 A 67 67 ASP CB C 67 37.794 41.047 -3.253 1
1 623 . 18 1 1 A 67 67 ASP N N 67 124.130 123.702 0.428 1
1 624 . 18 1 1 A 68 68 TYR H H 68 7.177 7.387 -0.210 1
1 625 . 18 1 1 A 68 68 TYR N N 68 115.334 114.806 0.528 1
1 626 . 18 1 1 A 69 69 ASN H H 69 8.111 8.273 -0.162 1
1 627 . 18 1 1 A 69 69 ASN HA H 69 4.253 4.300 -0.047 1
1 630 . 18 1 1 A 69 69 ASN CA C 69 51.386 54.212 -2.826 1
1 631 . 18 1 1 A 69 69 ASN CB C 69 34.867 37.379 -2.512 1
1 632 . 18 1 1 A 69 69 ASN N N 69 116.867 117.682 -0.815 1
1 633 . 18 1 1 A 70 70 ILE H H 70 7.460 7.840 -0.380 1
1 634 . 18 1 1 A 70 70 ILE HA H 70 3.210 3.983 -0.773 1
1 644 . 18 1 1 A 70 70 ILE CA C 70 60.157 62.117 -1.960 1
1 645 . 18 1 1 A 70 70 ILE CB C 70 34.754 37.805 -3.051 1
1 649 . 18 1 1 A 70 70 ILE N N 70 119.821 120.067 -0.246 1
1 650 . 18 1 1 A 71 71 GLN H H 71 7.368 8.908 -1.540 1
1 651 . 18 1 1 A 71 71 GLN HA H 71 4.099 4.559 -0.460 1
1 656 . 18 1 1 A 71 71 GLN CA C 71 50.906 54.468 -3.562 1
1 657 . 18 1 1 A 71 71 GLN CB C 71 28.793 30.813 -2.020 1
1 659 . 18 1 1 A 71 71 GLN N N 71 124.287 126.806 -2.519 1
1 660 . 18 1 1 A 72 72 ARG H H 72 7.583 8.918 -1.335 1
1 661 . 18 1 1 A 72 72 ARG HA H 72 3.907 4.166 -0.259 1
1 668 . 18 1 1 A 72 72 ARG CA C 72 54.527 59.384 -4.857 1
1 669 . 18 1 1 A 72 72 ARG CB C 72 27.470 29.928 -2.458 1
1 672 . 18 1 1 A 72 72 ARG N N 72 119.007 121.884 -2.877 1
1 673 . 18 1 1 A 73 73 GLU H H 73 9.262 7.753 1.509 1
1 674 . 18 1 1 A 73 73 GLU HA H 73 3.586 4.468 -0.882 1
1 679 . 18 1 1 A 73 73 GLU CA C 73 55.703 56.253 -0.550 1
1 680 . 18 1 1 A 73 73 GLU CB C 73 23.669 28.328 -4.659 1
1 682 . 18 1 1 A 73 73 GLU N N 73 115.180 118.087 -2.907 1
1 683 . 18 1 1 A 74 74 SER H H 74 7.551 7.725 -0.174 1
1 684 . 18 1 1 A 74 74 SER HA H 74 4.613 5.050 -0.437 1
1 687 . 18 1 1 A 74 74 SER CA C 74 58.305 56.554 1.751 1
1 688 . 18 1 1 A 74 74 SER CB C 74 62.156 65.526 -3.370 1
1 689 . 18 1 1 A 74 74 SER N N 74 115.104 116.791 -1.687 1
1 690 . 18 1 1 A 75 75 THR H H 75 8.785 8.756 0.029 1
1 691 . 18 1 1 A 75 75 THR HA H 75 5.014 4.914 0.100 1
1 696 . 18 1 1 A 75 75 THR CA C 75 59.835 62.044 -2.209 1
1 697 . 18 1 1 A 75 75 THR CB C 75 67.258 69.297 -2.039 1
1 699 . 18 1 1 A 75 75 THR N N 75 118.401 120.900 -2.499 1
1 700 . 18 1 1 A 76 76 LEU H H 76 9.447 10.071 -0.624 1
1 701 . 18 1 1 A 76 76 LEU HA H 76 4.930 4.613 0.317 1
1 711 . 18 1 1 A 76 76 LEU CA C 76 51.107 54.900 -3.793 1
1 712 . 18 1 1 A 76 76 LEU CB C 76 40.841 42.973 -2.132 1
1 716 . 18 1 1 A 76 76 LEU N N 76 127.905 128.286 -0.381 1
1 717 . 18 1 1 A 77 77 HIS HA H 77 4.976 5.127 -0.151 1
1 720 . 18 1 1 A 77 77 HIS CA C 77 53.776 55.157 -1.381 1
1 721 . 18 1 1 A 77 77 HIS CB C 77 28.438 29.996 -1.558 1
1 722 . 18 1 1 A 78 78 LEU H H 78 8.450 8.636 -0.186 1
1 723 . 18 1 1 A 78 78 LEU HA H 78 5.085 5.092 -0.007 1
1 733 . 18 1 1 A 78 78 LEU CA C 78 50.896 53.498 -2.602 1
1 734 . 18 1 1 A 78 78 LEU CB C 78 41.916 45.150 -3.234 1
1 738 . 18 1 1 A 78 78 LEU N N 78 126.178 126.255 -0.077 1
1 739 . 18 1 1 A 79 79 VAL H H 79 9.093 9.722 -0.629 1
1 740 . 18 1 1 A 79 79 VAL HA H 79 4.053 4.821 -0.768 1
1 748 . 18 1 1 A 79 79 VAL CA C 79 59.054 60.978 -1.924 1
1 749 . 18 1 1 A 79 79 VAL CB C 79 32.115 33.959 -1.844 1
1 752 . 18 1 1 A 79 79 VAL N N 79 128.372 125.634 2.738 1
1 753 . 18 1 1 A 80 80 LEU H H 80 8.000 8.893 -0.893 1
1 754 . 18 1 1 A 80 80 LEU HA H 80 5.105 5.072 0.033 1
1 764 . 18 1 1 A 80 80 LEU CA C 80 50.556 53.560 -3.004 1
1 765 . 18 1 1 A 80 80 LEU CB C 80 39.597 43.408 -3.811 1
1 769 . 18 1 1 A 80 80 LEU N N 80 126.145 128.528 -2.383 1
1 770 . 18 1 1 A 81 81 ARG H H 81 8.470 7.930 0.540 1
1 771 . 18 1 1 A 81 81 ARG HA H 81 4.197 4.427 -0.230 1
1 778 . 18 1 1 A 81 81 ARG CA C 81 53.133 56.167 -3.034 1
1 779 . 18 1 1 A 81 81 ARG CB C 81 28.413 31.438 -3.025 1
1 782 . 18 1 1 A 81 81 ARG N N 81 121.625 123.651 -2.026 1
1 783 . 18 1 1 A 82 82 LEU H H 82 8.454 8.435 0.019 1
1 784 . 18 1 1 A 82 82 LEU HA H 82 4.339 4.578 -0.239 1
1 794 . 18 1 1 A 82 82 LEU CA C 82 52.081 54.108 -2.027 1
1 795 . 18 1 1 A 82 82 LEU CB C 82 39.810 42.694 -2.884 1
1 799 . 18 1 1 A 82 82 LEU N N 82 123.832 122.502 1.330 1
1 800 . 18 1 1 A 83 83 ARG H H 83 8.404 8.969 -0.565 1
1 801 . 18 1 1 A 83 83 ARG HA H 83 4.308 4.061 0.247 1
1 808 . 18 1 1 A 83 83 ARG CA C 83 53.258 58.035 -4.777 1
1 809 . 18 1 1 A 83 83 ARG CB C 83 28.160 31.035 -2.875 1
1 812 . 18 1 1 A 83 83 ARG N N 83 121.447 127.515 -6.068 1
1 813 . 18 1 1 A 84 84 GLY H H 84 8.410 7.823 0.587 1
1 814 . 18 1 1 A 84 84 GLY HA2 H 84 3.929 4.073 -0.144 1
1 815 . 18 1 1 A 84 84 GLY HA3 H 84 3.929 4.073 -0.144 1
1 816 . 18 1 1 A 84 84 GLY CA C 84 42.751 45.724 -2.973 1
1 817 . 18 1 1 A 84 84 GLY N N 84 110.030 107.278 2.752 1
1 818 . 18 1 1 A 85 85 GLY H H 85 8.295 7.932 0.363 1
1 819 . 18 1 1 A 85 85 GLY HA2 H 85 3.950 4.063 -0.113 1
1 820 . 18 1 1 A 85 85 GLY HA3 H 85 3.950 4.063 -0.113 1
1 821 . 18 1 1 A 85 85 GLY CA C 85 42.831 45.204 -2.373 1
1 822 . 18 1 1 A 85 85 GLY N N 85 108.838 107.238 1.600 1
1 823 . 18 1 1 A 86 86 SER H H 86 8.292 8.133 0.159 1
1 824 . 18 1 1 A 86 86 SER HA H 86 4.405 4.186 0.219 1
1 827 . 18 1 1 A 86 86 SER CA C 86 55.965 58.976 -3.011 1
1 828 . 18 1 1 A 86 86 SER CB C 86 61.232 61.436 -0.204 1
1 829 . 18 1 1 A 86 86 SER N N 86 116.028 115.048 0.980 1
1 830 . 18 1 1 A 87 87 MET H H 87 8.470 8.038 0.432 1
1 831 . 18 1 1 A 87 87 MET HA H 87 4.447 4.169 0.278 1
1 836 . 18 1 1 A 87 87 MET CA C 87 53.281 58.446 -5.165 1
1 837 . 18 1 1 A 87 87 MET CB C 87 29.788 33.245 -3.457 1
1 839 . 18 1 1 A 87 87 MET N N 87 121.625 125.932 -4.307 1
1 840 . 18 1 1 A 88 88 GLY H H 88 8.320 7.690 0.630 1
1 841 . 18 1 1 A 88 88 GLY HA2 H 88 3.919 4.019 -0.100 1
1 842 . 18 1 1 A 88 88 GLY HA3 H 88 3.896 4.020 -0.124 1
1 843 . 18 1 1 A 88 88 GLY CA C 88 43.060 45.381 -2.321 1
1 844 . 18 1 1 A 88 88 GLY N N 88 109.625 106.523 3.102 1
1 845 . 18 1 1 A 89 89 GLY H H 89 8.256 8.071 0.185 1
1 846 . 18 1 1 A 89 89 GLY HA2 H 89 3.940 4.044 -0.104 1
1 847 . 18 1 1 A 89 89 GLY HA3 H 89 3.910 4.044 -0.134 1
1 848 . 18 1 1 A 89 89 GLY CA C 89 42.678 45.412 -2.734 1
1 849 . 18 1 1 A 89 89 GLY N N 89 108.982 107.600 1.382 1
1 850 . 18 1 1 A 90 90 ALA H H 90 8.203 8.008 0.195 1
1 851 . 18 1 1 A 90 90 ALA HA H 90 4.255 4.141 0.114 1
1 855 . 18 1 1 A 90 90 ALA CA C 90 50.763 54.831 -4.068 1
1 856 . 18 1 1 A 90 90 ALA CB C 90 16.364 19.080 -2.716 1
1 857 . 18 1 1 A 90 90 ALA N N 90 124.065 123.087 0.978 1
1 858 . 18 1 1 A 91 91 ALA H H 91 8.273 7.940 0.333 1
1 859 . 18 1 1 A 91 91 ALA HA H 91 4.204 4.688 -0.484 1
1 863 . 18 1 1 A 91 91 ALA CA C 91 51.080 50.496 0.584 1
1 864 . 18 1 1 A 91 91 ALA CB C 91 16.036 20.673 -4.637 1
1 865 . 18 1 1 A 91 91 ALA N N 91 121.985 119.707 2.278 1
1 866 . 18 1 1 A 92 92 ASP H H 92 8.022 8.724 -0.702 1
1 867 . 18 1 1 A 92 92 ASP HA H 92 4.455 4.901 -0.446 1
1 870 . 18 1 1 A 92 92 ASP CA C 92 52.664 53.149 -0.485 1
1 871 . 18 1 1 A 92 92 ASP CB C 92 37.925 41.876 -3.951 1
1 872 . 18 1 1 A 92 92 ASP N N 92 118.621 124.038 -5.417 1
1 873 . 18 1 1 A 93 93 GLU H H 93 8.282 8.258 0.024 1
1 874 . 18 1 1 A 93 93 GLU HA H 93 3.912 3.933 -0.021 1
1 879 . 18 1 1 A 93 93 GLU CA C 93 56.947 57.356 -0.409 1
1 880 . 18 1 1 A 93 93 GLU CB C 93 27.413 28.626 -1.213 1
1 882 . 18 1 1 A 93 93 GLU N N 93 122.247 117.937 4.310 1
1 883 . 18 1 1 A 94 94 GLU H H 94 8.194 7.969 0.225 1
1 884 . 18 1 1 A 94 94 GLU HA H 94 3.940 4.407 -0.467 1
1 889 . 18 1 1 A 94 94 GLU CA C 94 56.681 57.874 -1.193 1
1 890 . 18 1 1 A 94 94 GLU CB C 94 26.127 31.011 -4.884 1
1 892 . 18 1 1 A 94 94 GLU N N 94 118.024 119.585 -1.561 1
1 893 . 18 1 1 A 95 95 GLU H H 95 7.816 8.668 -0.852 1
1 894 . 18 1 1 A 95 95 GLU HA H 95 4.121 4.167 -0.046 1
1 898 . 18 1 1 A 95 95 GLU CA C 95 56.162 58.466 -2.304 1
1 899 . 18 1 1 A 95 95 GLU CB C 95 26.403 28.606 -2.203 1
1 901 . 18 1 1 A 95 95 GLU N N 95 120.028 119.840 0.188 1
1 902 . 18 1 1 A 96 96 LEU H H 96 7.637 7.763 -0.126 1
1 903 . 18 1 1 A 96 96 LEU HA H 96 3.988 4.108 -0.120 1
1 913 . 18 1 1 A 96 96 LEU CA C 96 55.303 57.178 -1.875 1
1 914 . 18 1 1 A 96 96 LEU CB C 96 39.038 41.447 -2.409 1
1 918 . 18 1 1 A 96 96 LEU N N 96 119.866 118.073 1.793 1
1 919 . 18 1 1 A 97 97 ILE H H 97 8.044 7.529 0.515 1
1 920 . 18 1 1 A 97 97 ILE HA H 97 3.478 3.974 -0.496 1
1 930 . 18 1 1 A 97 97 ILE CA C 97 62.054 63.851 -1.797 1
1 931 . 18 1 1 A 97 97 ILE CB C 97 34.541 38.100 -3.559 1
1 935 . 18 1 1 A 97 97 ILE N N 97 119.088 119.492 -0.404 1
1 936 . 18 1 1 A 98 98 ARG H H 98 7.991 8.359 -0.368 1
1 937 . 18 1 1 A 98 98 ARG HA H 98 3.793 4.013 -0.220 1
1 944 . 18 1 1 A 98 98 ARG CA C 98 57.509 58.841 -1.332 1
1 945 . 18 1 1 A 98 98 ARG CB C 98 27.191 29.968 -2.777 1
1 948 . 18 1 1 A 98 98 ARG N N 98 119.225 120.738 -1.513 1
1 949 . 18 1 1 A 99 99 LYS H H 99 8.101 7.920 0.181 1
1 950 . 18 1 1 A 99 99 LYS HA H 99 3.968 4.074 -0.106 1
1 959 . 18 1 1 A 99 99 LYS CA C 99 56.455 59.192 -2.737 1
1 960 . 18 1 1 A 99 99 LYS CB C 99 29.531 31.941 -2.410 1
1 964 . 18 1 1 A 99 99 LYS N N 99 119.464 118.459 1.005 1
1 965 . 18 1 1 A 100 100 ALA H H 100 8.167 8.050 0.117 1
1 966 . 18 1 1 A 100 100 ALA HA H 100 3.789 4.133 -0.344 1
1 970 . 18 1 1 A 100 100 ALA CA C 100 52.451 54.781 -2.330 1
1 971 . 18 1 1 A 100 100 ALA CB C 100 16.259 18.580 -2.321 1
1 972 . 18 1 1 A 100 100 ALA N N 100 122.398 121.454 0.944 1
1 973 . 18 1 1 A 101 101 ILE H H 101 8.777 7.926 0.851 1
1 974 . 18 1 1 A 101 101 ILE HA H 101 3.191 3.508 -0.317 1
1 984 . 18 1 1 A 101 101 ILE CA C 101 62.910 65.148 -2.238 1
1 985 . 18 1 1 A 101 101 ILE CB C 101 34.544 37.613 -3.069 1
1 989 . 18 1 1 A 101 101 ILE N N 101 120.431 118.901 1.530 1
1 990 . 18 1 1 A 102 102 GLU H H 102 7.890 7.652 0.238 1
1 991 . 18 1 1 A 102 102 GLU HA H 102 3.848 4.229 -0.381 1
1 996 . 18 1 1 A 102 102 GLU CA C 102 57.079 57.833 -0.754 1
1 997 . 18 1 1 A 102 102 GLU CB C 102 26.769 29.591 -2.822 1
1 999 . 18 1 1 A 102 102 GLU N N 102 120.248 121.237 -0.989 1
1 1000 . 18 1 1 A 103 103 LEU H H 103 8.194 7.648 0.546 1
1 1001 . 18 1 1 A 103 103 LEU HA H 103 3.912 4.197 -0.285 1
1 1011 . 18 1 1 A 103 103 LEU CA C 103 55.078 57.327 -2.249 1
1 1012 . 18 1 1 A 103 103 LEU CB C 103 38.963 42.105 -3.142 1
1 1016 . 18 1 1 A 103 103 LEU N N 103 120.341 120.403 -0.062 1
1 1017 . 18 1 1 A 104 104 SER H H 104 8.268 7.581 0.687 1
1 1018 . 18 1 1 A 104 104 SER HA H 104 4.120 4.577 -0.457 1
1 1021 . 18 1 1 A 104 104 SER CA C 104 58.301 59.375 -1.074 1
1 1022 . 18 1 1 A 104 104 SER CB C 104 60.193 64.437 -4.244 1
1 1023 . 18 1 1 A 104 104 SER N N 104 115.150 113.864 1.286 1
1 1024 . 18 1 1 A 105 105 LEU H H 105 7.501 7.405 0.096 1
1 1025 . 18 1 1 A 105 105 LEU HA H 105 4.041 3.992 0.049 1
1 1035 . 18 1 1 A 105 105 LEU CA C 105 53.995 56.823 -2.828 1
1 1036 . 18 1 1 A 105 105 LEU CB C 105 39.597 41.899 -2.302 1
1 1040 . 18 1 1 A 105 105 LEU N N 105 124.223 120.065 4.158 1
1 1041 . 18 1 1 A 106 106 LYS H H 106 7.542 8.141 -0.599 1
1 1042 . 18 1 1 A 106 106 LYS HA H 106 4.090 4.017 0.073 1
1 1050 . 18 1 1 A 106 106 LYS CA C 106 55.495 58.957 -3.462 1
1 1051 . 18 1 1 A 106 106 LYS CB C 106 29.941 31.822 -1.881 1
1 1055 . 18 1 1 A 106 106 LYS N N 106 120.328 117.662 2.666 1
1 1056 . 18 1 1 A 107 107 GLU H H 107 7.884 8.409 -0.525 1
1 1057 . 18 1 1 A 107 107 GLU HA H 107 4.210 4.038 0.172 1
1 1060 . 18 1 1 A 107 107 GLU CA C 107 54.509 59.474 -4.965 1
1 1061 . 18 1 1 A 107 107 GLU CB C 107 27.239 29.451 -2.212 1
1 1062 . 18 1 1 A 107 107 GLU N N 107 118.621 120.165 -1.544 1
1 1063 . 18 1 1 A 108 108 SER H H 108 7.923 8.507 -0.584 1
1 1064 . 18 1 1 A 108 108 SER HA H 108 4.385 4.150 0.235 1
1 1067 . 18 1 1 A 108 108 SER CA C 108 56.442 61.046 -4.604 1
1 1068 . 18 1 1 A 108 108 SER CB C 108 60.953 62.963 -2.010 1
1 1069 . 18 1 1 A 108 108 SER N N 108 115.670 114.372 1.298 1
1 1070 . 18 1 1 A 109 109 ARG H H 109 8.068 8.059 0.009 1
1 1071 . 18 1 1 A 109 109 ARG HA H 109 4.307 3.961 0.346 1
1 1078 . 18 1 1 A 109 109 ARG CA C 109 53.732 58.675 -4.943 1
1 1079 . 18 1 1 A 109 109 ARG CB C 109 27.968 29.717 -1.749 1
1 1082 . 18 1 1 A 109 109 ARG N N 109 122.313 121.865 0.448 1
1 1083 . 18 1 1 A 110 110 ASN H H 110 8.292 8.174 0.118 1
1 1084 . 18 1 1 A 110 110 ASN HA H 110 4.720 4.449 0.271 1
1 1087 . 18 1 1 A 110 110 ASN CA C 110 50.750 56.767 -6.017 1
1 1088 . 18 1 1 A 110 110 ASN CB C 110 36.197 39.787 -3.590 1
1 1089 . 18 1 1 A 110 110 ASN N N 110 119.304 117.687 1.617 1
1 1090 . 18 1 1 A 111 111 SER H H 111 8.244 7.930 0.314 1
1 1091 . 18 1 1 A 111 111 SER HA H 111 4.423 4.207 0.216 1
1 1094 . 18 1 1 A 111 111 SER CA C 111 55.990 61.077 -5.087 1
1 1095 . 18 1 1 A 111 111 SER CB C 111 61.027 62.700 -1.673 1
1 1096 . 18 1 1 A 111 111 SER N N 111 116.119 115.158 0.961 1
1 1097 . 18 1 1 A 112 112 GLY H H 112 8.327 7.692 0.635 1
1 1098 . 18 1 1 A 112 112 GLY HA2 H 112 3.944 3.960 -0.016 1
1 1099 . 18 1 1 A 112 112 GLY HA3 H 112 3.912 3.993 -0.081 1
1 1100 . 18 1 1 A 112 112 GLY CA C 112 42.733 45.377 -2.644 1
1 1101 . 18 1 1 A 112 112 GLY N N 112 110.442 109.407 1.035 1
1 1102 . 18 1 1 A 113 113 GLY H H 113 8.097 8.136 -0.039 1
1 1103 . 18 1 1 A 113 113 GLY HA2 H 113 3.831 3.714 0.117 1
1 1104 . 18 1 1 A 113 113 GLY HA3 H 113 3.785 3.717 0.068 1
1 1105 . 18 1 1 A 113 113 GLY CA C 113 42.435 47.278 -4.843 1
1 1106 . 18 1 1 A 113 113 GLY N N 113 108.745 108.761 -0.016 1
1 2 . 19 1 1 A 3 3 HIS CB C 3 33.709 30.553 3.156 1
1 3 . 19 1 1 A 7 7 HIS H H 7 8.731 8.899 -0.168 1
1 4 . 19 1 1 A 7 7 HIS HA H 7 4.564 4.883 -0.319 1
1 7 . 19 1 1 A 7 7 HIS CA C 7 53.649 54.247 -0.598 1
1 8 . 19 1 1 A 7 7 HIS CB C 7 26.268 28.360 -2.092 1
1 9 . 19 1 1 A 7 7 HIS N N 7 121.126 118.224 2.902 1
1 10 . 19 1 1 A 8 8 GLY H H 8 8.540 8.834 -0.294 1
1 11 . 19 1 1 A 8 8 GLY HA2 H 8 3.973 3.878 0.095 1
1 12 . 19 1 1 A 8 8 GLY HA3 H 8 3.811 3.896 -0.085 1
1 13 . 19 1 1 A 8 8 GLY CA C 8 42.618 45.020 -2.402 1
1 14 . 19 1 1 A 8 8 GLY N N 8 110.662 114.109 -3.447 1
1 15 . 19 1 1 A 9 9 GLU H H 9 8.239 8.364 -0.125 1
1 16 . 19 1 1 A 9 9 GLU HA H 9 4.568 4.047 0.521 1
1 18 . 19 1 1 A 9 9 GLU CA C 9 53.605 55.358 -1.753 1
1 19 . 19 1 1 A 9 9 GLU CB C 9 28.019 30.499 -2.480 1
1 20 . 19 1 1 A 9 9 GLU N N 9 121.669 119.857 1.812 1
1 21 . 19 1 1 A 10 10 PHE H H 10 8.785 8.153 0.632 1
1 22 . 19 1 1 A 10 10 PHE HA H 10 4.850 5.259 -0.409 1
1 25 . 19 1 1 A 10 10 PHE CA C 10 52.630 56.241 -3.611 1
1 26 . 19 1 1 A 10 10 PHE CB C 10 37.906 41.908 -4.002 1
1 27 . 19 1 1 A 10 10 PHE N N 10 118.401 120.817 -2.416 1
1 28 . 19 1 1 A 11 11 GLN H H 11 8.552 9.210 -0.658 1
1 29 . 19 1 1 A 11 11 GLN HA H 11 5.425 5.440 -0.015 1
1 34 . 19 1 1 A 11 11 GLN CA C 11 51.663 54.187 -2.524 1
1 35 . 19 1 1 A 11 11 GLN CB C 11 28.427 31.011 -2.584 1
1 37 . 19 1 1 A 11 11 GLN N N 11 117.519 120.505 -2.986 1
1 38 . 19 1 1 A 12 12 ILE H H 12 8.239 8.388 -0.149 1
1 39 . 19 1 1 A 12 12 ILE HA H 12 4.103 4.963 -0.860 1
1 49 . 19 1 1 A 12 12 ILE CA C 12 57.134 59.552 -2.418 1
1 50 . 19 1 1 A 12 12 ILE CB C 12 39.491 38.850 0.641 1
1 54 . 19 1 1 A 12 12 ILE N N 12 114.043 120.471 -6.428 1
1 55 . 19 1 1 A 13 13 PHE H H 13 8.538 8.684 -0.146 1
1 56 . 19 1 1 A 13 13 PHE HA H 13 5.620 5.298 0.322 1
1 59 . 19 1 1 A 13 13 PHE CA C 13 52.438 56.394 -3.956 1
1 60 . 19 1 1 A 13 13 PHE CB C 13 39.253 42.685 -3.432 1
1 61 . 19 1 1 A 13 13 PHE N N 13 117.015 119.255 -2.240 1
1 62 . 19 1 1 A 14 14 ALA H H 14 9.238 9.506 -0.268 1
1 63 . 19 1 1 A 14 14 ALA HA H 14 5.311 5.742 -0.431 1
1 67 . 19 1 1 A 14 14 ALA CA C 14 47.183 50.073 -2.890 1
1 68 . 19 1 1 A 14 14 ALA CB C 14 17.811 22.738 -4.927 1
1 69 . 19 1 1 A 14 14 ALA N N 14 123.503 124.269 -0.766 1
1 70 . 19 1 1 A 15 15 LYS H H 15 8.810 9.500 -0.690 1
1 71 . 19 1 1 A 15 15 LYS HA H 15 5.511 5.452 0.059 1
1 80 . 19 1 1 A 15 15 LYS CA C 15 51.718 54.636 -2.918 1
1 81 . 19 1 1 A 15 15 LYS CB C 15 33.635 35.661 -2.026 1
1 85 . 19 1 1 A 15 15 LYS N N 15 123.382 122.602 0.780 1
1 86 . 19 1 1 A 16 16 THR H H 16 8.830 8.745 0.085 1
1 87 . 19 1 1 A 16 16 THR HA H 16 5.212 4.773 0.439 1
1 92 . 19 1 1 A 16 16 THR CA C 16 57.614 61.040 -3.426 1
1 93 . 19 1 1 A 16 16 THR CB C 16 68.210 71.046 -2.836 1
1 95 . 19 1 1 A 16 16 THR N N 16 116.517 116.437 0.080 1
1 96 . 19 1 1 A 17 17 LEU H H 17 9.428 8.713 0.715 1
1 97 . 19 1 1 A 17 17 LEU HA H 17 4.286 3.969 0.317 1
1 107 . 19 1 1 A 17 17 LEU CA C 17 54.504 58.378 -3.874 1
1 108 . 19 1 1 A 17 17 LEU CB C 17 38.564 41.294 -2.730 1
1 112 . 19 1 1 A 17 17 LEU N N 17 121.786 123.293 -1.507 1
1 113 . 19 1 1 A 18 18 THR H H 18 7.546 7.829 -0.283 1
1 114 . 19 1 1 A 18 18 THR HA H 18 4.391 4.231 0.160 1
1 119 . 19 1 1 A 18 18 THR CA C 18 58.524 63.430 -4.906 1
1 120 . 19 1 1 A 18 18 THR CB C 18 66.166 70.463 -4.297 1
1 122 . 19 1 1 A 18 18 THR N N 18 105.598 108.905 -3.307 1
1 123 . 19 1 1 A 19 19 GLY H H 19 7.683 7.917 -0.234 1
1 124 . 19 1 1 A 19 19 GLY HA2 H 19 3.300 3.936 -0.636 1
1 125 . 19 1 1 A 19 19 GLY HA3 H 19 4.248 3.955 0.293 1
1 126 . 19 1 1 A 19 19 GLY CA C 19 42.947 45.886 -2.939 1
1 127 . 19 1 1 A 19 19 GLY N N 19 109.243 112.095 -2.852 1
1 128 . 19 1 1 A 20 20 LYS H H 20 7.375 7.965 -0.590 1
1 129 . 19 1 1 A 20 20 LYS HA H 20 4.331 4.627 -0.296 1
1 138 . 19 1 1 A 20 20 LYS CA C 20 53.829 55.133 -1.304 1
1 139 . 19 1 1 A 20 20 LYS CB C 20 30.385 34.119 -3.734 1
1 143 . 19 1 1 A 20 20 LYS N N 20 122.757 120.830 1.927 1
1 144 . 19 1 1 A 21 21 THR H H 21 8.637 8.819 -0.182 1
1 145 . 19 1 1 A 21 21 THR HA H 21 4.852 4.813 0.039 1
1 150 . 19 1 1 A 21 21 THR CA C 21 59.846 62.688 -2.842 1
1 151 . 19 1 1 A 21 21 THR CB C 21 67.140 69.631 -2.491 1
1 153 . 19 1 1 A 21 21 THR N N 21 121.524 123.430 -1.906 1
1 154 . 19 1 1 A 22 22 ILE H H 22 9.509 9.292 0.217 1
1 155 . 19 1 1 A 22 22 ILE HA H 22 4.349 4.860 -0.511 1
1 165 . 19 1 1 A 22 22 ILE CA C 22 57.634 60.255 -2.621 1
1 166 . 19 1 1 A 22 22 ILE CB C 22 38.334 41.832 -3.498 1
1 170 . 19 1 1 A 22 22 ILE N N 22 129.772 127.574 2.198 1
1 171 . 19 1 1 A 23 23 THR H H 23 8.838 8.709 0.129 1
1 172 . 19 1 1 A 23 23 THR HA H 23 4.653 4.556 0.097 1
1 177 . 19 1 1 A 23 23 THR CA C 23 60.194 61.741 -1.547 1
1 178 . 19 1 1 A 23 23 THR CB C 23 66.577 69.442 -2.865 1
1 180 . 19 1 1 A 23 23 THR N N 23 124.070 123.890 0.180 1
1 181 . 19 1 1 A 24 24 LEU H H 24 8.749 8.405 0.344 1
1 182 . 19 1 1 A 24 24 LEU HA H 24 4.619 5.078 -0.459 1
1 192 . 19 1 1 A 24 24 LEU CA C 24 50.257 52.846 -2.589 1
1 193 . 19 1 1 A 24 24 LEU CB C 24 42.932 45.697 -2.765 1
1 197 . 19 1 1 A 24 24 LEU N N 24 126.499 123.450 3.049 1
1 198 . 19 1 1 A 25 25 GLU H H 25 7.990 8.687 -0.697 1
1 199 . 19 1 1 A 25 25 GLU HA H 25 4.591 4.559 0.032 1
1 204 . 19 1 1 A 25 25 GLU CA C 25 52.845 56.194 -3.349 1
1 205 . 19 1 1 A 25 25 GLU CB C 25 27.210 30.241 -3.031 1
1 207 . 19 1 1 A 25 25 GLU N N 25 121.644 122.809 -1.165 1
1 208 . 19 1 1 A 26 26 VAL H H 26 8.657 8.708 -0.051 1
1 209 . 19 1 1 A 26 26 VAL HA H 26 4.403 4.833 -0.430 1
1 217 . 19 1 1 A 26 26 VAL CA C 26 56.020 58.926 -2.906 1
1 218 . 19 1 1 A 26 26 VAL CB C 26 33.631 35.694 -2.063 1
1 221 . 19 1 1 A 26 26 VAL N N 26 116.647 120.566 -3.919 1
1 222 . 19 1 1 A 27 27 GLU H H 27 7.970 8.978 -1.008 1
1 223 . 19 1 1 A 27 27 GLU HA H 27 4.447 4.526 -0.079 1
1 228 . 19 1 1 A 27 27 GLU CA C 27 51.386 56.708 -5.322 1
1 229 . 19 1 1 A 27 27 GLU CB C 27 30.905 30.692 0.213 1
1 231 . 19 1 1 A 27 27 GLU N N 27 115.496 123.339 -7.843 1
1 232 . 19 1 1 A 28 28 SER H H 28 9.192 9.113 0.079 1
1 233 . 19 1 1 A 28 28 SER HA H 28 4.108 4.161 -0.053 1
1 236 . 19 1 1 A 28 28 SER CA C 28 59.909 60.875 -0.966 1
1 237 . 19 1 1 A 28 28 SER CB C 28 60.399 62.675 -2.276 1
1 238 . 19 1 1 A 28 28 SER N N 28 117.720 118.540 -0.820 1
1 239 . 19 1 1 A 29 29 SER H H 29 7.371 7.714 -0.343 1
1 240 . 19 1 1 A 29 29 SER HA H 29 4.327 4.494 -0.167 1
1 243 . 19 1 1 A 29 29 SER CA C 29 54.805 57.117 -2.312 1
1 244 . 19 1 1 A 29 29 SER CB C 29 60.775 64.267 -3.492 1
1 245 . 19 1 1 A 29 29 SER N N 29 108.936 110.266 -1.330 1
1 246 . 19 1 1 A 30 30 ASP H H 30 7.852 7.602 0.250 1
1 247 . 19 1 1 A 30 30 ASP HA H 30 4.591 4.531 0.060 1
1 250 . 19 1 1 A 30 30 ASP CA C 30 53.040 54.730 -1.690 1
1 251 . 19 1 1 A 30 30 ASP CB C 30 37.942 41.662 -3.720 1
1 252 . 19 1 1 A 30 30 ASP N N 30 123.735 124.037 -0.302 1
1 253 . 19 1 1 A 31 31 THR H H 31 7.852 8.488 -0.636 1
1 254 . 19 1 1 A 31 31 THR HA H 31 4.918 4.851 0.067 1
1 259 . 19 1 1 A 31 31 THR CA C 31 56.929 60.206 -3.277 1
1 260 . 19 1 1 A 31 31 THR CB C 31 68.674 71.529 -2.855 1
1 262 . 19 1 1 A 31 31 THR N N 31 109.181 113.037 -3.856 1
1 263 . 19 1 1 A 32 32 ILE H H 32 8.582 8.719 -0.137 1
1 264 . 19 1 1 A 32 32 ILE HA H 32 3.624 3.793 -0.169 1
1 274 . 19 1 1 A 32 32 ILE CA C 32 59.474 65.466 -5.992 1
1 275 . 19 1 1 A 32 32 ILE CB C 32 31.561 37.598 -6.037 1
1 279 . 19 1 1 A 32 32 ILE N N 32 121.833 122.711 -0.878 1
1 280 . 19 1 1 A 33 33 ASP H H 33 9.255 8.440 0.815 1
1 281 . 19 1 1 A 33 33 ASP HA H 33 4.201 4.292 -0.091 1
1 284 . 19 1 1 A 33 33 ASP CA C 33 54.679 57.416 -2.737 1
1 285 . 19 1 1 A 33 33 ASP CB C 33 37.700 40.022 -2.322 1
1 286 . 19 1 1 A 33 33 ASP N N 33 119.823 120.951 -1.128 1
1 287 . 19 1 1 A 34 34 ASN H H 34 8.026 7.791 0.235 1
1 288 . 19 1 1 A 34 34 ASN HA H 34 4.409 4.454 -0.045 1
1 291 . 19 1 1 A 34 34 ASN CA C 34 53.324 56.405 -3.081 1
1 292 . 19 1 1 A 34 34 ASN CB C 34 35.782 39.133 -3.351 1
1 293 . 19 1 1 A 34 34 ASN N N 34 119.540 117.708 1.832 1
1 294 . 19 1 1 A 35 35 VAL H H 35 8.167 8.055 0.112 1
1 295 . 19 1 1 A 35 35 VAL HA H 35 3.249 3.457 -0.208 1
1 303 . 19 1 1 A 35 35 VAL CA C 35 65.308 66.983 -1.675 1
1 304 . 19 1 1 A 35 35 VAL CB C 35 27.965 31.513 -3.548 1
1 307 . 19 1 1 A 35 35 VAL N N 35 122.223 119.997 2.226 1
1 308 . 19 1 1 A 36 36 LYS H H 36 8.460 8.269 0.191 1
1 313 . 19 1 1 A 36 36 LYS CB C 36 30.753 32.234 -1.481 1
1 315 . 19 1 1 A 36 36 LYS N N 36 119.438 119.144 0.294 1
1 316 . 19 1 1 A 37 37 SER H H 37 8.196 8.151 0.045 1
1 317 . 19 1 1 A 37 37 SER HA H 37 4.130 4.072 0.058 1
1 320 . 19 1 1 A 37 37 SER CA C 37 58.528 61.721 -3.193 1
1 321 . 19 1 1 A 37 37 SER CB C 37 59.768 63.039 -3.271 1
1 322 . 19 1 1 A 37 37 SER N N 37 117.791 114.165 3.626 1
1 323 . 19 1 1 A 38 38 LYS H H 38 8.043 8.136 -0.093 1
1 324 . 19 1 1 A 38 38 LYS HA H 38 4.095 3.989 0.106 1
1 325 . 19 1 1 A 38 38 LYS CA C 38 57.377 59.435 -2.058 1
1 326 . 19 1 1 A 38 38 LYS N N 38 124.094 121.016 3.078 1
1 327 . 19 1 1 A 39 39 ILE H H 39 8.254 7.950 0.304 1
1 328 . 19 1 1 A 39 39 ILE HA H 39 3.439 3.686 -0.247 1
1 338 . 19 1 1 A 39 39 ILE CA C 39 63.977 65.246 -1.269 1
1 339 . 19 1 1 A 39 39 ILE CB C 39 33.935 37.622 -3.687 1
1 343 . 19 1 1 A 39 39 ILE N N 39 122.107 120.324 1.783 1
1 344 . 19 1 1 A 40 40 GLN H H 40 8.379 8.283 0.096 1
1 345 . 19 1 1 A 40 40 GLN HA H 40 3.746 4.030 -0.284 1
1 350 . 19 1 1 A 40 40 GLN CA C 40 57.472 58.109 -0.637 1
1 351 . 19 1 1 A 40 40 GLN CB C 40 25.072 28.140 -3.068 1
1 353 . 19 1 1 A 40 40 GLN N N 40 123.725 120.550 3.175 1
1 354 . 19 1 1 A 41 41 ASP H H 41 8.210 7.931 0.279 1
1 355 . 19 1 1 A 41 41 ASP HA H 41 4.247 4.377 -0.130 1
1 358 . 19 1 1 A 41 41 ASP CA C 41 54.646 56.704 -2.058 1
1 359 . 19 1 1 A 41 41 ASP CB C 41 38.136 40.674 -2.538 1
1 360 . 19 1 1 A 41 41 ASP N N 41 120.564 120.679 -0.115 1
1 361 . 19 1 1 A 42 42 LYS H H 42 7.381 7.943 -0.562 1
1 362 . 19 1 1 A 42 42 LYS HA H 42 4.246 4.293 -0.047 1
1 369 . 19 1 1 A 42 42 LYS CA C 42 55.579 58.122 -2.543 1
1 370 . 19 1 1 A 42 42 LYS CB C 42 31.406 33.537 -2.131 1
1 373 . 19 1 1 A 42 42 LYS N N 42 115.674 117.133 -1.459 1
1 374 . 19 1 1 A 43 43 GLU H H 43 8.537 8.555 -0.018 1
1 375 . 19 1 1 A 43 43 GLU HA H 43 4.522 4.556 -0.034 1
1 380 . 19 1 1 A 43 43 GLU CA C 43 52.772 55.557 -2.785 1
1 381 . 19 1 1 A 43 43 GLU CB C 43 30.535 31.087 -0.552 1
1 383 . 19 1 1 A 43 43 GLU N N 43 114.355 116.170 -1.815 1
1 384 . 19 1 1 A 44 44 GLY H H 44 8.611 8.377 0.234 1
1 385 . 19 1 1 A 44 44 GLY HA2 H 44 4.067 3.971 0.096 1
1 386 . 19 1 1 A 44 44 GLY HA3 H 44 3.819 3.972 -0.153 1
1 387 . 19 1 1 A 44 44 GLY CA C 44 43.205 45.380 -2.175 1
1 388 . 19 1 1 A 44 44 GLY N N 44 109.406 108.972 0.434 1
1 389 . 19 1 1 A 45 45 ILE H H 45 6.092 8.131 -2.039 1
1 390 . 19 1 1 A 45 45 ILE HA H 45 4.324 4.123 0.201 1
1 400 . 19 1 1 A 45 45 ILE CA C 45 55.211 60.032 -4.821 1
1 401 . 19 1 1 A 45 45 ILE CB C 45 37.903 38.439 -0.536 1
1 405 . 19 1 1 A 45 45 ILE N N 45 120.791 122.427 -1.636 1
1 406 . 19 1 1 A 46 46 PRO HA H 46 4.547 4.548 -0.001 1
1 413 . 19 1 1 A 46 46 PRO CA C 46 58.971 62.047 -3.076 1
1 414 . 19 1 1 A 46 46 PRO CB C 46 29.142 32.426 -3.284 1
1 417 . 19 1 1 A 47 47 PRO HA H 47 4.062 4.120 -0.058 1
1 424 . 19 1 1 A 47 47 PRO CA C 47 63.476 65.833 -2.357 1
1 425 . 19 1 1 A 47 47 PRO CB C 47 30.113 32.077 -1.964 1
1 428 . 19 1 1 A 48 48 ASP H H 48 8.418 8.375 0.043 1
1 429 . 19 1 1 A 48 48 ASP HA H 48 4.346 4.384 -0.038 1
1 432 . 19 1 1 A 48 48 ASP CA C 48 52.838 57.239 -4.401 1
1 433 . 19 1 1 A 48 48 ASP CB C 48 36.926 40.335 -3.409 1
1 434 . 19 1 1 A 48 48 ASP N N 48 113.462 117.574 -4.112 1
1 435 . 19 1 1 A 49 49 GLN H H 49 7.822 7.912 -0.090 1
1 436 . 19 1 1 A 49 49 GLN HA H 49 4.283 4.090 0.193 1
1 439 . 19 1 1 A 49 49 GLN CA C 49 52.770 58.225 -5.455 1
1 441 . 19 1 1 A 49 49 GLN N N 49 117.377 118.529 -1.152 1
1 442 . 19 1 1 A 50 50 GLN H H 50 7.451 7.374 0.077 1
1 443 . 19 1 1 A 50 50 GLN HA H 50 4.260 5.009 -0.749 1
1 448 . 19 1 1 A 50 50 GLN CA C 50 53.725 54.652 -0.927 1
1 449 . 19 1 1 A 50 50 GLN CB C 50 29.142 31.462 -2.320 1
1 451 . 19 1 1 A 50 50 GLN N N 50 117.526 115.199 2.327 1
1 452 . 19 1 1 A 51 51 ARG H H 51 8.534 8.933 -0.399 1
1 453 . 19 1 1 A 51 51 ARG HA H 51 4.486 5.186 -0.700 1
1 460 . 19 1 1 A 51 51 ARG CA C 51 52.492 54.326 -1.834 1
1 461 . 19 1 1 A 51 51 ARG CB C 51 29.096 34.760 -5.664 1
1 464 . 19 1 1 A 51 51 ARG N N 51 121.655 119.695 1.960 1
1 465 . 19 1 1 A 52 52 LEU H H 52 8.683 8.891 -0.208 1
1 466 . 19 1 1 A 52 52 LEU HA H 52 5.255 4.987 0.268 1
1 476 . 19 1 1 A 52 52 LEU CA C 52 50.618 54.017 -3.399 1
1 477 . 19 1 1 A 52 52 LEU CB C 52 43.007 44.314 -1.307 1
1 481 . 19 1 1 A 52 52 LEU N N 52 122.929 121.292 1.637 1
1 482 . 19 1 1 A 53 53 ILE H H 53 9.286 9.085 0.201 1
1 483 . 19 1 1 A 53 53 ILE HA H 53 5.096 5.027 0.069 1
1 492 . 19 1 1 A 53 53 ILE CA C 53 56.795 60.413 -3.618 1
1 496 . 19 1 1 A 53 53 ILE N N 53 124.718 126.317 -1.599 1
1 497 . 19 1 1 A 54 54 TRP H H 54 8.871 9.104 -0.233 1
1 499 . 19 1 1 A 54 54 TRP N N 54 127.412 128.215 -0.803 1
1 501 . 19 1 1 A 55 55 ALA H H 55 8.401 8.512 -0.111 1
1 502 . 19 1 1 A 55 55 ALA HA H 55 3.183 3.651 -0.468 1
1 506 . 19 1 1 A 55 55 ALA CA C 55 49.712 52.922 -3.210 1
1 507 . 19 1 1 A 55 55 ALA CB C 55 13.252 17.500 -4.248 1
1 508 . 19 1 1 A 55 55 ALA N N 55 128.894 130.234 -1.340 1
1 509 . 19 1 1 A 56 56 GLY H H 56 8.248 8.468 -0.220 1
1 510 . 19 1 1 A 56 56 GLY HA2 H 56 3.968 3.765 0.203 1
1 511 . 19 1 1 A 56 56 GLY HA3 H 56 3.916 3.776 0.140 1
1 512 . 19 1 1 A 56 56 GLY CA C 56 43.142 45.691 -2.549 1
1 513 . 19 1 1 A 56 56 GLY N N 56 101.499 102.426 -0.927 1
1 514 . 19 1 1 A 57 57 LYS H H 57 8.028 7.641 0.387 1
1 515 . 19 1 1 A 57 57 LYS HA H 57 4.609 4.945 -0.336 1
1 522 . 19 1 1 A 57 57 LYS CA C 57 51.928 54.732 -2.804 1
1 523 . 19 1 1 A 57 57 LYS CB C 57 32.613 35.587 -2.974 1
1 526 . 19 1 1 A 57 57 LYS N N 57 118.995 120.643 -1.648 1
1 527 . 19 1 1 A 58 58 GLN H H 58 8.607 8.578 0.029 1
1 528 . 19 1 1 A 58 58 GLN HA H 58 4.617 4.673 -0.056 1
1 533 . 19 1 1 A 58 58 GLN CA C 58 53.261 56.087 -2.826 1
1 534 . 19 1 1 A 58 58 GLN CB C 58 26.613 29.805 -3.192 1
1 536 . 19 1 1 A 58 58 GLN N N 58 119.825 127.103 -7.278 1
1 537 . 19 1 1 A 59 59 LEU H H 59 8.653 8.888 -0.235 1
1 538 . 19 1 1 A 59 59 LEU HA H 59 4.138 4.597 -0.459 1
1 548 . 19 1 1 A 59 59 LEU CA C 59 51.991 54.583 -2.592 1
1 549 . 19 1 1 A 59 59 LEU CB C 59 39.006 42.512 -3.506 1
1 553 . 19 1 1 A 59 59 LEU N N 59 125.484 126.283 -0.799 1
1 554 . 19 1 1 A 60 60 GLU H H 60 8.461 8.353 0.108 1
1 555 . 19 1 1 A 60 60 GLU HA H 60 4.371 4.591 -0.220 1
1 559 . 19 1 1 A 60 60 GLU CA C 60 53.436 56.122 -2.686 1
1 560 . 19 1 1 A 60 60 GLU CB C 60 29.057 33.382 -4.325 1
1 562 . 19 1 1 A 60 60 GLU N N 60 123.237 118.632 4.605 1
1 563 . 19 1 1 A 61 61 ASP H H 61 8.076 9.051 -0.975 1
1 564 . 19 1 1 A 61 61 ASP HA H 61 4.265 4.374 -0.109 1
1 567 . 19 1 1 A 61 61 ASP CA C 61 54.398 56.838 -2.440 1
1 568 . 19 1 1 A 61 61 ASP CB C 61 38.340 39.925 -1.585 1
1 569 . 19 1 1 A 61 61 ASP N N 61 120.701 123.464 -2.763 1
1 570 . 19 1 1 A 62 62 GLY HA2 H 62 4.104 4.009 0.095 1
1 571 . 19 1 1 A 62 62 GLY HA3 H 62 3.832 4.011 -0.179 1
1 572 . 19 1 1 A 62 62 GLY CA C 62 42.576 45.802 -3.226 1
1 573 . 19 1 1 A 63 63 ARG H H 63 7.319 8.207 -0.888 1
1 574 . 19 1 1 A 63 63 ARG HA H 63 4.595 4.535 0.060 1
1 579 . 19 1 1 A 63 63 ARG CA C 63 51.971 55.805 -3.834 1
1 582 . 19 1 1 A 63 63 ARG N N 63 119.206 121.590 -2.384 1
1 583 . 19 1 1 A 64 64 THR H H 64 8.735 8.543 0.192 1
1 584 . 19 1 1 A 64 64 THR HA H 64 5.208 4.959 0.249 1
1 589 . 19 1 1 A 64 64 THR CA C 64 57.126 59.514 -2.388 1
1 590 . 19 1 1 A 64 64 THR CB C 64 69.885 71.982 -2.097 1
1 592 . 19 1 1 A 64 64 THR N N 64 108.713 116.256 -7.543 1
1 593 . 19 1 1 A 65 65 LEU H H 65 8.241 9.403 -1.162 1
1 594 . 19 1 1 A 65 65 LEU HA H 65 4.003 3.947 0.056 1
1 604 . 19 1 1 A 65 65 LEU CA C 65 56.409 57.873 -1.464 1
1 605 . 19 1 1 A 65 65 LEU CB C 65 37.179 41.377 -4.198 1
1 609 . 19 1 1 A 65 65 LEU N N 65 118.111 122.572 -4.461 1
1 610 . 19 1 1 A 66 66 SER H H 66 8.296 7.998 0.298 1
1 611 . 19 1 1 A 66 66 SER HA H 66 4.201 4.267 -0.066 1
1 614 . 19 1 1 A 66 66 SER CA C 66 58.454 60.800 -2.346 1
1 615 . 19 1 1 A 66 66 SER CB C 66 59.969 62.859 -2.890 1
1 616 . 19 1 1 A 66 66 SER N N 66 113.148 113.940 -0.792 1
1 617 . 19 1 1 A 67 67 ASP H H 67 7.984 8.285 -0.301 1
1 618 . 19 1 1 A 67 67 ASP HA H 67 4.187 4.233 -0.046 1
1 621 . 19 1 1 A 67 67 ASP CA C 67 54.744 56.368 -1.624 1
1 622 . 19 1 1 A 67 67 ASP CB C 67 37.794 40.682 -2.888 1
1 623 . 19 1 1 A 67 67 ASP N N 67 124.130 120.785 3.345 1
1 624 . 19 1 1 A 68 68 TYR H H 68 7.177 7.264 -0.087 1
1 625 . 19 1 1 A 68 68 TYR N N 68 115.334 113.666 1.668 1
1 626 . 19 1 1 A 69 69 ASN H H 69 8.111 7.618 0.493 1
1 627 . 19 1 1 A 69 69 ASN HA H 69 4.253 4.362 -0.109 1
1 630 . 19 1 1 A 69 69 ASN CA C 69 51.386 54.294 -2.908 1
1 631 . 19 1 1 A 69 69 ASN CB C 69 34.867 36.431 -1.564 1
1 632 . 19 1 1 A 69 69 ASN N N 69 116.867 114.725 2.142 1
1 633 . 19 1 1 A 70 70 ILE H H 70 7.460 7.686 -0.226 1
1 634 . 19 1 1 A 70 70 ILE HA H 70 3.210 3.947 -0.737 1
1 644 . 19 1 1 A 70 70 ILE CA C 70 60.157 61.857 -1.700 1
1 645 . 19 1 1 A 70 70 ILE CB C 70 34.754 37.641 -2.887 1
1 649 . 19 1 1 A 70 70 ILE N N 70 119.821 119.299 0.522 1
1 650 . 19 1 1 A 71 71 GLN H H 71 7.368 9.018 -1.650 1
1 651 . 19 1 1 A 71 71 GLN HA H 71 4.099 4.535 -0.436 1
1 656 . 19 1 1 A 71 71 GLN CA C 71 50.906 54.802 -3.896 1
1 657 . 19 1 1 A 71 71 GLN CB C 71 28.793 30.089 -1.296 1
1 659 . 19 1 1 A 71 71 GLN N N 71 124.287 126.877 -2.590 1
1 660 . 19 1 1 A 72 72 ARG H H 72 7.583 8.707 -1.124 1
1 661 . 19 1 1 A 72 72 ARG HA H 72 3.907 3.990 -0.083 1
1 668 . 19 1 1 A 72 72 ARG CA C 72 54.527 59.107 -4.580 1
1 669 . 19 1 1 A 72 72 ARG CB C 72 27.470 30.100 -2.630 1
1 672 . 19 1 1 A 72 72 ARG N N 72 119.007 121.542 -2.535 1
1 673 . 19 1 1 A 73 73 GLU H H 73 9.262 8.349 0.913 1
1 674 . 19 1 1 A 73 73 GLU HA H 73 3.586 4.475 -0.889 1
1 679 . 19 1 1 A 73 73 GLU CA C 73 55.703 56.528 -0.825 1
1 680 . 19 1 1 A 73 73 GLU CB C 73 23.669 29.165 -5.496 1
1 682 . 19 1 1 A 73 73 GLU N N 73 115.180 116.812 -1.632 1
1 683 . 19 1 1 A 74 74 SER H H 74 7.551 7.704 -0.153 1
1 684 . 19 1 1 A 74 74 SER HA H 74 4.613 5.221 -0.608 1
1 687 . 19 1 1 A 74 74 SER CA C 74 58.305 56.426 1.879 1
1 688 . 19 1 1 A 74 74 SER CB C 74 62.156 65.877 -3.721 1
1 689 . 19 1 1 A 74 74 SER N N 74 115.104 116.183 -1.079 1
1 690 . 19 1 1 A 75 75 THR H H 75 8.785 9.053 -0.268 1
1 691 . 19 1 1 A 75 75 THR HA H 75 5.014 4.980 0.034 1
1 696 . 19 1 1 A 75 75 THR CA C 75 59.835 62.059 -2.224 1
1 697 . 19 1 1 A 75 75 THR CB C 75 67.258 69.270 -2.012 1
1 699 . 19 1 1 A 75 75 THR N N 75 118.401 121.302 -2.901 1
1 700 . 19 1 1 A 76 76 LEU H H 76 9.447 10.092 -0.645 1
1 701 . 19 1 1 A 76 76 LEU HA H 76 4.930 5.117 -0.187 1
1 711 . 19 1 1 A 76 76 LEU CA C 76 51.107 54.292 -3.185 1
1 712 . 19 1 1 A 76 76 LEU CB C 76 40.841 42.201 -1.360 1
1 716 . 19 1 1 A 76 76 LEU N N 76 127.905 128.289 -0.384 1
1 717 . 19 1 1 A 77 77 HIS HA H 77 4.976 4.784 0.192 1
1 720 . 19 1 1 A 77 77 HIS CA C 77 53.776 55.265 -1.489 1
1 721 . 19 1 1 A 77 77 HIS CB C 77 28.438 30.022 -1.584 1
1 722 . 19 1 1 A 78 78 LEU H H 78 8.450 9.088 -0.638 1
1 723 . 19 1 1 A 78 78 LEU HA H 78 5.085 4.915 0.170 1
1 733 . 19 1 1 A 78 78 LEU CA C 78 50.896 53.829 -2.933 1
1 734 . 19 1 1 A 78 78 LEU CB C 78 41.916 44.913 -2.997 1
1 738 . 19 1 1 A 78 78 LEU N N 78 126.178 128.339 -2.161 1
1 739 . 19 1 1 A 79 79 VAL H H 79 9.093 9.121 -0.028 1
1 740 . 19 1 1 A 79 79 VAL HA H 79 4.053 4.618 -0.565 1
1 748 . 19 1 1 A 79 79 VAL CA C 79 59.054 61.681 -2.627 1
1 749 . 19 1 1 A 79 79 VAL CB C 79 32.115 32.523 -0.408 1
1 752 . 19 1 1 A 79 79 VAL N N 79 128.372 127.337 1.035 1
1 753 . 19 1 1 A 80 80 LEU H H 80 8.000 8.970 -0.970 1
1 754 . 19 1 1 A 80 80 LEU HA H 80 5.105 5.116 -0.011 1
1 764 . 19 1 1 A 80 80 LEU CA C 80 50.556 53.313 -2.757 1
1 765 . 19 1 1 A 80 80 LEU CB C 80 39.597 45.337 -5.740 1
1 769 . 19 1 1 A 80 80 LEU N N 80 126.145 129.678 -3.533 1
1 770 . 19 1 1 A 81 81 ARG H H 81 8.470 8.182 0.288 1
1 771 . 19 1 1 A 81 81 ARG HA H 81 4.197 4.399 -0.202 1
1 778 . 19 1 1 A 81 81 ARG CA C 81 53.133 55.600 -2.467 1
1 779 . 19 1 1 A 81 81 ARG CB C 81 28.413 31.020 -2.607 1
1 782 . 19 1 1 A 81 81 ARG N N 81 121.625 126.631 -5.006 1
1 783 . 19 1 1 A 82 82 LEU H H 82 8.454 8.340 0.114 1
1 784 . 19 1 1 A 82 82 LEU HA H 82 4.339 4.407 -0.068 1
1 794 . 19 1 1 A 82 82 LEU CA C 82 52.081 55.255 -3.174 1
1 795 . 19 1 1 A 82 82 LEU CB C 82 39.810 42.413 -2.603 1
1 799 . 19 1 1 A 82 82 LEU N N 82 123.832 125.320 -1.488 1
1 800 . 19 1 1 A 83 83 ARG H H 83 8.404 8.790 -0.386 1
1 801 . 19 1 1 A 83 83 ARG HA H 83 4.308 4.620 -0.312 1
1 808 . 19 1 1 A 83 83 ARG CA C 83 53.258 55.155 -1.897 1
1 809 . 19 1 1 A 83 83 ARG CB C 83 28.160 30.339 -2.179 1
1 812 . 19 1 1 A 83 83 ARG N N 83 121.447 123.770 -2.323 1
1 813 . 19 1 1 A 84 84 GLY H H 84 8.410 8.866 -0.456 1
1 814 . 19 1 1 A 84 84 GLY HA2 H 84 3.929 3.947 -0.018 1
1 815 . 19 1 1 A 84 84 GLY HA3 H 84 3.929 3.947 -0.018 1
1 816 . 19 1 1 A 84 84 GLY CA C 84 42.751 46.407 -3.656 1
1 817 . 19 1 1 A 84 84 GLY N N 84 110.030 111.224 -1.194 1
1 818 . 19 1 1 A 85 85 GLY H H 85 8.295 7.879 0.416 1
1 819 . 19 1 1 A 85 85 GLY HA2 H 85 3.950 4.123 -0.173 1
1 820 . 19 1 1 A 85 85 GLY HA3 H 85 3.950 4.123 -0.173 1
1 821 . 19 1 1 A 85 85 GLY CA C 85 42.831 45.734 -2.903 1
1 822 . 19 1 1 A 85 85 GLY N N 85 108.838 107.902 0.936 1
1 823 . 19 1 1 A 86 86 SER H H 86 8.292 9.142 -0.850 1
1 824 . 19 1 1 A 86 86 SER HA H 86 4.405 4.157 0.248 1
1 827 . 19 1 1 A 86 86 SER CA C 86 55.965 58.996 -3.031 1
1 828 . 19 1 1 A 86 86 SER CB C 86 61.232 61.412 -0.180 1
1 829 . 19 1 1 A 86 86 SER N N 86 116.028 120.945 -4.917 1
1 830 . 19 1 1 A 87 87 MET H H 87 8.470 8.025 0.445 1
1 831 . 19 1 1 A 87 87 MET HA H 87 4.447 4.195 0.252 1
1 836 . 19 1 1 A 87 87 MET CA C 87 53.281 57.867 -4.586 1
1 837 . 19 1 1 A 87 87 MET CB C 87 29.788 33.108 -3.320 1
1 839 . 19 1 1 A 87 87 MET N N 87 121.625 123.922 -2.297 1
1 840 . 19 1 1 A 88 88 GLY H H 88 8.320 8.347 -0.027 1
1 841 . 19 1 1 A 88 88 GLY HA2 H 88 3.919 3.903 0.016 1
1 842 . 19 1 1 A 88 88 GLY HA3 H 88 3.896 3.904 -0.008 1
1 843 . 19 1 1 A 88 88 GLY CA C 88 43.060 47.327 -4.267 1
1 844 . 19 1 1 A 88 88 GLY N N 88 109.625 107.207 2.418 1
1 845 . 19 1 1 A 89 89 GLY H H 89 8.256 8.039 0.217 1
1 846 . 19 1 1 A 89 89 GLY HA2 H 89 3.940 4.053 -0.113 1
1 847 . 19 1 1 A 89 89 GLY HA3 H 89 3.910 4.053 -0.143 1
1 848 . 19 1 1 A 89 89 GLY CA C 89 42.678 45.439 -2.761 1
1 849 . 19 1 1 A 89 89 GLY N N 89 108.982 108.679 0.303 1
1 850 . 19 1 1 A 90 90 ALA H H 90 8.203 8.154 0.049 1
1 851 . 19 1 1 A 90 90 ALA HA H 90 4.255 4.105 0.150 1
1 855 . 19 1 1 A 90 90 ALA CA C 90 50.763 54.953 -4.190 1
1 856 . 19 1 1 A 90 90 ALA CB C 90 16.364 18.811 -2.447 1
1 857 . 19 1 1 A 90 90 ALA N N 90 124.065 123.167 0.898 1
1 858 . 19 1 1 A 91 91 ALA H H 91 8.273 7.970 0.303 1
1 859 . 19 1 1 A 91 91 ALA HA H 91 4.204 4.615 -0.411 1
1 863 . 19 1 1 A 91 91 ALA CA C 91 51.080 50.963 0.117 1
1 864 . 19 1 1 A 91 91 ALA CB C 91 16.036 21.305 -5.269 1
1 865 . 19 1 1 A 91 91 ALA N N 91 121.985 119.154 2.831 1
1 866 . 19 1 1 A 92 92 ASP H H 92 8.022 8.729 -0.707 1
1 867 . 19 1 1 A 92 92 ASP HA H 92 4.455 4.984 -0.529 1
1 870 . 19 1 1 A 92 92 ASP CA C 92 52.664 53.066 -0.402 1
1 871 . 19 1 1 A 92 92 ASP CB C 92 37.925 41.951 -4.026 1
1 872 . 19 1 1 A 92 92 ASP N N 92 118.621 118.811 -0.190 1
1 873 . 19 1 1 A 93 93 GLU H H 93 8.282 8.251 0.031 1
1 874 . 19 1 1 A 93 93 GLU HA H 93 3.912 3.952 -0.040 1
1 879 . 19 1 1 A 93 93 GLU CA C 93 56.947 57.401 -0.454 1
1 880 . 19 1 1 A 93 93 GLU CB C 93 27.413 28.539 -1.126 1
1 882 . 19 1 1 A 93 93 GLU N N 93 122.247 117.325 4.922 1
1 883 . 19 1 1 A 94 94 GLU H H 94 8.194 7.871 0.323 1
1 884 . 19 1 1 A 94 94 GLU HA H 94 3.940 4.483 -0.543 1
1 889 . 19 1 1 A 94 94 GLU CA C 94 56.681 57.623 -0.942 1
1 890 . 19 1 1 A 94 94 GLU CB C 94 26.127 30.936 -4.809 1
1 892 . 19 1 1 A 94 94 GLU N N 94 118.024 120.656 -2.632 1
1 893 . 19 1 1 A 95 95 GLU H H 95 7.816 8.637 -0.821 1
1 894 . 19 1 1 A 95 95 GLU HA H 95 4.121 4.090 0.031 1
1 898 . 19 1 1 A 95 95 GLU CA C 95 56.162 59.030 -2.868 1
1 899 . 19 1 1 A 95 95 GLU CB C 95 26.403 29.293 -2.890 1
1 901 . 19 1 1 A 95 95 GLU N N 95 120.028 119.902 0.126 1
1 902 . 19 1 1 A 96 96 LEU H H 96 7.637 7.982 -0.345 1
1 903 . 19 1 1 A 96 96 LEU HA H 96 3.988 4.080 -0.092 1
1 913 . 19 1 1 A 96 96 LEU CA C 96 55.303 58.143 -2.840 1
1 914 . 19 1 1 A 96 96 LEU CB C 96 39.038 41.619 -2.581 1
1 918 . 19 1 1 A 96 96 LEU N N 96 119.866 117.847 2.019 1
1 919 . 19 1 1 A 97 97 ILE H H 97 8.044 7.634 0.410 1
1 920 . 19 1 1 A 97 97 ILE HA H 97 3.478 3.656 -0.178 1
1 930 . 19 1 1 A 97 97 ILE CA C 97 62.054 65.307 -3.253 1
1 931 . 19 1 1 A 97 97 ILE CB C 97 34.541 37.668 -3.127 1
1 935 . 19 1 1 A 97 97 ILE N N 97 119.088 119.424 -0.336 1
1 936 . 19 1 1 A 98 98 ARG H H 98 7.991 8.302 -0.311 1
1 937 . 19 1 1 A 98 98 ARG HA H 98 3.793 4.030 -0.237 1
1 944 . 19 1 1 A 98 98 ARG CA C 98 57.509 58.419 -0.910 1
1 945 . 19 1 1 A 98 98 ARG CB C 98 27.191 29.846 -2.655 1
1 948 . 19 1 1 A 98 98 ARG N N 98 119.225 121.102 -1.877 1
1 949 . 19 1 1 A 99 99 LYS H H 99 8.101 8.922 -0.821 1
1 950 . 19 1 1 A 99 99 LYS HA H 99 3.968 4.119 -0.151 1
1 959 . 19 1 1 A 99 99 LYS CA C 99 56.455 58.559 -2.104 1
1 960 . 19 1 1 A 99 99 LYS CB C 99 29.531 32.277 -2.746 1
1 964 . 19 1 1 A 99 99 LYS N N 99 119.464 119.778 -0.314 1
1 965 . 19 1 1 A 100 100 ALA H H 100 8.167 7.793 0.374 1
1 966 . 19 1 1 A 100 100 ALA HA H 100 3.789 4.216 -0.427 1
1 970 . 19 1 1 A 100 100 ALA CA C 100 52.451 54.316 -1.865 1
1 971 . 19 1 1 A 100 100 ALA CB C 100 16.259 18.357 -2.098 1
1 972 . 19 1 1 A 100 100 ALA N N 100 122.398 120.510 1.888 1
1 973 . 19 1 1 A 101 101 ILE H H 101 8.777 7.298 1.479 1
1 974 . 19 1 1 A 101 101 ILE HA H 101 3.191 3.786 -0.595 1
1 984 . 19 1 1 A 101 101 ILE CA C 101 62.910 64.248 -1.338 1
1 985 . 19 1 1 A 101 101 ILE CB C 101 34.544 37.728 -3.184 1
1 989 . 19 1 1 A 101 101 ILE N N 101 120.431 116.935 3.496 1
1 990 . 19 1 1 A 102 102 GLU H H 102 7.890 8.066 -0.176 1
1 991 . 19 1 1 A 102 102 GLU HA H 102 3.848 4.202 -0.354 1
1 996 . 19 1 1 A 102 102 GLU CA C 102 57.079 58.143 -1.064 1
1 997 . 19 1 1 A 102 102 GLU CB C 102 26.769 29.657 -2.888 1
1 999 . 19 1 1 A 102 102 GLU N N 102 120.248 121.438 -1.190 1
1 1000 . 19 1 1 A 103 103 LEU H H 103 8.194 7.465 0.729 1
1 1001 . 19 1 1 A 103 103 LEU HA H 103 3.912 4.294 -0.382 1
1 1011 . 19 1 1 A 103 103 LEU CA C 103 55.078 56.257 -1.179 1
1 1012 . 19 1 1 A 103 103 LEU CB C 103 38.963 42.422 -3.459 1
1 1016 . 19 1 1 A 103 103 LEU N N 103 120.341 117.913 2.428 1
1 1017 . 19 1 1 A 104 104 SER H H 104 8.268 7.858 0.410 1
1 1018 . 19 1 1 A 104 104 SER HA H 104 4.120 4.413 -0.293 1
1 1021 . 19 1 1 A 104 104 SER CA C 104 58.301 59.499 -1.198 1
1 1022 . 19 1 1 A 104 104 SER CB C 104 60.193 64.025 -3.832 1
1 1023 . 19 1 1 A 104 104 SER N N 104 115.150 116.536 -1.386 1
1 1024 . 19 1 1 A 105 105 LEU H H 105 7.501 7.447 0.054 1
1 1025 . 19 1 1 A 105 105 LEU HA H 105 4.041 3.990 0.051 1
1 1035 . 19 1 1 A 105 105 LEU CA C 105 53.995 56.349 -2.354 1
1 1036 . 19 1 1 A 105 105 LEU CB C 105 39.597 41.862 -2.265 1
1 1040 . 19 1 1 A 105 105 LEU N N 105 124.223 119.786 4.437 1
1 1041 . 19 1 1 A 106 106 LYS H H 106 7.542 7.949 -0.407 1
1 1042 . 19 1 1 A 106 106 LYS HA H 106 4.090 4.015 0.075 1
1 1050 . 19 1 1 A 106 106 LYS CA C 106 55.495 58.963 -3.468 1
1 1051 . 19 1 1 A 106 106 LYS CB C 106 29.941 31.865 -1.924 1
1 1055 . 19 1 1 A 106 106 LYS N N 106 120.328 117.477 2.851 1
1 1056 . 19 1 1 A 107 107 GLU H H 107 7.884 8.354 -0.470 1
1 1057 . 19 1 1 A 107 107 GLU HA H 107 4.210 3.992 0.218 1
1 1060 . 19 1 1 A 107 107 GLU CA C 107 54.509 59.603 -5.094 1
1 1061 . 19 1 1 A 107 107 GLU CB C 107 27.239 29.467 -2.228 1
1 1062 . 19 1 1 A 107 107 GLU N N 107 118.621 119.902 -1.281 1
1 1063 . 19 1 1 A 108 108 SER H H 108 7.923 8.779 -0.856 1
1 1064 . 19 1 1 A 108 108 SER HA H 108 4.385 4.107 0.278 1
1 1067 . 19 1 1 A 108 108 SER CA C 108 56.442 60.948 -4.506 1
1 1068 . 19 1 1 A 108 108 SER CB C 108 60.953 62.891 -1.938 1
1 1069 . 19 1 1 A 108 108 SER N N 108 115.670 116.048 -0.378 1
1 1070 . 19 1 1 A 109 109 ARG H H 109 8.068 7.685 0.383 1
1 1071 . 19 1 1 A 109 109 ARG HA H 109 4.307 4.008 0.299 1
1 1078 . 19 1 1 A 109 109 ARG CA C 109 53.732 59.615 -5.883 1
1 1079 . 19 1 1 A 109 109 ARG CB C 109 27.968 29.772 -1.804 1
1 1082 . 19 1 1 A 109 109 ARG N N 109 122.313 122.104 0.209 1
1 1083 . 19 1 1 A 110 110 ASN H H 110 8.292 8.467 -0.175 1
1 1084 . 19 1 1 A 110 110 ASN HA H 110 4.720 4.457 0.263 1
1 1087 . 19 1 1 A 110 110 ASN CA C 110 50.750 56.014 -5.264 1
1 1088 . 19 1 1 A 110 110 ASN CB C 110 36.197 37.883 -1.686 1
1 1089 . 19 1 1 A 110 110 ASN N N 110 119.304 118.374 0.930 1
1 1090 . 19 1 1 A 111 111 SER H H 111 8.244 8.365 -0.121 1
1 1091 . 19 1 1 A 111 111 SER HA H 111 4.423 4.252 0.171 1
1 1094 . 19 1 1 A 111 111 SER CA C 111 55.990 62.286 -6.296 1
1 1095 . 19 1 1 A 111 111 SER CB C 111 61.027 62.705 -1.678 1
1 1096 . 19 1 1 A 111 111 SER N N 111 116.119 116.343 -0.224 1
1 1097 . 19 1 1 A 112 112 GLY H H 112 8.327 8.090 0.237 1
1 1098 . 19 1 1 A 112 112 GLY HA2 H 112 3.944 3.877 0.067 1
1 1099 . 19 1 1 A 112 112 GLY HA3 H 112 3.912 3.890 0.022 1
1 1100 . 19 1 1 A 112 112 GLY CA C 112 42.733 46.416 -3.683 1
1 1101 . 19 1 1 A 112 112 GLY N N 112 110.442 109.109 1.333 1
1 1102 . 19 1 1 A 113 113 GLY H H 113 8.097 8.307 -0.210 1
1 1103 . 19 1 1 A 113 113 GLY HA2 H 113 3.831 3.575 0.256 1
1 1104 . 19 1 1 A 113 113 GLY HA3 H 113 3.785 3.589 0.196 1
1 1105 . 19 1 1 A 113 113 GLY CA C 113 42.435 46.633 -4.198 1
1 1106 . 19 1 1 A 113 113 GLY N N 113 108.745 109.352 -0.607 1
1 2 . 20 1 1 A 3 3 HIS CB C 3 33.709 30.017 3.692 1
1 3 . 20 1 1 A 7 7 HIS H H 7 8.731 8.154 0.577 1
1 4 . 20 1 1 A 7 7 HIS HA H 7 4.564 4.633 -0.069 1
1 7 . 20 1 1 A 7 7 HIS CA C 7 53.649 55.237 -1.588 1
1 8 . 20 1 1 A 7 7 HIS CB C 7 26.268 31.038 -4.770 1
1 9 . 20 1 1 A 7 7 HIS N N 7 121.126 120.576 0.550 1
1 10 . 20 1 1 A 8 8 GLY H H 8 8.540 8.357 0.183 1
1 11 . 20 1 1 A 8 8 GLY HA2 H 8 3.973 4.018 -0.045 1
1 12 . 20 1 1 A 8 8 GLY HA3 H 8 3.811 4.089 -0.278 1
1 13 . 20 1 1 A 8 8 GLY CA C 8 42.618 45.688 -3.070 1
1 14 . 20 1 1 A 8 8 GLY N N 8 110.662 107.187 3.475 1
1 15 . 20 1 1 A 9 9 GLU H H 9 8.239 7.774 0.465 1
1 16 . 20 1 1 A 9 9 GLU HA H 9 4.568 3.755 0.813 1
1 18 . 20 1 1 A 9 9 GLU CA C 9 53.605 54.370 -0.765 1
1 19 . 20 1 1 A 9 9 GLU CB C 9 28.019 31.041 -3.022 1
1 20 . 20 1 1 A 9 9 GLU N N 9 121.669 121.102 0.567 1
1 21 . 20 1 1 A 10 10 PHE H H 10 8.785 8.336 0.449 1
1 22 . 20 1 1 A 10 10 PHE HA H 10 4.850 5.195 -0.345 1
1 25 . 20 1 1 A 10 10 PHE CA C 10 52.630 56.695 -4.065 1
1 26 . 20 1 1 A 10 10 PHE CB C 10 37.906 41.810 -3.904 1
1 27 . 20 1 1 A 10 10 PHE N N 10 118.401 120.033 -1.632 1
1 28 . 20 1 1 A 11 11 GLN H H 11 8.552 9.185 -0.633 1
1 29 . 20 1 1 A 11 11 GLN HA H 11 5.425 5.452 -0.027 1
1 34 . 20 1 1 A 11 11 GLN CA C 11 51.663 54.578 -2.915 1
1 35 . 20 1 1 A 11 11 GLN CB C 11 28.427 30.759 -2.332 1
1 37 . 20 1 1 A 11 11 GLN N N 11 117.519 120.816 -3.297 1
1 38 . 20 1 1 A 12 12 ILE H H 12 8.239 8.278 -0.039 1
1 39 . 20 1 1 A 12 12 ILE HA H 12 4.103 4.569 -0.466 1
1 49 . 20 1 1 A 12 12 ILE CA C 12 57.134 60.725 -3.591 1
1 50 . 20 1 1 A 12 12 ILE CB C 12 39.491 39.206 0.285 1
1 54 . 20 1 1 A 12 12 ILE N N 12 114.043 122.138 -8.095 1
1 55 . 20 1 1 A 13 13 PHE H H 13 8.538 8.743 -0.205 1
1 56 . 20 1 1 A 13 13 PHE HA H 13 5.620 5.228 0.392 1
1 59 . 20 1 1 A 13 13 PHE CA C 13 52.438 55.955 -3.517 1
1 60 . 20 1 1 A 13 13 PHE CB C 13 39.253 41.435 -2.182 1
1 61 . 20 1 1 A 13 13 PHE N N 13 117.015 124.337 -7.322 1
1 62 . 20 1 1 A 14 14 ALA H H 14 9.238 9.892 -0.654 1
1 63 . 20 1 1 A 14 14 ALA HA H 14 5.311 4.975 0.336 1
1 67 . 20 1 1 A 14 14 ALA CA C 14 47.183 50.093 -2.910 1
1 68 . 20 1 1 A 14 14 ALA CB C 14 17.811 21.079 -3.268 1
1 69 . 20 1 1 A 14 14 ALA N N 14 123.503 130.069 -6.566 1
1 70 . 20 1 1 A 15 15 LYS H H 15 8.810 9.351 -0.541 1
1 71 . 20 1 1 A 15 15 LYS HA H 15 5.511 5.327 0.184 1
1 80 . 20 1 1 A 15 15 LYS CA C 15 51.718 54.481 -2.763 1
1 81 . 20 1 1 A 15 15 LYS CB C 15 33.635 34.299 -0.664 1
1 85 . 20 1 1 A 15 15 LYS N N 15 123.382 124.367 -0.985 1
1 86 . 20 1 1 A 16 16 THR H H 16 8.830 8.208 0.622 1
1 87 . 20 1 1 A 16 16 THR HA H 16 5.212 4.968 0.244 1
1 92 . 20 1 1 A 16 16 THR CA C 16 57.614 59.377 -1.763 1
1 93 . 20 1 1 A 16 16 THR CB C 16 68.210 72.101 -3.891 1
1 95 . 20 1 1 A 16 16 THR N N 16 116.517 115.767 0.750 1
1 96 . 20 1 1 A 17 17 LEU H H 17 9.428 8.815 0.613 1
1 97 . 20 1 1 A 17 17 LEU HA H 17 4.286 4.032 0.254 1
1 107 . 20 1 1 A 17 17 LEU CA C 17 54.504 58.559 -4.055 1
1 108 . 20 1 1 A 17 17 LEU CB C 17 38.564 41.506 -2.942 1
1 112 . 20 1 1 A 17 17 LEU N N 17 121.786 123.657 -1.871 1
1 113 . 20 1 1 A 18 18 THR H H 18 7.546 7.834 -0.288 1
1 114 . 20 1 1 A 18 18 THR HA H 18 4.391 4.240 0.151 1
1 119 . 20 1 1 A 18 18 THR CA C 18 58.524 63.451 -4.927 1
1 120 . 20 1 1 A 18 18 THR CB C 18 66.166 70.473 -4.307 1
1 122 . 20 1 1 A 18 18 THR N N 18 105.598 109.002 -3.404 1
1 123 . 20 1 1 A 19 19 GLY H H 19 7.683 8.033 -0.350 1
1 124 . 20 1 1 A 19 19 GLY HA2 H 19 3.300 3.948 -0.648 1
1 125 . 20 1 1 A 19 19 GLY HA3 H 19 4.248 3.972 0.276 1
1 126 . 20 1 1 A 19 19 GLY CA C 19 42.947 45.624 -2.677 1
1 127 . 20 1 1 A 19 19 GLY N N 19 109.243 111.925 -2.682 1
1 128 . 20 1 1 A 20 20 LYS H H 20 7.375 8.306 -0.931 1
1 129 . 20 1 1 A 20 20 LYS HA H 20 4.331 4.592 -0.261 1
1 138 . 20 1 1 A 20 20 LYS CA C 20 53.829 55.424 -1.595 1
1 139 . 20 1 1 A 20 20 LYS CB C 20 30.385 33.887 -3.502 1
1 143 . 20 1 1 A 20 20 LYS N N 20 122.757 121.451 1.306 1
1 144 . 20 1 1 A 21 21 THR H H 21 8.637 8.731 -0.094 1
1 145 . 20 1 1 A 21 21 THR HA H 21 4.852 5.201 -0.349 1
1 150 . 20 1 1 A 21 21 THR CA C 21 59.846 62.358 -2.512 1
1 151 . 20 1 1 A 21 21 THR CB C 21 67.140 69.683 -2.543 1
1 153 . 20 1 1 A 21 21 THR N N 21 121.524 121.717 -0.193 1
1 154 . 20 1 1 A 22 22 ILE H H 22 9.509 9.458 0.051 1
1 155 . 20 1 1 A 22 22 ILE HA H 22 4.349 4.932 -0.583 1
1 165 . 20 1 1 A 22 22 ILE CA C 22 57.634 60.151 -2.517 1
1 166 . 20 1 1 A 22 22 ILE CB C 22 38.334 42.301 -3.967 1
1 170 . 20 1 1 A 22 22 ILE N N 22 129.772 126.989 2.783 1
1 171 . 20 1 1 A 23 23 THR H H 23 8.838 8.748 0.090 1
1 172 . 20 1 1 A 23 23 THR HA H 23 4.653 5.238 -0.585 1
1 177 . 20 1 1 A 23 23 THR CA C 23 60.194 61.736 -1.542 1
1 178 . 20 1 1 A 23 23 THR CB C 23 66.577 70.535 -3.958 1
1 180 . 20 1 1 A 23 23 THR N N 23 124.070 124.706 -0.636 1
1 181 . 20 1 1 A 24 24 LEU H H 24 8.749 8.788 -0.039 1
1 182 . 20 1 1 A 24 24 LEU HA H 24 4.619 5.213 -0.594 1
1 192 . 20 1 1 A 24 24 LEU CA C 24 50.257 52.955 -2.698 1
1 193 . 20 1 1 A 24 24 LEU CB C 24 42.932 45.572 -2.640 1
1 197 . 20 1 1 A 24 24 LEU N N 24 126.499 123.078 3.421 1
1 198 . 20 1 1 A 25 25 GLU H H 25 7.990 8.624 -0.634 1
1 199 . 20 1 1 A 25 25 GLU HA H 25 4.591 4.771 -0.180 1
1 204 . 20 1 1 A 25 25 GLU CA C 25 52.845 56.218 -3.373 1
1 205 . 20 1 1 A 25 25 GLU CB C 25 27.210 30.382 -3.172 1
1 207 . 20 1 1 A 25 25 GLU N N 25 121.644 121.123 0.521 1
1 208 . 20 1 1 A 26 26 VAL H H 26 8.657 8.496 0.161 1
1 209 . 20 1 1 A 26 26 VAL HA H 26 4.403 4.911 -0.508 1
1 217 . 20 1 1 A 26 26 VAL CA C 26 56.020 58.787 -2.767 1
1 218 . 20 1 1 A 26 26 VAL CB C 26 33.631 35.874 -2.243 1
1 221 . 20 1 1 A 26 26 VAL N N 26 116.647 117.571 -0.924 1
1 222 . 20 1 1 A 27 27 GLU H H 27 7.970 9.116 -1.146 1
1 223 . 20 1 1 A 27 27 GLU HA H 27 4.447 4.608 -0.161 1
1 228 . 20 1 1 A 27 27 GLU CA C 27 51.386 56.593 -5.207 1
1 229 . 20 1 1 A 27 27 GLU CB C 27 30.905 30.638 0.267 1
1 231 . 20 1 1 A 27 27 GLU N N 27 115.496 122.031 -6.535 1
1 232 . 20 1 1 A 28 28 SER H H 28 9.192 8.848 0.344 1
1 233 . 20 1 1 A 28 28 SER HA H 28 4.108 4.316 -0.208 1
1 236 . 20 1 1 A 28 28 SER CA C 28 59.909 60.577 -0.668 1
1 237 . 20 1 1 A 28 28 SER CB C 28 60.399 62.920 -2.521 1
1 238 . 20 1 1 A 28 28 SER N N 28 117.720 118.453 -0.733 1
1 239 . 20 1 1 A 29 29 SER H H 29 7.371 7.784 -0.413 1
1 240 . 20 1 1 A 29 29 SER HA H 29 4.327 4.637 -0.310 1
1 243 . 20 1 1 A 29 29 SER CA C 29 54.805 58.010 -3.205 1
1 244 . 20 1 1 A 29 29 SER CB C 29 60.775 64.370 -3.595 1
1 245 . 20 1 1 A 29 29 SER N N 29 108.936 115.874 -6.938 1
1 246 . 20 1 1 A 30 30 ASP H H 30 7.852 7.577 0.275 1
1 247 . 20 1 1 A 30 30 ASP HA H 30 4.591 4.571 0.020 1
1 250 . 20 1 1 A 30 30 ASP CA C 30 53.040 54.736 -1.696 1
1 251 . 20 1 1 A 30 30 ASP CB C 30 37.942 41.226 -3.284 1
1 252 . 20 1 1 A 30 30 ASP N N 30 123.735 123.203 0.532 1
1 253 . 20 1 1 A 31 31 THR H H 31 7.852 8.424 -0.572 1
1 254 . 20 1 1 A 31 31 THR HA H 31 4.918 4.833 0.085 1
1 259 . 20 1 1 A 31 31 THR CA C 31 56.929 60.082 -3.153 1
1 260 . 20 1 1 A 31 31 THR CB C 31 68.674 71.623 -2.949 1
1 262 . 20 1 1 A 31 31 THR N N 31 109.181 112.677 -3.496 1
1 263 . 20 1 1 A 32 32 ILE H H 32 8.582 8.712 -0.130 1
1 264 . 20 1 1 A 32 32 ILE HA H 32 3.624 3.792 -0.168 1
1 274 . 20 1 1 A 32 32 ILE CA C 32 59.474 65.300 -5.826 1
1 275 . 20 1 1 A 32 32 ILE CB C 32 31.561 37.423 -5.862 1
1 279 . 20 1 1 A 32 32 ILE N N 32 121.833 122.829 -0.996 1
1 280 . 20 1 1 A 33 33 ASP H H 33 9.255 8.432 0.823 1
1 281 . 20 1 1 A 33 33 ASP HA H 33 4.201 4.289 -0.088 1
1 284 . 20 1 1 A 33 33 ASP CA C 33 54.679 57.410 -2.731 1
1 285 . 20 1 1 A 33 33 ASP CB C 33 37.700 40.038 -2.338 1
1 286 . 20 1 1 A 33 33 ASP N N 33 119.823 121.071 -1.248 1
1 287 . 20 1 1 A 34 34 ASN H H 34 8.026 7.951 0.075 1
1 288 . 20 1 1 A 34 34 ASN HA H 34 4.409 4.631 -0.222 1
1 291 . 20 1 1 A 34 34 ASN CA C 34 53.324 56.439 -3.115 1
1 292 . 20 1 1 A 34 34 ASN CB C 34 35.782 38.826 -3.044 1
1 293 . 20 1 1 A 34 34 ASN N N 34 119.540 117.648 1.892 1
1 294 . 20 1 1 A 35 35 VAL H H 35 8.167 7.970 0.197 1
1 295 . 20 1 1 A 35 35 VAL HA H 35 3.249 3.460 -0.211 1
1 303 . 20 1 1 A 35 35 VAL CA C 35 65.308 67.348 -2.040 1
1 304 . 20 1 1 A 35 35 VAL CB C 35 27.965 31.512 -3.547 1
1 307 . 20 1 1 A 35 35 VAL N N 35 122.223 120.146 2.077 1
1 308 . 20 1 1 A 36 36 LYS H H 36 8.460 8.330 0.130 1
1 313 . 20 1 1 A 36 36 LYS CB C 36 30.753 32.297 -1.544 1
1 315 . 20 1 1 A 36 36 LYS N N 36 119.438 119.291 0.147 1
1 316 . 20 1 1 A 37 37 SER H H 37 8.196 8.683 -0.487 1
1 317 . 20 1 1 A 37 37 SER HA H 37 4.130 4.187 -0.057 1
1 320 . 20 1 1 A 37 37 SER CA C 37 58.528 61.222 -2.694 1
1 321 . 20 1 1 A 37 37 SER CB C 37 59.768 62.639 -2.871 1
1 322 . 20 1 1 A 37 37 SER N N 37 117.791 114.318 3.473 1
1 323 . 20 1 1 A 38 38 LYS H H 38 8.043 8.084 -0.041 1
1 324 . 20 1 1 A 38 38 LYS HA H 38 4.095 3.993 0.102 1
1 325 . 20 1 1 A 38 38 LYS CA C 38 57.377 59.596 -2.219 1
1 326 . 20 1 1 A 38 38 LYS N N 38 124.094 121.337 2.757 1
1 327 . 20 1 1 A 39 39 ILE H H 39 8.254 8.186 0.068 1
1 328 . 20 1 1 A 39 39 ILE HA H 39 3.439 3.702 -0.263 1
1 338 . 20 1 1 A 39 39 ILE CA C 39 63.977 65.254 -1.277 1
1 339 . 20 1 1 A 39 39 ILE CB C 39 33.935 37.692 -3.757 1
1 343 . 20 1 1 A 39 39 ILE N N 39 122.107 120.333 1.774 1
1 344 . 20 1 1 A 40 40 GLN H H 40 8.379 8.236 0.143 1
1 345 . 20 1 1 A 40 40 GLN HA H 40 3.746 4.023 -0.277 1
1 350 . 20 1 1 A 40 40 GLN CA C 40 57.472 58.061 -0.589 1
1 351 . 20 1 1 A 40 40 GLN CB C 40 25.072 28.453 -3.381 1
1 353 . 20 1 1 A 40 40 GLN N N 40 123.725 120.569 3.156 1
1 354 . 20 1 1 A 41 41 ASP H H 41 8.210 7.888 0.322 1
1 355 . 20 1 1 A 41 41 ASP HA H 41 4.247 4.373 -0.126 1
1 358 . 20 1 1 A 41 41 ASP CA C 41 54.646 56.596 -1.950 1
1 359 . 20 1 1 A 41 41 ASP CB C 41 38.136 40.804 -2.668 1
1 360 . 20 1 1 A 41 41 ASP N N 41 120.564 120.371 0.193 1
1 361 . 20 1 1 A 42 42 LYS H H 42 7.381 7.800 -0.419 1
1 362 . 20 1 1 A 42 42 LYS HA H 42 4.246 4.340 -0.094 1
1 369 . 20 1 1 A 42 42 LYS CA C 42 55.579 57.747 -2.168 1
1 370 . 20 1 1 A 42 42 LYS CB C 42 31.406 33.597 -2.191 1
1 373 . 20 1 1 A 42 42 LYS N N 42 115.674 116.747 -1.073 1
1 374 . 20 1 1 A 43 43 GLU H H 43 8.537 9.055 -0.518 1
1 375 . 20 1 1 A 43 43 GLU HA H 43 4.522 4.555 -0.033 1
1 380 . 20 1 1 A 43 43 GLU CA C 43 52.772 55.561 -2.789 1
1 381 . 20 1 1 A 43 43 GLU CB C 43 30.535 31.140 -0.605 1
1 383 . 20 1 1 A 43 43 GLU N N 43 114.355 116.242 -1.887 1
1 384 . 20 1 1 A 44 44 GLY H H 44 8.611 8.332 0.279 1
1 385 . 20 1 1 A 44 44 GLY HA2 H 44 4.067 3.972 0.095 1
1 386 . 20 1 1 A 44 44 GLY HA3 H 44 3.819 3.973 -0.154 1
1 387 . 20 1 1 A 44 44 GLY CA C 44 43.205 45.374 -2.169 1
1 388 . 20 1 1 A 44 44 GLY N N 44 109.406 108.497 0.909 1
1 389 . 20 1 1 A 45 45 ILE H H 45 6.092 8.088 -1.996 1
1 390 . 20 1 1 A 45 45 ILE HA H 45 4.324 4.104 0.220 1
1 400 . 20 1 1 A 45 45 ILE CA C 45 55.211 60.217 -5.006 1
1 401 . 20 1 1 A 45 45 ILE CB C 45 37.903 38.142 -0.239 1
1 405 . 20 1 1 A 45 45 ILE N N 45 120.791 122.486 -1.695 1
1 406 . 20 1 1 A 46 46 PRO HA H 46 4.547 4.580 -0.033 1
1 413 . 20 1 1 A 46 46 PRO CA C 46 58.971 61.913 -2.942 1
1 414 . 20 1 1 A 46 46 PRO CB C 46 29.142 32.137 -2.995 1
1 417 . 20 1 1 A 47 47 PRO HA H 47 4.062 4.227 -0.165 1
1 424 . 20 1 1 A 47 47 PRO CA C 47 63.476 65.803 -2.327 1
1 425 . 20 1 1 A 47 47 PRO CB C 47 30.113 31.826 -1.713 1
1 428 . 20 1 1 A 48 48 ASP H H 48 8.418 9.106 -0.688 1
1 429 . 20 1 1 A 48 48 ASP HA H 48 4.346 4.352 -0.006 1
1 432 . 20 1 1 A 48 48 ASP CA C 48 52.838 56.414 -3.576 1
1 433 . 20 1 1 A 48 48 ASP CB C 48 36.926 39.595 -2.669 1
1 434 . 20 1 1 A 48 48 ASP N N 48 113.462 117.228 -3.766 1
1 435 . 20 1 1 A 49 49 GLN H H 49 7.822 7.799 0.023 1
1 436 . 20 1 1 A 49 49 GLN HA H 49 4.283 4.105 0.178 1
1 439 . 20 1 1 A 49 49 GLN CA C 49 52.770 57.712 -4.942 1
1 441 . 20 1 1 A 49 49 GLN N N 49 117.377 119.141 -1.764 1
1 442 . 20 1 1 A 50 50 GLN H H 50 7.451 7.768 -0.317 1
1 443 . 20 1 1 A 50 50 GLN HA H 50 4.260 5.135 -0.875 1
1 448 . 20 1 1 A 50 50 GLN CA C 50 53.725 54.701 -0.976 1
1 449 . 20 1 1 A 50 50 GLN CB C 50 29.142 31.212 -2.070 1
1 451 . 20 1 1 A 50 50 GLN N N 50 117.526 118.341 -0.815 1
1 452 . 20 1 1 A 51 51 ARG H H 51 8.534 8.901 -0.367 1
1 453 . 20 1 1 A 51 51 ARG HA H 51 4.486 5.219 -0.733 1
1 460 . 20 1 1 A 51 51 ARG CA C 51 52.492 54.352 -1.860 1
1 461 . 20 1 1 A 51 51 ARG CB C 51 29.096 34.528 -5.432 1
1 464 . 20 1 1 A 51 51 ARG N N 51 121.655 120.287 1.368 1
1 465 . 20 1 1 A 52 52 LEU H H 52 8.683 8.927 -0.244 1
1 466 . 20 1 1 A 52 52 LEU HA H 52 5.255 4.957 0.298 1
1 476 . 20 1 1 A 52 52 LEU CA C 52 50.618 53.943 -3.325 1
1 477 . 20 1 1 A 52 52 LEU CB C 52 43.007 44.079 -1.072 1
1 481 . 20 1 1 A 52 52 LEU N N 52 122.929 121.532 1.397 1
1 482 . 20 1 1 A 53 53 ILE H H 53 9.286 9.060 0.226 1
1 483 . 20 1 1 A 53 53 ILE HA H 53 5.096 4.939 0.157 1
1 492 . 20 1 1 A 53 53 ILE CA C 53 56.795 60.434 -3.639 1
1 496 . 20 1 1 A 53 53 ILE N N 53 124.718 125.858 -1.140 1
1 497 . 20 1 1 A 54 54 TRP H H 54 8.871 9.263 -0.392 1
1 499 . 20 1 1 A 54 54 TRP N N 54 127.412 128.405 -0.993 1
1 501 . 20 1 1 A 55 55 ALA H H 55 8.401 8.570 -0.169 1
1 502 . 20 1 1 A 55 55 ALA HA H 55 3.183 3.440 -0.257 1
1 506 . 20 1 1 A 55 55 ALA CA C 55 49.712 52.468 -2.756 1
1 507 . 20 1 1 A 55 55 ALA CB C 55 13.252 16.475 -3.223 1
1 508 . 20 1 1 A 55 55 ALA N N 55 128.894 130.261 -1.367 1
1 509 . 20 1 1 A 56 56 GLY H H 56 8.248 8.368 -0.120 1
1 510 . 20 1 1 A 56 56 GLY HA2 H 56 3.968 3.699 0.269 1
1 511 . 20 1 1 A 56 56 GLY HA3 H 56 3.916 3.719 0.197 1
1 512 . 20 1 1 A 56 56 GLY CA C 56 43.142 45.513 -2.371 1
1 513 . 20 1 1 A 56 56 GLY N N 56 101.499 102.471 -0.972 1
1 514 . 20 1 1 A 57 57 LYS H H 57 8.028 7.489 0.539 1
1 515 . 20 1 1 A 57 57 LYS HA H 57 4.609 4.678 -0.069 1
1 522 . 20 1 1 A 57 57 LYS CA C 57 51.928 54.680 -2.752 1
1 523 . 20 1 1 A 57 57 LYS CB C 57 32.613 35.029 -2.416 1
1 526 . 20 1 1 A 57 57 LYS N N 57 118.995 121.312 -2.317 1
1 527 . 20 1 1 A 58 58 GLN H H 58 8.607 8.490 0.117 1
1 528 . 20 1 1 A 58 58 GLN HA H 58 4.617 4.418 0.199 1
1 533 . 20 1 1 A 58 58 GLN CA C 58 53.261 55.930 -2.669 1
1 534 . 20 1 1 A 58 58 GLN CB C 58 26.613 28.866 -2.253 1
1 536 . 20 1 1 A 58 58 GLN N N 58 119.825 123.756 -3.931 1
1 537 . 20 1 1 A 59 59 LEU H H 59 8.653 9.354 -0.701 1
1 538 . 20 1 1 A 59 59 LEU HA H 59 4.138 4.487 -0.349 1
1 548 . 20 1 1 A 59 59 LEU CA C 59 51.991 54.412 -2.421 1
1 549 . 20 1 1 A 59 59 LEU CB C 59 39.006 42.396 -3.390 1
1 553 . 20 1 1 A 59 59 LEU N N 59 125.484 125.880 -0.396 1
1 554 . 20 1 1 A 60 60 GLU H H 60 8.461 8.966 -0.505 1
1 555 . 20 1 1 A 60 60 GLU HA H 60 4.371 4.553 -0.182 1
1 559 . 20 1 1 A 60 60 GLU CA C 60 53.436 54.864 -1.428 1
1 560 . 20 1 1 A 60 60 GLU CB C 60 29.057 31.571 -2.514 1
1 562 . 20 1 1 A 60 60 GLU N N 60 123.237 122.172 1.065 1
1 563 . 20 1 1 A 61 61 ASP H H 61 8.076 8.726 -0.650 1
1 564 . 20 1 1 A 61 61 ASP HA H 61 4.265 4.309 -0.044 1
1 567 . 20 1 1 A 61 61 ASP CA C 61 54.398 56.850 -2.452 1
1 568 . 20 1 1 A 61 61 ASP CB C 61 38.340 40.350 -2.010 1
1 569 . 20 1 1 A 61 61 ASP N N 61 120.701 122.175 -1.474 1
1 570 . 20 1 1 A 62 62 GLY HA2 H 62 4.104 3.979 0.125 1
1 571 . 20 1 1 A 62 62 GLY HA3 H 62 3.832 3.980 -0.148 1
1 572 . 20 1 1 A 62 62 GLY CA C 62 42.576 45.615 -3.039 1
1 573 . 20 1 1 A 63 63 ARG H H 63 7.319 8.297 -0.978 1
1 574 . 20 1 1 A 63 63 ARG HA H 63 4.595 4.422 0.173 1
1 579 . 20 1 1 A 63 63 ARG CA C 63 51.971 56.096 -4.125 1
1 582 . 20 1 1 A 63 63 ARG N N 63 119.206 121.504 -2.298 1
1 583 . 20 1 1 A 64 64 THR H H 64 8.735 8.231 0.504 1
1 584 . 20 1 1 A 64 64 THR HA H 64 5.208 4.932 0.276 1
1 589 . 20 1 1 A 64 64 THR CA C 64 57.126 59.667 -2.541 1
1 590 . 20 1 1 A 64 64 THR CB C 64 69.885 71.903 -2.018 1
1 592 . 20 1 1 A 64 64 THR N N 64 108.713 115.615 -6.902 1
1 593 . 20 1 1 A 65 65 LEU H H 65 8.241 9.036 -0.795 1
1 594 . 20 1 1 A 65 65 LEU HA H 65 4.003 3.986 0.017 1
1 604 . 20 1 1 A 65 65 LEU CA C 65 56.409 57.214 -0.805 1
1 605 . 20 1 1 A 65 65 LEU CB C 65 37.179 41.531 -4.352 1
1 609 . 20 1 1 A 65 65 LEU N N 65 118.111 122.276 -4.165 1
1 610 . 20 1 1 A 66 66 SER H H 66 8.296 8.047 0.249 1
1 611 . 20 1 1 A 66 66 SER HA H 66 4.201 4.227 -0.026 1
1 614 . 20 1 1 A 66 66 SER CA C 66 58.454 60.639 -2.185 1
1 615 . 20 1 1 A 66 66 SER CB C 66 59.969 62.867 -2.898 1
1 616 . 20 1 1 A 66 66 SER N N 66 113.148 114.189 -1.041 1
1 617 . 20 1 1 A 67 67 ASP H H 67 7.984 8.172 -0.188 1
1 618 . 20 1 1 A 67 67 ASP HA H 67 4.187 4.255 -0.068 1
1 621 . 20 1 1 A 67 67 ASP CA C 67 54.744 57.382 -2.638 1
1 622 . 20 1 1 A 67 67 ASP CB C 67 37.794 41.045 -3.251 1
1 623 . 20 1 1 A 67 67 ASP N N 67 124.130 121.482 2.648 1
1 624 . 20 1 1 A 68 68 TYR H H 68 7.177 7.603 -0.426 1
1 625 . 20 1 1 A 68 68 TYR N N 68 115.334 121.076 -5.742 1
1 626 . 20 1 1 A 69 69 ASN H H 69 8.111 8.166 -0.055 1
1 627 . 20 1 1 A 69 69 ASN HA H 69 4.253 4.262 -0.009 1
1 630 . 20 1 1 A 69 69 ASN CA C 69 51.386 53.925 -2.539 1
1 631 . 20 1 1 A 69 69 ASN CB C 69 34.867 36.778 -1.911 1
1 632 . 20 1 1 A 69 69 ASN N N 69 116.867 117.829 -0.962 1
1 633 . 20 1 1 A 70 70 ILE H H 70 7.460 8.091 -0.631 1
1 634 . 20 1 1 A 70 70 ILE HA H 70 3.210 4.078 -0.868 1
1 644 . 20 1 1 A 70 70 ILE CA C 70 60.157 61.653 -1.496 1
1 645 . 20 1 1 A 70 70 ILE CB C 70 34.754 37.557 -2.803 1
1 649 . 20 1 1 A 70 70 ILE N N 70 119.821 119.084 0.737 1
1 650 . 20 1 1 A 71 71 GLN H H 71 7.368 8.806 -1.438 1
1 651 . 20 1 1 A 71 71 GLN HA H 71 4.099 4.592 -0.493 1
1 656 . 20 1 1 A 71 71 GLN CA C 71 50.906 54.995 -4.089 1
1 657 . 20 1 1 A 71 71 GLN CB C 71 28.793 29.899 -1.106 1
1 659 . 20 1 1 A 71 71 GLN N N 71 124.287 125.815 -1.528 1
1 660 . 20 1 1 A 72 72 ARG H H 72 7.583 8.702 -1.119 1
1 661 . 20 1 1 A 72 72 ARG HA H 72 3.907 4.443 -0.536 1
1 668 . 20 1 1 A 72 72 ARG CA C 72 54.527 58.011 -3.484 1
1 669 . 20 1 1 A 72 72 ARG CB C 72 27.470 31.531 -4.061 1
1 672 . 20 1 1 A 72 72 ARG N N 72 119.007 120.822 -1.815 1
1 673 . 20 1 1 A 73 73 GLU H H 73 9.262 7.721 1.541 1
1 674 . 20 1 1 A 73 73 GLU HA H 73 3.586 4.531 -0.945 1
1 679 . 20 1 1 A 73 73 GLU CA C 73 55.703 56.457 -0.754 1
1 680 . 20 1 1 A 73 73 GLU CB C 73 23.669 30.100 -6.431 1
1 682 . 20 1 1 A 73 73 GLU N N 73 115.180 118.247 -3.067 1
1 683 . 20 1 1 A 74 74 SER H H 74 7.551 7.739 -0.188 1
1 684 . 20 1 1 A 74 74 SER HA H 74 4.613 5.101 -0.488 1
1 687 . 20 1 1 A 74 74 SER CA C 74 58.305 56.776 1.529 1
1 688 . 20 1 1 A 74 74 SER CB C 74 62.156 64.546 -2.390 1
1 689 . 20 1 1 A 74 74 SER N N 74 115.104 114.883 0.221 1
1 690 . 20 1 1 A 75 75 THR H H 75 8.785 8.934 -0.149 1
1 691 . 20 1 1 A 75 75 THR HA H 75 5.014 4.410 0.604 1
1 696 . 20 1 1 A 75 75 THR CA C 75 59.835 62.464 -2.629 1
1 697 . 20 1 1 A 75 75 THR CB C 75 67.258 68.397 -1.139 1
1 699 . 20 1 1 A 75 75 THR N N 75 118.401 121.701 -3.300 1
1 700 . 20 1 1 A 76 76 LEU H H 76 9.447 9.556 -0.109 1
1 701 . 20 1 1 A 76 76 LEU HA H 76 4.930 4.636 0.294 1
1 711 . 20 1 1 A 76 76 LEU CA C 76 51.107 54.352 -3.245 1
1 712 . 20 1 1 A 76 76 LEU CB C 76 40.841 42.681 -1.840 1
1 716 . 20 1 1 A 76 76 LEU N N 76 127.905 127.995 -0.090 1
1 717 . 20 1 1 A 77 77 HIS HA H 77 4.976 5.207 -0.231 1
1 720 . 20 1 1 A 77 77 HIS CA C 77 53.776 54.006 -0.230 1
1 721 . 20 1 1 A 77 77 HIS CB C 77 28.438 31.680 -3.242 1
1 722 . 20 1 1 A 78 78 LEU H H 78 8.450 9.535 -1.085 1
1 723 . 20 1 1 A 78 78 LEU HA H 78 5.085 5.055 0.030 1
1 733 . 20 1 1 A 78 78 LEU CA C 78 50.896 53.813 -2.917 1
1 734 . 20 1 1 A 78 78 LEU CB C 78 41.916 44.883 -2.967 1
1 738 . 20 1 1 A 78 78 LEU N N 78 126.178 126.762 -0.584 1
1 739 . 20 1 1 A 79 79 VAL H H 79 9.093 9.717 -0.624 1
1 740 . 20 1 1 A 79 79 VAL HA H 79 4.053 4.755 -0.702 1
1 748 . 20 1 1 A 79 79 VAL CA C 79 59.054 61.185 -2.131 1
1 749 . 20 1 1 A 79 79 VAL CB C 79 32.115 33.077 -0.962 1
1 752 . 20 1 1 A 79 79 VAL N N 79 128.372 127.596 0.776 1
1 753 . 20 1 1 A 80 80 LEU H H 80 8.000 8.997 -0.997 1
1 754 . 20 1 1 A 80 80 LEU HA H 80 5.105 4.967 0.138 1
1 764 . 20 1 1 A 80 80 LEU CA C 80 50.556 53.605 -3.049 1
1 765 . 20 1 1 A 80 80 LEU CB C 80 39.597 42.854 -3.257 1
1 769 . 20 1 1 A 80 80 LEU N N 80 126.145 128.099 -1.954 1
1 770 . 20 1 1 A 81 81 ARG H H 81 8.470 8.438 0.032 1
1 771 . 20 1 1 A 81 81 ARG HA H 81 4.197 4.294 -0.097 1
1 778 . 20 1 1 A 81 81 ARG CA C 81 53.133 55.897 -2.764 1
1 779 . 20 1 1 A 81 81 ARG CB C 81 28.413 30.598 -2.185 1
1 782 . 20 1 1 A 81 81 ARG N N 81 121.625 124.677 -3.052 1
1 783 . 20 1 1 A 82 82 LEU H H 82 8.454 8.549 -0.095 1
1 784 . 20 1 1 A 82 82 LEU HA H 82 4.339 4.636 -0.297 1
1 794 . 20 1 1 A 82 82 LEU CA C 82 52.081 53.511 -1.430 1
1 795 . 20 1 1 A 82 82 LEU CB C 82 39.810 43.573 -3.763 1
1 799 . 20 1 1 A 82 82 LEU N N 82 123.832 123.881 -0.049 1
1 800 . 20 1 1 A 83 83 ARG H H 83 8.404 8.880 -0.476 1
1 801 . 20 1 1 A 83 83 ARG HA H 83 4.308 4.527 -0.219 1
1 808 . 20 1 1 A 83 83 ARG CA C 83 53.258 56.225 -2.967 1
1 809 . 20 1 1 A 83 83 ARG CB C 83 28.160 31.335 -3.175 1
1 812 . 20 1 1 A 83 83 ARG N N 83 121.447 121.965 -0.518 1
1 813 . 20 1 1 A 84 84 GLY H H 84 8.410 7.352 1.058 1
1 814 . 20 1 1 A 84 84 GLY HA2 H 84 3.929 4.103 -0.174 1
1 815 . 20 1 1 A 84 84 GLY HA3 H 84 3.929 4.103 -0.174 1
1 816 . 20 1 1 A 84 84 GLY CA C 84 42.751 45.129 -2.378 1
1 817 . 20 1 1 A 84 84 GLY N N 84 110.030 106.586 3.444 1
1 818 . 20 1 1 A 85 85 GLY H H 85 8.295 8.538 -0.243 1
1 819 . 20 1 1 A 85 85 GLY HA2 H 85 3.950 3.862 0.088 1
1 820 . 20 1 1 A 85 85 GLY HA3 H 85 3.950 3.862 0.088 1
1 821 . 20 1 1 A 85 85 GLY CA C 85 42.831 47.225 -4.394 1
1 822 . 20 1 1 A 85 85 GLY N N 85 108.838 108.900 -0.062 1
1 823 . 20 1 1 A 86 86 SER H H 86 8.292 8.331 -0.039 1
1 824 . 20 1 1 A 86 86 SER HA H 86 4.405 4.559 -0.154 1
1 827 . 20 1 1 A 86 86 SER CA C 86 55.965 58.276 -2.311 1
1 828 . 20 1 1 A 86 86 SER CB C 86 61.232 64.167 -2.935 1
1 829 . 20 1 1 A 86 86 SER N N 86 116.028 120.748 -4.720 1
1 830 . 20 1 1 A 87 87 MET H H 87 8.470 8.962 -0.492 1
1 831 . 20 1 1 A 87 87 MET HA H 87 4.447 4.484 -0.037 1
1 836 . 20 1 1 A 87 87 MET CA C 87 53.281 55.796 -2.515 1
1 837 . 20 1 1 A 87 87 MET CB C 87 29.788 33.642 -3.854 1
1 839 . 20 1 1 A 87 87 MET N N 87 121.625 125.786 -4.161 1
1 840 . 20 1 1 A 88 88 GLY H H 88 8.320 9.460 -1.140 1
1 841 . 20 1 1 A 88 88 GLY HA2 H 88 3.919 3.898 0.021 1
1 842 . 20 1 1 A 88 88 GLY HA3 H 88 3.896 3.898 -0.002 1
1 843 . 20 1 1 A 88 88 GLY CA C 88 43.060 46.709 -3.649 1
1 844 . 20 1 1 A 88 88 GLY N N 88 109.625 109.028 0.597 1
1 845 . 20 1 1 A 89 89 GLY H H 89 8.256 7.855 0.401 1
1 846 . 20 1 1 A 89 89 GLY HA2 H 89 3.940 4.111 -0.171 1
1 847 . 20 1 1 A 89 89 GLY HA3 H 89 3.910 4.112 -0.202 1
1 848 . 20 1 1 A 89 89 GLY CA C 89 42.678 46.180 -3.502 1
1 849 . 20 1 1 A 89 89 GLY N N 89 108.982 105.381 3.601 1
1 850 . 20 1 1 A 90 90 ALA H H 90 8.203 8.325 -0.122 1
1 851 . 20 1 1 A 90 90 ALA HA H 90 4.255 4.091 0.164 1
1 855 . 20 1 1 A 90 90 ALA CA C 90 50.763 54.722 -3.959 1
1 856 . 20 1 1 A 90 90 ALA CB C 90 16.364 18.560 -2.196 1
1 857 . 20 1 1 A 90 90 ALA N N 90 124.065 129.605 -5.540 1
1 858 . 20 1 1 A 91 91 ALA H H 91 8.273 7.685 0.588 1
1 859 . 20 1 1 A 91 91 ALA HA H 91 4.204 4.274 -0.070 1
1 863 . 20 1 1 A 91 91 ALA CA C 91 51.080 53.001 -1.921 1
1 864 . 20 1 1 A 91 91 ALA CB C 91 16.036 19.265 -3.229 1
1 865 . 20 1 1 A 91 91 ALA N N 91 121.985 120.146 1.839 1
1 866 . 20 1 1 A 92 92 ASP H H 92 8.022 8.668 -0.646 1
1 867 . 20 1 1 A 92 92 ASP HA H 92 4.455 4.970 -0.515 1
1 870 . 20 1 1 A 92 92 ASP CA C 92 52.664 53.120 -0.456 1
1 871 . 20 1 1 A 92 92 ASP CB C 92 37.925 41.784 -3.859 1
1 872 . 20 1 1 A 92 92 ASP N N 92 118.621 123.444 -4.823 1
1 873 . 20 1 1 A 93 93 GLU H H 93 8.282 8.308 -0.026 1
1 874 . 20 1 1 A 93 93 GLU HA H 93 3.912 4.252 -0.340 1
1 879 . 20 1 1 A 93 93 GLU CA C 93 56.947 58.568 -1.621 1
1 880 . 20 1 1 A 93 93 GLU CB C 93 27.413 29.457 -2.044 1
1 882 . 20 1 1 A 93 93 GLU N N 93 122.247 117.616 4.631 1
1 883 . 20 1 1 A 94 94 GLU H H 94 8.194 8.517 -0.323 1
1 884 . 20 1 1 A 94 94 GLU HA H 94 3.940 4.143 -0.203 1
1 889 . 20 1 1 A 94 94 GLU CA C 94 56.681 58.794 -2.113 1
1 890 . 20 1 1 A 94 94 GLU CB C 94 26.127 30.001 -3.874 1
1 892 . 20 1 1 A 94 94 GLU N N 94 118.024 119.346 -1.322 1
1 893 . 20 1 1 A 95 95 GLU H H 95 7.816 8.232 -0.416 1
1 894 . 20 1 1 A 95 95 GLU HA H 95 4.121 4.003 0.118 1
1 898 . 20 1 1 A 95 95 GLU CA C 95 56.162 59.156 -2.994 1
1 899 . 20 1 1 A 95 95 GLU CB C 95 26.403 29.391 -2.988 1
1 901 . 20 1 1 A 95 95 GLU N N 95 120.028 118.427 1.601 1
1 902 . 20 1 1 A 96 96 LEU H H 96 7.637 8.096 -0.459 1
1 903 . 20 1 1 A 96 96 LEU HA H 96 3.988 4.086 -0.098 1
1 913 . 20 1 1 A 96 96 LEU CA C 96 55.303 57.874 -2.571 1
1 914 . 20 1 1 A 96 96 LEU CB C 96 39.038 41.619 -2.581 1
1 918 . 20 1 1 A 96 96 LEU N N 96 119.866 118.813 1.053 1
1 919 . 20 1 1 A 97 97 ILE H H 97 8.044 7.387 0.657 1
1 920 . 20 1 1 A 97 97 ILE HA H 97 3.478 3.855 -0.377 1
1 930 . 20 1 1 A 97 97 ILE CA C 97 62.054 64.353 -2.299 1
1 931 . 20 1 1 A 97 97 ILE CB C 97 34.541 38.151 -3.610 1
1 935 . 20 1 1 A 97 97 ILE N N 97 119.088 119.444 -0.356 1
1 936 . 20 1 1 A 98 98 ARG H H 98 7.991 8.134 -0.143 1
1 937 . 20 1 1 A 98 98 ARG HA H 98 3.793 3.987 -0.194 1
1 944 . 20 1 1 A 98 98 ARG CA C 98 57.509 58.952 -1.443 1
1 945 . 20 1 1 A 98 98 ARG CB C 98 27.191 30.225 -3.034 1
1 948 . 20 1 1 A 98 98 ARG N N 98 119.225 120.607 -1.382 1
1 949 . 20 1 1 A 99 99 LYS H H 99 8.101 7.953 0.148 1
1 950 . 20 1 1 A 99 99 LYS HA H 99 3.968 4.057 -0.089 1
1 959 . 20 1 1 A 99 99 LYS CA C 99 56.455 59.046 -2.591 1
1 960 . 20 1 1 A 99 99 LYS CB C 99 29.531 31.835 -2.304 1
1 964 . 20 1 1 A 99 99 LYS N N 99 119.464 117.796 1.668 1
1 965 . 20 1 1 A 100 100 ALA H H 100 8.167 8.022 0.145 1
1 966 . 20 1 1 A 100 100 ALA HA H 100 3.789 4.127 -0.338 1
1 970 . 20 1 1 A 100 100 ALA CA C 100 52.451 54.396 -1.945 1
1 971 . 20 1 1 A 100 100 ALA CB C 100 16.259 18.221 -1.962 1
1 972 . 20 1 1 A 100 100 ALA N N 100 122.398 121.741 0.657 1
1 973 . 20 1 1 A 101 101 ILE H H 101 8.777 7.690 1.087 1
1 974 . 20 1 1 A 101 101 ILE HA H 101 3.191 3.735 -0.544 1
1 984 . 20 1 1 A 101 101 ILE CA C 101 62.910 64.564 -1.654 1
1 985 . 20 1 1 A 101 101 ILE CB C 101 34.544 37.192 -2.648 1
1 989 . 20 1 1 A 101 101 ILE N N 101 120.431 117.793 2.638 1
1 990 . 20 1 1 A 102 102 GLU H H 102 7.890 7.648 0.242 1
1 991 . 20 1 1 A 102 102 GLU HA H 102 3.848 4.181 -0.333 1
1 996 . 20 1 1 A 102 102 GLU CA C 102 57.079 57.846 -0.767 1
1 997 . 20 1 1 A 102 102 GLU CB C 102 26.769 30.086 -3.317 1
1 999 . 20 1 1 A 102 102 GLU N N 102 120.248 120.112 0.136 1
1 1000 . 20 1 1 A 103 103 LEU H H 103 8.194 7.580 0.614 1
1 1001 . 20 1 1 A 103 103 LEU HA H 103 3.912 4.310 -0.398 1
1 1011 . 20 1 1 A 103 103 LEU CA C 103 55.078 56.223 -1.145 1
1 1012 . 20 1 1 A 103 103 LEU CB C 103 38.963 42.501 -3.538 1
1 1016 . 20 1 1 A 103 103 LEU N N 103 120.341 117.182 3.159 1
1 1017 . 20 1 1 A 104 104 SER H H 104 8.268 8.057 0.211 1
1 1018 . 20 1 1 A 104 104 SER HA H 104 4.120 4.417 -0.297 1
1 1021 . 20 1 1 A 104 104 SER CA C 104 58.301 58.774 -0.473 1
1 1022 . 20 1 1 A 104 104 SER CB C 104 60.193 63.565 -3.372 1
1 1023 . 20 1 1 A 104 104 SER N N 104 115.150 114.813 0.337 1
1 1024 . 20 1 1 A 105 105 LEU H H 105 7.501 7.624 -0.123 1
1 1025 . 20 1 1 A 105 105 LEU HA H 105 4.041 3.998 0.043 1
1 1035 . 20 1 1 A 105 105 LEU CA C 105 53.995 56.779 -2.784 1
1 1036 . 20 1 1 A 105 105 LEU CB C 105 39.597 41.991 -2.394 1
1 1040 . 20 1 1 A 105 105 LEU N N 105 124.223 119.495 4.728 1
1 1041 . 20 1 1 A 106 106 LYS H H 106 7.542 7.990 -0.448 1
1 1042 . 20 1 1 A 106 106 LYS HA H 106 4.090 3.972 0.118 1
1 1050 . 20 1 1 A 106 106 LYS CA C 106 55.495 58.787 -3.292 1
1 1051 . 20 1 1 A 106 106 LYS CB C 106 29.941 31.732 -1.791 1
1 1055 . 20 1 1 A 106 106 LYS N N 106 120.328 118.282 2.046 1
1 1056 . 20 1 1 A 107 107 GLU H H 107 7.884 8.218 -0.334 1
1 1057 . 20 1 1 A 107 107 GLU HA H 107 4.210 4.037 0.173 1
1 1060 . 20 1 1 A 107 107 GLU CA C 107 54.509 59.150 -4.641 1
1 1061 . 20 1 1 A 107 107 GLU CB C 107 27.239 29.372 -2.133 1
1 1062 . 20 1 1 A 107 107 GLU N N 107 118.621 120.310 -1.689 1
1 1063 . 20 1 1 A 108 108 SER H H 108 7.923 8.531 -0.608 1
1 1064 . 20 1 1 A 108 108 SER HA H 108 4.385 4.225 0.160 1
1 1067 . 20 1 1 A 108 108 SER CA C 108 56.442 61.201 -4.759 1
1 1068 . 20 1 1 A 108 108 SER CB C 108 60.953 62.311 -1.358 1
1 1069 . 20 1 1 A 108 108 SER N N 108 115.670 115.382 0.288 1
1 1070 . 20 1 1 A 109 109 ARG H H 109 8.068 7.617 0.451 1
1 1071 . 20 1 1 A 109 109 ARG HA H 109 4.307 4.089 0.218 1
1 1078 . 20 1 1 A 109 109 ARG CA C 109 53.732 58.831 -5.099 1
1 1079 . 20 1 1 A 109 109 ARG CB C 109 27.968 29.959 -1.991 1
1 1082 . 20 1 1 A 109 109 ARG N N 109 122.313 121.471 0.842 1
1 1083 . 20 1 1 A 110 110 ASN H H 110 8.292 8.020 0.272 1
1 1084 . 20 1 1 A 110 110 ASN HA H 110 4.720 4.556 0.164 1
1 1087 . 20 1 1 A 110 110 ASN CA C 110 50.750 54.757 -4.007 1
1 1088 . 20 1 1 A 110 110 ASN CB C 110 36.197 38.218 -2.021 1
1 1089 . 20 1 1 A 110 110 ASN N N 110 119.304 116.774 2.530 1
1 1090 . 20 1 1 A 111 111 SER H H 111 8.244 7.795 0.449 1
1 1091 . 20 1 1 A 111 111 SER HA H 111 4.423 4.218 0.205 1
1 1094 . 20 1 1 A 111 111 SER CA C 111 55.990 62.212 -6.222 1
1 1095 . 20 1 1 A 111 111 SER CB C 111 61.027 63.003 -1.976 1
1 1096 . 20 1 1 A 111 111 SER N N 111 116.119 115.573 0.546 1
1 1097 . 20 1 1 A 112 112 GLY H H 112 8.327 8.150 0.177 1
1 1098 . 20 1 1 A 112 112 GLY HA2 H 112 3.944 3.609 0.335 1
1 1099 . 20 1 1 A 112 112 GLY HA3 H 112 3.912 3.721 0.191 1
1 1100 . 20 1 1 A 112 112 GLY CA C 112 42.733 46.692 -3.959 1
1 1101 . 20 1 1 A 112 112 GLY N N 112 110.442 109.493 0.949 1
1 1102 . 20 1 1 A 113 113 GLY H H 113 8.097 7.674 0.423 1
1 1103 . 20 1 1 A 113 113 GLY HA2 H 113 3.831 3.792 0.039 1
1 1104 . 20 1 1 A 113 113 GLY HA3 H 113 3.785 3.864 -0.079 1
1 1105 . 20 1 1 A 113 113 GLY CA C 113 42.435 45.895 -3.460 1
1 1106 . 20 1 1 A 113 113 GLY N N 113 108.745 108.728 0.017 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 0 0.000 1
2 1 1 1 "RMS(OBS, PRED)" CA 104 2.980 1
3 1 1 1 "RMS(OBS, PRED)" CB 91 3.087 1
4 1 1 1 "RMS(OBS, PRED)" H 103 0.533 1
5 1 1 1 "RMS(OBS, PRED)" HA 115 0.340 1
6 1 1 1 "RMS(OBS, PRED)" N 103 2.508 1
7 1 2 1 "RMS(OBS, PRED)" C 0 0.000 1
8 1 2 1 "RMS(OBS, PRED)" CA 104 3.094 1
9 1 2 1 "RMS(OBS, PRED)" CB 91 3.127 1
10 1 2 1 "RMS(OBS, PRED)" H 103 0.519 1
11 1 2 1 "RMS(OBS, PRED)" HA 115 0.304 1
12 1 2 1 "RMS(OBS, PRED)" N 103 2.660 1
13 1 3 1 "RMS(OBS, PRED)" C 0 0.000 1
14 1 3 1 "RMS(OBS, PRED)" CA 104 2.893 1
15 1 3 1 "RMS(OBS, PRED)" CB 91 3.155 1
16 1 3 1 "RMS(OBS, PRED)" H 103 0.543 1
17 1 3 1 "RMS(OBS, PRED)" HA 115 0.331 1
18 1 3 1 "RMS(OBS, PRED)" N 103 2.713 1
19 1 4 1 "RMS(OBS, PRED)" C 0 0.000 1
20 1 4 1 "RMS(OBS, PRED)" CA 104 2.975 1
21 1 4 1 "RMS(OBS, PRED)" CB 91 3.156 1
22 1 4 1 "RMS(OBS, PRED)" H 103 0.573 1
23 1 4 1 "RMS(OBS, PRED)" HA 115 0.290 1
24 1 4 1 "RMS(OBS, PRED)" N 103 2.644 1
25 1 5 1 "RMS(OBS, PRED)" C 0 0.000 1
26 1 5 1 "RMS(OBS, PRED)" CA 104 2.968 1
27 1 5 1 "RMS(OBS, PRED)" CB 91 3.022 1
28 1 5 1 "RMS(OBS, PRED)" H 103 0.572 1
29 1 5 1 "RMS(OBS, PRED)" HA 115 0.316 1
30 1 5 1 "RMS(OBS, PRED)" N 103 2.411 1
31 1 6 1 "RMS(OBS, PRED)" C 0 0.000 1
32 1 6 1 "RMS(OBS, PRED)" CA 104 2.911 1
33 1 6 1 "RMS(OBS, PRED)" CB 91 3.085 1
34 1 6 1 "RMS(OBS, PRED)" H 103 0.509 1
35 1 6 1 "RMS(OBS, PRED)" HA 115 0.314 1
36 1 6 1 "RMS(OBS, PRED)" N 103 2.515 1
37 1 7 1 "RMS(OBS, PRED)" C 0 0.000 1
38 1 7 1 "RMS(OBS, PRED)" CA 104 2.903 1
39 1 7 1 "RMS(OBS, PRED)" CB 91 3.152 1
40 1 7 1 "RMS(OBS, PRED)" H 103 0.549 1
41 1 7 1 "RMS(OBS, PRED)" HA 115 0.310 1
42 1 7 1 "RMS(OBS, PRED)" N 103 3.023 1
43 1 8 1 "RMS(OBS, PRED)" C 0 0.000 1
44 1 8 1 "RMS(OBS, PRED)" CA 104 3.019 1
45 1 8 1 "RMS(OBS, PRED)" CB 91 3.166 1
46 1 8 1 "RMS(OBS, PRED)" H 103 0.573 1
47 1 8 1 "RMS(OBS, PRED)" HA 115 0.323 1
48 1 8 1 "RMS(OBS, PRED)" N 103 2.733 1
49 1 9 1 "RMS(OBS, PRED)" C 0 0.000 1
50 1 9 1 "RMS(OBS, PRED)" CA 104 2.999 1
51 1 9 1 "RMS(OBS, PRED)" CB 91 3.125 1
52 1 9 1 "RMS(OBS, PRED)" H 103 0.566 1
53 1 9 1 "RMS(OBS, PRED)" HA 115 0.317 1
54 1 9 1 "RMS(OBS, PRED)" N 103 2.625 1
55 1 10 1 "RMS(OBS, PRED)" C 0 0.000 1
56 1 10 1 "RMS(OBS, PRED)" CA 104 3.025 1
57 1 10 1 "RMS(OBS, PRED)" CB 91 3.202 1
58 1 10 1 "RMS(OBS, PRED)" H 103 0.530 1
59 1 10 1 "RMS(OBS, PRED)" HA 115 0.313 1
60 1 10 1 "RMS(OBS, PRED)" N 103 2.686 1
61 1 11 1 "RMS(OBS, PRED)" C 0 0.000 1
62 1 11 1 "RMS(OBS, PRED)" CA 104 3.034 1
63 1 11 1 "RMS(OBS, PRED)" CB 91 3.058 1
64 1 11 1 "RMS(OBS, PRED)" H 103 0.545 1
65 1 11 1 "RMS(OBS, PRED)" HA 115 0.339 1
66 1 11 1 "RMS(OBS, PRED)" N 103 2.585 1
67 1 12 1 "RMS(OBS, PRED)" C 0 0.000 1
68 1 12 1 "RMS(OBS, PRED)" CA 104 2.869 1
69 1 12 1 "RMS(OBS, PRED)" CB 91 3.080 1
70 1 12 1 "RMS(OBS, PRED)" H 103 0.569 1
71 1 12 1 "RMS(OBS, PRED)" HA 115 0.295 1
72 1 12 1 "RMS(OBS, PRED)" N 103 2.554 1
73 1 13 1 "RMS(OBS, PRED)" C 0 0.000 1
74 1 13 1 "RMS(OBS, PRED)" CA 104 3.016 1
75 1 13 1 "RMS(OBS, PRED)" CB 91 3.217 1
76 1 13 1 "RMS(OBS, PRED)" H 103 0.571 1
77 1 13 1 "RMS(OBS, PRED)" HA 115 0.322 1
78 1 13 1 "RMS(OBS, PRED)" N 103 2.766 1
79 1 14 1 "RMS(OBS, PRED)" C 0 0.000 1
80 1 14 1 "RMS(OBS, PRED)" CA 104 2.999 1
81 1 14 1 "RMS(OBS, PRED)" CB 91 3.036 1
82 1 14 1 "RMS(OBS, PRED)" H 103 0.548 1
83 1 14 1 "RMS(OBS, PRED)" HA 115 0.286 1
84 1 14 1 "RMS(OBS, PRED)" N 103 2.731 1
85 1 15 1 "RMS(OBS, PRED)" C 0 0.000 1
86 1 15 1 "RMS(OBS, PRED)" CA 104 2.918 1
87 1 15 1 "RMS(OBS, PRED)" CB 91 3.194 1
88 1 15 1 "RMS(OBS, PRED)" H 103 0.533 1
89 1 15 1 "RMS(OBS, PRED)" HA 115 0.322 1
90 1 15 1 "RMS(OBS, PRED)" N 103 2.421 1
91 1 16 1 "RMS(OBS, PRED)" C 0 0.000 1
92 1 16 1 "RMS(OBS, PRED)" CA 104 2.993 1
93 1 16 1 "RMS(OBS, PRED)" CB 91 3.247 1
94 1 16 1 "RMS(OBS, PRED)" H 103 0.611 1
95 1 16 1 "RMS(OBS, PRED)" HA 115 0.349 1
96 1 16 1 "RMS(OBS, PRED)" N 103 2.593 1
97 1 17 1 "RMS(OBS, PRED)" C 0 0.000 1
98 1 17 1 "RMS(OBS, PRED)" CA 104 3.061 1
99 1 17 1 "RMS(OBS, PRED)" CB 91 2.911 1
100 1 17 1 "RMS(OBS, PRED)" H 103 0.544 1
101 1 17 1 "RMS(OBS, PRED)" HA 115 0.305 1
102 1 17 1 "RMS(OBS, PRED)" N 103 2.735 1
103 1 18 1 "RMS(OBS, PRED)" C 0 0.000 1
104 1 18 1 "RMS(OBS, PRED)" CA 104 3.063 1
105 1 18 1 "RMS(OBS, PRED)" CB 91 3.028 1
106 1 18 1 "RMS(OBS, PRED)" H 103 0.584 1
107 1 18 1 "RMS(OBS, PRED)" HA 115 0.295 1
108 1 18 1 "RMS(OBS, PRED)" N 103 2.682 1
109 1 19 1 "RMS(OBS, PRED)" C 0 0.000 1
110 1 19 1 "RMS(OBS, PRED)" CA 104 3.072 1
111 1 19 1 "RMS(OBS, PRED)" CB 91 3.054 1
112 1 19 1 "RMS(OBS, PRED)" H 103 0.540 1
113 1 19 1 "RMS(OBS, PRED)" HA 115 0.302 1
114 1 19 1 "RMS(OBS, PRED)" N 103 2.660 1
115 1 20 1 "RMS(OBS, PRED)" C 0 0.000 1
116 1 20 1 "RMS(OBS, PRED)" CA 104 2.962 1
117 1 20 1 "RMS(OBS, PRED)" CB 91 3.009 1
118 1 20 1 "RMS(OBS, PRED)" H 103 0.570 1
119 1 20 1 "RMS(OBS, PRED)" HA 115 0.319 1
120 1 20 1 "RMS(OBS, PRED)" N 103 2.808 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 2 . 1 1 A 3 3 HIS CB C 3 33.709 30.072 3.637 2
1 3 . 1 1 A 7 7 HIS H H 7 8.731 8.269 0.462 2
1 4 . 1 1 A 7 7 HIS HA H 7 4.564 4.731 -0.168 2
1 7 . 1 1 A 7 7 HIS CA C 7 53.649 55.285 -1.636 2
1 8 . 1 1 A 7 7 HIS CB C 7 26.268 31.135 -4.867 2
1 9 . 1 1 A 7 7 HIS N N 7 121.126 118.271 2.855 2
1 10 . 1 1 A 8 8 GLY H H 8 8.540 8.279 0.261 2
1 11 . 1 1 A 8 8 GLY HA2 H 8 3.973 3.842 0.131 2
1 12 . 1 1 A 8 8 GLY HA3 H 8 3.811 3.918 -0.107 2
1 13 . 1 1 A 8 8 GLY CA C 8 42.618 45.485 -2.867 2
1 14 . 1 1 A 8 8 GLY N N 8 110.662 109.377 1.285 2
1 15 . 1 1 A 9 9 GLU H H 9 8.239 8.111 0.128 2
1 16 . 1 1 A 9 9 GLU HA H 9 4.568 4.251 0.317 2
1 18 . 1 1 A 9 9 GLU CA C 9 53.605 55.626 -2.021 2
1 19 . 1 1 A 9 9 GLU CB C 9 28.019 31.282 -3.263 2
1 20 . 1 1 A 9 9 GLU N N 9 121.669 120.369 1.300 2
1 21 . 1 1 A 10 10 PHE H H 10 8.785 7.840 0.945 2
1 22 . 1 1 A 10 10 PHE HA H 10 4.850 5.144 -0.294 2
1 25 . 1 1 A 10 10 PHE CA C 10 52.630 56.549 -3.919 2
1 26 . 1 1 A 10 10 PHE CB C 10 37.906 41.708 -3.802 2
1 27 . 1 1 A 10 10 PHE N N 10 118.401 119.153 -0.752 2
1 28 . 1 1 A 11 11 GLN H H 11 8.552 8.902 -0.350 2
1 29 . 1 1 A 11 11 GLN HA H 11 5.425 5.101 0.324 2
1 34 . 1 1 A 11 11 GLN CA C 11 51.663 54.597 -2.934 2
1 35 . 1 1 A 11 11 GLN CB C 11 28.427 30.770 -2.342 2
1 37 . 1 1 A 11 11 GLN N N 11 117.519 121.425 -3.906 2
1 38 . 1 1 A 12 12 ILE H H 12 8.239 8.273 -0.034 2
1 39 . 1 1 A 12 12 ILE HA H 12 4.103 4.862 -0.759 2
1 49 . 1 1 A 12 12 ILE CA C 12 57.134 59.720 -2.586 2
1 50 . 1 1 A 12 12 ILE CB C 12 39.491 40.180 -0.689 2
1 54 . 1 1 A 12 12 ILE N N 12 114.043 120.575 -6.532 2
1 55 . 1 1 A 13 13 PHE H H 13 8.538 8.621 -0.083 2
1 56 . 1 1 A 13 13 PHE HA H 13 5.620 5.303 0.317 2
1 59 . 1 1 A 13 13 PHE CA C 13 52.438 56.407 -3.969 2
1 60 . 1 1 A 13 13 PHE CB C 13 39.253 42.234 -2.981 2
1 61 . 1 1 A 13 13 PHE N N 13 117.015 119.893 -2.878 2
1 62 . 1 1 A 14 14 ALA H H 14 9.238 9.548 -0.310 2
1 63 . 1 1 A 14 14 ALA HA H 14 5.311 5.488 -0.177 2
1 67 . 1 1 A 14 14 ALA CA C 14 47.183 50.057 -2.874 2
1 68 . 1 1 A 14 14 ALA CB C 14 17.811 22.318 -4.507 2
1 69 . 1 1 A 14 14 ALA N N 14 123.503 125.169 -1.666 2
1 70 . 1 1 A 15 15 LYS H H 15 8.810 9.319 -0.508 2
1 71 . 1 1 A 15 15 LYS HA H 15 5.511 5.393 0.118 2
1 80 . 1 1 A 15 15 LYS CA C 15 51.718 54.571 -2.853 2
1 81 . 1 1 A 15 15 LYS CB C 15 33.635 35.375 -1.740 2
1 85 . 1 1 A 15 15 LYS N N 15 123.382 122.927 0.455 2
1 86 . 1 1 A 16 16 THR H H 16 8.830 8.610 0.220 2
1 87 . 1 1 A 16 16 THR HA H 16 5.212 4.976 0.236 2
1 92 . 1 1 A 16 16 THR CA C 16 57.614 60.674 -3.060 2
1 93 . 1 1 A 16 16 THR CB C 16 68.210 71.217 -3.007 2
1 95 . 1 1 A 16 16 THR N N 16 116.517 116.224 0.293 2
1 96 . 1 1 A 17 17 LEU H H 17 9.428 8.720 0.708 2
1 97 . 1 1 A 17 17 LEU HA H 17 4.286 4.123 0.163 2
1 107 . 1 1 A 17 17 LEU CA C 17 54.504 57.989 -3.485 2
1 108 . 1 1 A 17 17 LEU CB C 17 38.564 41.684 -3.120 2
1 112 . 1 1 A 17 17 LEU N N 17 121.786 123.494 -1.708 2
1 113 . 1 1 A 18 18 THR H H 18 7.546 7.808 -0.262 2
1 114 . 1 1 A 18 18 THR HA H 18 4.391 4.309 0.082 2
1 119 . 1 1 A 18 18 THR CA C 18 58.524 63.093 -4.569 2
1 120 . 1 1 A 18 18 THR CB C 18 66.166 70.535 -4.369 2
1 122 . 1 1 A 18 18 THR N N 18 105.598 108.415 -2.817 2
1 123 . 1 1 A 19 19 GLY H H 19 7.683 8.084 -0.400 2
1 124 . 1 1 A 19 19 GLY HA2 H 19 3.300 3.966 -0.666 2
1 125 . 1 1 A 19 19 GLY HA3 H 19 4.248 3.981 0.267 2
1 126 . 1 1 A 19 19 GLY CA C 19 42.947 45.830 -2.883 2
1 127 . 1 1 A 19 19 GLY N N 19 109.243 111.984 -2.741 2
1 128 . 1 1 A 20 20 LYS H H 20 7.375 7.801 -0.426 2
1 129 . 1 1 A 20 20 LYS HA H 20 4.331 4.650 -0.319 2
1 138 . 1 1 A 20 20 LYS CA C 20 53.829 55.159 -1.330 2
1 139 . 1 1 A 20 20 LYS CB C 20 30.385 34.205 -3.820 2
1 143 . 1 1 A 20 20 LYS N N 20 122.757 120.900 1.857 2
1 144 . 1 1 A 21 21 THR H H 21 8.637 8.804 -0.167 2
1 145 . 1 1 A 21 21 THR HA H 21 4.852 4.842 0.010 2
1 150 . 1 1 A 21 21 THR CA C 21 59.846 62.264 -2.418 2
1 151 . 1 1 A 21 21 THR CB C 21 67.140 69.668 -2.528 2
1 153 . 1 1 A 21 21 THR N N 21 121.524 122.312 -0.788 2
1 154 . 1 1 A 22 22 ILE H H 22 9.509 9.274 0.235 2
1 155 . 1 1 A 22 22 ILE HA H 22 4.349 4.864 -0.515 2
1 165 . 1 1 A 22 22 ILE CA C 22 57.634 60.086 -2.452 2
1 166 . 1 1 A 22 22 ILE CB C 22 38.334 41.803 -3.469 2
1 170 . 1 1 A 22 22 ILE N N 22 129.772 127.098 2.674 2
1 171 . 1 1 A 23 23 THR H H 23 8.838 8.793 0.044 2
1 172 . 1 1 A 23 23 THR HA H 23 4.653 4.779 -0.127 2
1 177 . 1 1 A 23 23 THR CA C 23 60.194 61.627 -1.433 2
1 178 . 1 1 A 23 23 THR CB C 23 66.577 69.896 -3.319 2
1 180 . 1 1 A 23 23 THR N N 23 124.070 123.713 0.357 2
1 181 . 1 1 A 24 24 LEU H H 24 8.749 8.549 0.200 2
1 182 . 1 1 A 24 24 LEU HA H 24 4.619 5.031 -0.412 2
1 192 . 1 1 A 24 24 LEU CA C 24 50.257 52.902 -2.645 2
1 193 . 1 1 A 24 24 LEU CB C 24 42.932 45.594 -2.662 2
1 197 . 1 1 A 24 24 LEU N N 24 126.499 124.051 2.448 2
1 198 . 1 1 A 25 25 GLU H H 25 7.990 8.616 -0.626 2
1 199 . 1 1 A 25 25 GLU HA H 25 4.591 4.618 -0.027 2
1 204 . 1 1 A 25 25 GLU CA C 25 52.845 56.125 -3.280 2
1 205 . 1 1 A 25 25 GLU CB C 25 27.210 29.960 -2.750 2
1 207 . 1 1 A 25 25 GLU N N 25 121.644 121.990 -0.346 2
1 208 . 1 1 A 26 26 VAL H H 26 8.657 8.538 0.119 2
1 209 . 1 1 A 26 26 VAL HA H 26 4.403 4.982 -0.580 2
1 217 . 1 1 A 26 26 VAL CA C 26 56.020 58.947 -2.927 2
1 218 . 1 1 A 26 26 VAL CB C 26 33.631 35.675 -2.044 2
1 221 . 1 1 A 26 26 VAL N N 26 116.647 118.859 -2.212 2
1 222 . 1 1 A 27 27 GLU H H 27 7.970 8.797 -0.827 2
1 223 . 1 1 A 27 27 GLU HA H 27 4.447 4.608 -0.161 2
1 228 . 1 1 A 27 27 GLU CA C 27 51.386 55.655 -4.269 2
1 229 . 1 1 A 27 27 GLU CB C 27 30.905 31.222 -0.317 2
1 231 . 1 1 A 27 27 GLU N N 27 115.496 121.941 -6.445 2
1 232 . 1 1 A 28 28 SER H H 28 9.192 8.813 0.379 2
1 233 . 1 1 A 28 28 SER HA H 28 4.108 4.141 -0.033 2
1 236 . 1 1 A 28 28 SER CA C 28 59.909 60.962 -1.053 2
1 237 . 1 1 A 28 28 SER CB C 28 60.399 62.698 -2.299 2
1 238 . 1 1 A 28 28 SER N N 28 117.720 118.391 -0.671 2
1 239 . 1 1 A 29 29 SER H H 29 7.371 7.734 -0.363 2
1 240 . 1 1 A 29 29 SER HA H 29 4.327 4.557 -0.230 2
1 243 . 1 1 A 29 29 SER CA C 29 54.805 57.381 -2.576 2
1 244 . 1 1 A 29 29 SER CB C 29 60.775 64.162 -3.387 2
1 245 . 1 1 A 29 29 SER N N 29 108.936 112.787 -3.851 2
1 246 . 1 1 A 30 30 ASP H H 30 7.852 7.609 0.243 2
1 247 . 1 1 A 30 30 ASP HA H 30 4.591 4.526 0.065 2
1 250 . 1 1 A 30 30 ASP CA C 30 53.040 54.718 -1.678 2
1 251 . 1 1 A 30 30 ASP CB C 30 37.942 41.536 -3.594 2
1 252 . 1 1 A 30 30 ASP N N 30 123.735 123.198 0.537 2
1 253 . 1 1 A 31 31 THR H H 31 7.852 8.397 -0.545 2
1 254 . 1 1 A 31 31 THR HA H 31 4.918 4.862 0.056 2
1 259 . 1 1 A 31 31 THR CA C 31 56.929 60.106 -3.177 2
1 260 . 1 1 A 31 31 THR CB C 31 68.674 71.597 -2.923 2
1 262 . 1 1 A 31 31 THR N N 31 109.181 113.118 -3.937 2
1 263 . 1 1 A 32 32 ILE H H 32 8.582 8.820 -0.238 2
1 264 . 1 1 A 32 32 ILE HA H 32 3.624 3.797 -0.173 2
1 274 . 1 1 A 32 32 ILE CA C 32 59.474 65.419 -5.945 2
1 275 . 1 1 A 32 32 ILE CB C 32 31.561 37.621 -6.060 2
1 279 . 1 1 A 32 32 ILE N N 32 121.833 122.817 -0.984 2
1 280 . 1 1 A 33 33 ASP H H 33 9.255 8.194 1.061 2
1 281 . 1 1 A 33 33 ASP HA H 33 4.201 4.306 -0.105 2
1 284 . 1 1 A 33 33 ASP CA C 33 54.679 57.630 -2.951 2
1 285 . 1 1 A 33 33 ASP CB C 33 37.700 40.982 -3.282 2
1 286 . 1 1 A 33 33 ASP N N 33 119.823 120.831 -1.008 2
1 287 . 1 1 A 34 34 ASN H H 34 8.026 7.690 0.336 2
1 288 . 1 1 A 34 34 ASN HA H 34 4.409 4.593 -0.184 2
1 291 . 1 1 A 34 34 ASN CA C 34 53.324 56.421 -3.097 2
1 292 . 1 1 A 34 34 ASN CB C 34 35.782 38.629 -2.847 2
1 293 . 1 1 A 34 34 ASN N N 34 119.540 117.615 1.925 2
1 294 . 1 1 A 35 35 VAL H H 35 8.167 8.092 0.075 2
1 295 . 1 1 A 35 35 VAL HA H 35 3.249 3.466 -0.217 2
1 303 . 1 1 A 35 35 VAL CA C 35 65.308 67.146 -1.838 2
1 304 . 1 1 A 35 35 VAL CB C 35 27.965 31.490 -3.525 2
1 307 . 1 1 A 35 35 VAL N N 35 122.223 120.150 2.073 2
1 308 . 1 1 A 36 36 LYS H H 36 8.460 8.398 0.062 2
1 313 . 1 1 A 36 36 LYS CB C 36 30.753 32.253 -1.500 2
1 315 . 1 1 A 36 36 LYS N N 36 119.438 119.431 0.007 2
1 316 . 1 1 A 37 37 SER H H 37 8.196 8.482 -0.286 2
1 317 . 1 1 A 37 37 SER HA H 37 4.130 4.159 -0.029 2
1 320 . 1 1 A 37 37 SER CA C 37 58.528 61.400 -2.872 2
1 321 . 1 1 A 37 37 SER CB C 37 59.768 62.724 -2.956 2
1 322 . 1 1 A 37 37 SER N N 37 117.791 114.353 3.438 2
1 323 . 1 1 A 38 38 LYS H H 38 8.043 8.184 -0.141 2
1 324 . 1 1 A 38 38 LYS HA H 38 4.095 3.999 0.096 2
1 325 . 1 1 A 38 38 LYS CA C 38 57.377 59.145 -1.768 2
1 326 . 1 1 A 38 38 LYS N N 38 124.094 121.006 3.088 2
1 327 . 1 1 A 39 39 ILE H H 39 8.254 8.166 0.088 2
1 328 . 1 1 A 39 39 ILE HA H 39 3.439 3.753 -0.314 2
1 338 . 1 1 A 39 39 ILE CA C 39 63.977 64.541 -0.564 2
1 339 . 1 1 A 39 39 ILE CB C 39 33.935 37.461 -3.526 2
1 343 . 1 1 A 39 39 ILE N N 39 122.107 120.222 1.885 2
1 344 . 1 1 A 40 40 GLN H H 40 8.379 8.330 0.049 2
1 345 . 1 1 A 40 40 GLN HA H 40 3.746 4.129 -0.383 2
1 350 . 1 1 A 40 40 GLN CA C 40 57.472 58.106 -0.634 2
1 351 . 1 1 A 40 40 GLN CB C 40 25.072 28.034 -2.962 2
1 353 . 1 1 A 40 40 GLN N N 40 123.725 120.055 3.670 2
1 354 . 1 1 A 41 41 ASP H H 41 8.210 7.880 0.330 2
1 355 . 1 1 A 41 41 ASP HA H 41 4.247 4.381 -0.134 2
1 358 . 1 1 A 41 41 ASP CA C 41 54.646 56.642 -1.996 2
1 359 . 1 1 A 41 41 ASP CB C 41 38.136 40.835 -2.699 2
1 360 . 1 1 A 41 41 ASP N N 41 120.564 120.568 -0.004 2
1 361 . 1 1 A 42 42 LYS H H 42 7.381 7.991 -0.610 2
1 362 . 1 1 A 42 42 LYS HA H 42 4.246 4.300 -0.054 2
1 369 . 1 1 A 42 42 LYS CA C 42 55.579 57.886 -2.307 2
1 370 . 1 1 A 42 42 LYS CB C 42 31.406 33.496 -2.090 2
1 373 . 1 1 A 42 42 LYS N N 42 115.674 117.130 -1.456 2
1 374 . 1 1 A 43 43 GLU H H 43 8.537 8.720 -0.183 2
1 375 . 1 1 A 43 43 GLU HA H 43 4.522 4.535 -0.013 2
1 380 . 1 1 A 43 43 GLU CA C 43 52.772 55.652 -2.880 2
1 381 . 1 1 A 43 43 GLU CB C 43 30.535 31.022 -0.487 2
1 383 . 1 1 A 43 43 GLU N N 43 114.355 116.129 -1.774 2
1 384 . 1 1 A 44 44 GLY H H 44 8.611 8.339 0.272 2
1 385 . 1 1 A 44 44 GLY HA2 H 44 4.067 3.967 0.099 2
1 386 . 1 1 A 44 44 GLY HA3 H 44 3.819 3.968 -0.149 2
1 387 . 1 1 A 44 44 GLY CA C 44 43.205 45.434 -2.229 2
1 388 . 1 1 A 44 44 GLY N N 44 109.406 108.566 0.840 2
1 389 . 1 1 A 45 45 ILE H H 45 6.092 8.120 -2.028 2
1 390 . 1 1 A 45 45 ILE HA H 45 4.324 4.112 0.212 2
1 400 . 1 1 A 45 45 ILE CA C 45 55.211 60.180 -4.969 2
1 401 . 1 1 A 45 45 ILE CB C 45 37.903 38.278 -0.375 2
1 405 . 1 1 A 45 45 ILE N N 45 120.791 122.449 -1.658 2
1 406 . 1 1 A 46 46 PRO HA H 46 4.547 4.591 -0.044 2
1 413 . 1 1 A 46 46 PRO CA C 46 58.971 62.010 -3.039 2
1 414 . 1 1 A 46 46 PRO CB C 46 29.142 32.314 -3.172 2
1 417 . 1 1 A 47 47 PRO HA H 47 4.062 4.202 -0.140 2
1 424 . 1 1 A 47 47 PRO CA C 47 63.476 65.785 -2.309 2
1 425 . 1 1 A 47 47 PRO CB C 47 30.113 31.962 -1.849 2
1 428 . 1 1 A 48 48 ASP H H 48 8.418 8.567 -0.149 2
1 429 . 1 1 A 48 48 ASP HA H 48 4.346 4.397 -0.051 2
1 432 . 1 1 A 48 48 ASP CA C 48 52.838 56.658 -3.820 2
1 433 . 1 1 A 48 48 ASP CB C 48 36.926 40.207 -3.281 2
1 434 . 1 1 A 48 48 ASP N N 48 113.462 116.958 -3.496 2
1 435 . 1 1 A 49 49 GLN H H 49 7.822 7.887 -0.065 2
1 436 . 1 1 A 49 49 GLN HA H 49 4.283 4.189 0.094 2
1 439 . 1 1 A 49 49 GLN CA C 49 52.770 57.430 -4.660 2
1 441 . 1 1 A 49 49 GLN N N 49 117.377 117.997 -0.620 2
1 442 . 1 1 A 50 50 GLN H H 50 7.451 7.574 -0.123 2
1 443 . 1 1 A 50 50 GLN HA H 50 4.260 4.903 -0.643 2
1 448 . 1 1 A 50 50 GLN CA C 50 53.725 54.604 -0.879 2
1 449 . 1 1 A 50 50 GLN CB C 50 29.142 31.510 -2.368 2
1 451 . 1 1 A 50 50 GLN N N 50 117.526 117.398 0.128 2
1 452 . 1 1 A 51 51 ARG H H 51 8.534 8.762 -0.228 2
1 453 . 1 1 A 51 51 ARG HA H 51 4.486 5.127 -0.641 2
1 460 . 1 1 A 51 51 ARG CA C 51 52.492 54.432 -1.940 2
1 461 . 1 1 A 51 51 ARG CB C 51 29.096 34.311 -5.215 2
1 464 . 1 1 A 51 51 ARG N N 51 121.655 120.645 1.010 2
1 465 . 1 1 A 52 52 LEU H H 52 8.683 8.901 -0.218 2
1 466 . 1 1 A 52 52 LEU HA H 52 5.255 5.072 0.183 2
1 476 . 1 1 A 52 52 LEU CA C 52 50.618 53.731 -3.114 2
1 477 . 1 1 A 52 52 LEU CB C 52 43.007 44.104 -1.097 2
1 481 . 1 1 A 52 52 LEU N N 52 122.929 122.621 0.308 2
1 482 . 1 1 A 53 53 ILE H H 53 9.286 9.002 0.284 2
1 483 . 1 1 A 53 53 ILE HA H 53 5.096 5.030 0.066 2
1 492 . 1 1 A 53 53 ILE CA C 53 56.795 60.375 -3.580 2
1 496 . 1 1 A 53 53 ILE N N 53 124.718 125.237 -0.519 2
1 497 . 1 1 A 54 54 TRP H H 54 8.871 9.093 -0.222 2
1 499 . 1 1 A 54 54 TRP N N 54 127.412 128.299 -0.887 2
1 501 . 1 1 A 55 55 ALA H H 55 8.401 8.490 -0.089 2
1 502 . 1 1 A 55 55 ALA HA H 55 3.183 3.440 -0.257 2
1 506 . 1 1 A 55 55 ALA CA C 55 49.712 52.675 -2.963 2
1 507 . 1 1 A 55 55 ALA CB C 55 13.252 17.069 -3.817 2
1 508 . 1 1 A 55 55 ALA N N 55 128.894 130.061 -1.167 2
1 509 . 1 1 A 56 56 GLY H H 56 8.248 8.422 -0.174 2
1 510 . 1 1 A 56 56 GLY HA2 H 56 3.968 3.740 0.228 2
1 511 . 1 1 A 56 56 GLY HA3 H 56 3.916 3.754 0.162 2
1 512 . 1 1 A 56 56 GLY CA C 56 43.142 45.551 -2.409 2
1 513 . 1 1 A 56 56 GLY N N 56 101.499 102.484 -0.985 2
1 514 . 1 1 A 57 57 LYS H H 57 8.028 7.494 0.534 2
1 515 . 1 1 A 57 57 LYS HA H 57 4.609 4.734 -0.125 2
1 522 . 1 1 A 57 57 LYS CA C 57 51.928 54.578 -2.650 2
1 523 . 1 1 A 57 57 LYS CB C 57 32.613 35.220 -2.607 2
1 526 . 1 1 A 57 57 LYS N N 57 118.995 120.904 -1.909 2
1 527 . 1 1 A 58 58 GLN H H 58 8.607 8.467 0.140 2
1 528 . 1 1 A 58 58 GLN HA H 58 4.617 4.568 0.049 2
1 533 . 1 1 A 58 58 GLN CA C 58 53.261 55.929 -2.668 2
1 534 . 1 1 A 58 58 GLN CB C 58 26.613 29.280 -2.667 2
1 536 . 1 1 A 58 58 GLN N N 58 119.825 124.606 -4.781 2
1 537 . 1 1 A 59 59 LEU H H 59 8.653 9.115 -0.462 2
1 538 . 1 1 A 59 59 LEU HA H 59 4.138 4.463 -0.325 2
1 548 . 1 1 A 59 59 LEU CA C 59 51.991 54.685 -2.694 2
1 549 . 1 1 A 59 59 LEU CB C 59 39.006 42.359 -3.353 2
1 553 . 1 1 A 59 59 LEU N N 59 125.484 125.564 -0.080 2
1 554 . 1 1 A 60 60 GLU H H 60 8.461 8.764 -0.303 2
1 555 . 1 1 A 60 60 GLU HA H 60 4.371 4.521 -0.150 2
1 559 . 1 1 A 60 60 GLU CA C 60 53.436 55.833 -2.397 2
1 560 . 1 1 A 60 60 GLU CB C 60 29.057 31.205 -2.148 2
1 562 . 1 1 A 60 60 GLU N N 60 123.237 122.650 0.587 2
1 563 . 1 1 A 61 61 ASP H H 61 8.076 8.919 -0.843 2
1 564 . 1 1 A 61 61 ASP HA H 61 4.265 4.344 -0.079 2
1 567 . 1 1 A 61 61 ASP CA C 61 54.398 56.637 -2.239 2
1 568 . 1 1 A 61 61 ASP CB C 61 38.340 40.236 -1.896 2
1 569 . 1 1 A 61 61 ASP N N 61 120.701 123.413 -2.712 2
1 570 . 1 1 A 62 62 GLY HA2 H 62 4.104 3.981 0.123 2
1 571 . 1 1 A 62 62 GLY HA3 H 62 3.832 3.983 -0.151 2
1 572 . 1 1 A 62 62 GLY CA C 62 42.576 45.490 -2.914 2
1 573 . 1 1 A 63 63 ARG H H 63 7.319 8.300 -0.981 2
1 574 . 1 1 A 63 63 ARG HA H 63 4.595 4.487 0.108 2
1 579 . 1 1 A 63 63 ARG CA C 63 51.971 55.913 -3.942 2
1 582 . 1 1 A 63 63 ARG N N 63 119.206 121.190 -1.984 2
1 583 . 1 1 A 64 64 THR H H 64 8.735 8.540 0.195 2
1 584 . 1 1 A 64 64 THR HA H 64 5.208 4.993 0.215 2
1 589 . 1 1 A 64 64 THR CA C 64 57.126 59.576 -2.450 2
1 590 . 1 1 A 64 64 THR CB C 64 69.885 71.831 -1.946 2
1 592 . 1 1 A 64 64 THR N N 64 108.713 114.269 -5.556 2
1 593 . 1 1 A 65 65 LEU H H 65 8.241 9.211 -0.970 2
1 594 . 1 1 A 65 65 LEU HA H 65 4.003 3.971 0.032 2
1 604 . 1 1 A 65 65 LEU CA C 65 56.409 57.691 -1.282 2
1 605 . 1 1 A 65 65 LEU CB C 65 37.179 41.512 -4.333 2
1 609 . 1 1 A 65 65 LEU N N 65 118.111 122.536 -4.425 2
1 610 . 1 1 A 66 66 SER H H 66 8.296 8.114 0.182 2
1 611 . 1 1 A 66 66 SER HA H 66 4.201 4.261 -0.060 2
1 614 . 1 1 A 66 66 SER CA C 66 58.454 60.535 -2.080 2
1 615 . 1 1 A 66 66 SER CB C 66 59.969 62.866 -2.897 2
1 616 . 1 1 A 66 66 SER N N 66 113.148 113.703 -0.554 2
1 617 . 1 1 A 67 67 ASP H H 67 7.984 8.299 -0.315 2
1 618 . 1 1 A 67 67 ASP HA H 67 4.187 4.283 -0.096 2
1 621 . 1 1 A 67 67 ASP CA C 67 54.744 57.052 -2.308 2
1 622 . 1 1 A 67 67 ASP CB C 67 37.794 41.223 -3.429 2
1 623 . 1 1 A 67 67 ASP N N 67 124.130 122.262 1.868 2
1 624 . 1 1 A 68 68 TYR H H 68 7.177 7.619 -0.442 2
1 625 . 1 1 A 68 68 TYR N N 68 115.334 117.528 -2.194 2
1 626 . 1 1 A 69 69 ASN H H 69 8.111 8.054 0.057 2
1 627 . 1 1 A 69 69 ASN HA H 69 4.253 4.356 -0.102 2
1 630 . 1 1 A 69 69 ASN CA C 69 51.386 54.265 -2.879 2
1 631 . 1 1 A 69 69 ASN CB C 69 34.867 36.922 -2.055 2
1 632 . 1 1 A 69 69 ASN N N 69 116.867 116.639 0.228 2
1 633 . 1 1 A 70 70 ILE H H 70 7.460 7.775 -0.315 2
1 634 . 1 1 A 70 70 ILE HA H 70 3.210 3.971 -0.761 2
1 644 . 1 1 A 70 70 ILE CA C 70 60.157 62.010 -1.853 2
1 645 . 1 1 A 70 70 ILE CB C 70 34.754 37.652 -2.898 2
1 649 . 1 1 A 70 70 ILE N N 70 119.821 119.560 0.261 2
1 650 . 1 1 A 71 71 GLN H H 71 7.368 8.625 -1.257 2
1 651 . 1 1 A 71 71 GLN HA H 71 4.099 4.489 -0.390 2
1 656 . 1 1 A 71 71 GLN CA C 71 50.906 55.042 -4.136 2
1 657 . 1 1 A 71 71 GLN CB C 71 28.793 29.949 -1.156 2
1 659 . 1 1 A 71 71 GLN N N 71 124.287 125.936 -1.649 2
1 660 . 1 1 A 72 72 ARG H H 72 7.583 8.732 -1.149 2
1 661 . 1 1 A 72 72 ARG HA H 72 3.907 4.296 -0.389 2
1 668 . 1 1 A 72 72 ARG CA C 72 54.527 58.476 -3.949 2
1 669 . 1 1 A 72 72 ARG CB C 72 27.470 30.840 -3.370 2
1 672 . 1 1 A 72 72 ARG N N 72 119.007 121.296 -2.289 2
1 673 . 1 1 A 73 73 GLU H H 73 9.262 8.001 1.261 2
1 674 . 1 1 A 73 73 GLU HA H 73 3.586 4.517 -0.931 2
1 679 . 1 1 A 73 73 GLU CA C 73 55.703 56.403 -0.700 2
1 680 . 1 1 A 73 73 GLU CB C 73 23.669 28.819 -5.150 2
1 682 . 1 1 A 73 73 GLU N N 73 115.180 117.849 -2.669 2
1 683 . 1 1 A 74 74 SER H H 74 7.551 7.935 -0.384 2
1 684 . 1 1 A 74 74 SER HA H 74 4.613 5.116 -0.503 2
1 687 . 1 1 A 74 74 SER CA C 74 58.305 56.864 1.441 2
1 688 . 1 1 A 74 74 SER CB C 74 62.156 65.443 -3.287 2
1 689 . 1 1 A 74 74 SER N N 74 115.104 116.297 -1.193 2
1 690 . 1 1 A 75 75 THR H H 75 8.785 8.837 -0.052 2
1 691 . 1 1 A 75 75 THR HA H 75 5.014 4.857 0.157 2
1 696 . 1 1 A 75 75 THR CA C 75 59.835 62.150 -2.315 2
1 697 . 1 1 A 75 75 THR CB C 75 67.258 69.033 -1.775 2
1 699 . 1 1 A 75 75 THR N N 75 118.401 120.341 -1.940 2
1 700 . 1 1 A 76 76 LEU H H 76 9.447 9.904 -0.457 2
1 701 . 1 1 A 76 76 LEU HA H 76 4.930 4.697 0.233 2
1 711 . 1 1 A 76 76 LEU CA C 76 51.107 54.294 -3.187 2
1 712 . 1 1 A 76 76 LEU CB C 76 40.841 42.305 -1.464 2
1 716 . 1 1 A 76 76 LEU N N 76 127.905 128.166 -0.261 2
1 717 . 1 1 A 77 77 HIS HA H 77 4.976 5.123 -0.147 2
1 720 . 1 1 A 77 77 HIS CA C 77 53.776 55.333 -1.557 2
1 721 . 1 1 A 77 77 HIS CB C 77 28.438 30.823 -2.385 2
1 722 . 1 1 A 78 78 LEU H H 78 8.450 9.124 -0.674 2
1 723 . 1 1 A 78 78 LEU HA H 78 5.085 5.100 -0.015 2
1 733 . 1 1 A 78 78 LEU CA C 78 50.896 53.676 -2.780 2
1 734 . 1 1 A 78 78 LEU CB C 78 41.916 45.158 -3.242 2
1 738 . 1 1 A 78 78 LEU N N 78 126.178 126.812 -0.634 2
1 739 . 1 1 A 79 79 VAL H H 79 9.093 9.330 -0.237 2
1 740 . 1 1 A 79 79 VAL HA H 79 4.053 4.789 -0.736 2
1 748 . 1 1 A 79 79 VAL CA C 79 59.054 60.808 -1.754 2
1 749 . 1 1 A 79 79 VAL CB C 79 32.115 33.886 -1.771 2
1 752 . 1 1 A 79 79 VAL N N 79 128.372 124.206 4.166 2
1 753 . 1 1 A 80 80 LEU H H 80 8.000 8.971 -0.971 2
1 754 . 1 1 A 80 80 LEU HA H 80 5.105 4.901 0.204 2
1 764 . 1 1 A 80 80 LEU CA C 80 50.556 53.642 -3.086 2
1 765 . 1 1 A 80 80 LEU CB C 80 39.597 43.407 -3.810 2
1 769 . 1 1 A 80 80 LEU N N 80 126.145 127.849 -1.704 2
1 770 . 1 1 A 81 81 ARG H H 81 8.470 8.336 0.134 2
1 771 . 1 1 A 81 81 ARG HA H 81 4.197 4.533 -0.336 2
1 778 . 1 1 A 81 81 ARG CA C 81 53.133 55.874 -2.741 2
1 779 . 1 1 A 81 81 ARG CB C 81 28.413 31.304 -2.891 2
1 782 . 1 1 A 81 81 ARG N N 81 121.625 125.102 -3.477 2
1 783 . 1 1 A 82 82 LEU H H 82 8.454 8.487 -0.033 2
1 784 . 1 1 A 82 82 LEU HA H 82 4.339 4.662 -0.323 2
1 794 . 1 1 A 82 82 LEU CA C 82 52.081 54.212 -2.131 2
1 795 . 1 1 A 82 82 LEU CB C 82 39.810 43.261 -3.451 2
1 799 . 1 1 A 82 82 LEU N N 82 123.832 123.927 -0.094 2
1 800 . 1 1 A 83 83 ARG H H 83 8.404 8.770 -0.366 2
1 801 . 1 1 A 83 83 ARG HA H 83 4.308 4.328 -0.020 2
1 808 . 1 1 A 83 83 ARG CA C 83 53.258 57.030 -3.772 2
1 809 . 1 1 A 83 83 ARG CB C 83 28.160 30.764 -2.604 2
1 812 . 1 1 A 83 83 ARG N N 83 121.447 125.763 -4.316 2
1 813 . 1 1 A 84 84 GLY H H 84 8.410 7.911 0.499 2
1 814 . 1 1 A 84 84 GLY HA2 H 84 3.929 4.036 -0.107 2
1 815 . 1 1 A 84 84 GLY HA3 H 84 3.929 4.037 -0.108 2
1 816 . 1 1 A 84 84 GLY CA C 84 42.751 45.614 -2.863 2
1 817 . 1 1 A 84 84 GLY N N 84 110.030 107.647 2.383 2
1 818 . 1 1 A 85 85 GLY H H 85 8.295 8.299 -0.004 2
1 819 . 1 1 A 85 85 GLY HA2 H 85 3.950 3.997 -0.047 2
1 820 . 1 1 A 85 85 GLY HA3 H 85 3.950 3.997 -0.047 2
1 821 . 1 1 A 85 85 GLY CA C 85 42.831 46.102 -3.272 2
1 822 . 1 1 A 85 85 GLY N N 85 108.838 109.241 -0.403 2
1 823 . 1 1 A 86 86 SER H H 86 8.292 8.282 0.010 2
1 824 . 1 1 A 86 86 SER HA H 86 4.405 4.535 -0.130 2
1 827 . 1 1 A 86 86 SER CA C 86 55.965 58.063 -2.098 2
1 828 . 1 1 A 86 86 SER CB C 86 61.232 63.374 -2.142 2
1 829 . 1 1 A 86 86 SER N N 86 116.028 116.244 -0.216 2
1 830 . 1 1 A 87 87 MET H H 87 8.470 8.299 0.171 2
1 831 . 1 1 A 87 87 MET HA H 87 4.447 4.315 0.132 2
1 836 . 1 1 A 87 87 MET CA C 87 53.281 57.253 -3.972 2
1 837 . 1 1 A 87 87 MET CB C 87 29.788 33.090 -3.301 2
1 839 . 1 1 A 87 87 MET N N 87 121.625 123.677 -2.052 2
1 840 . 1 1 A 88 88 GLY H H 88 8.320 8.123 0.197 2
1 841 . 1 1 A 88 88 GLY HA2 H 88 3.919 3.888 0.031 2
1 842 . 1 1 A 88 88 GLY HA3 H 88 3.896 3.889 0.007 2
1 843 . 1 1 A 88 88 GLY CA C 88 43.060 46.336 -3.276 2
1 844 . 1 1 A 88 88 GLY N N 88 109.625 107.595 2.030 2
1 845 . 1 1 A 89 89 GLY H H 89 8.256 8.206 0.050 2
1 846 . 1 1 A 89 89 GLY HA2 H 89 3.940 4.094 -0.154 2
1 847 . 1 1 A 89 89 GLY HA3 H 89 3.910 4.095 -0.185 2
1 848 . 1 1 A 89 89 GLY CA C 89 42.678 45.530 -2.852 2
1 849 . 1 1 A 89 89 GLY N N 89 108.982 109.720 -0.738 2
1 850 . 1 1 A 90 90 ALA H H 90 8.203 8.371 -0.168 2
1 851 . 1 1 A 90 90 ALA HA H 90 4.255 4.128 0.127 2
1 855 . 1 1 A 90 90 ALA CA C 90 50.763 54.621 -3.859 2
1 856 . 1 1 A 90 90 ALA CB C 90 16.364 18.953 -2.589 2
1 857 . 1 1 A 90 90 ALA N N 90 124.065 124.155 -0.090 2
1 858 . 1 1 A 91 91 ALA H H 91 8.273 7.784 0.489 2
1 859 . 1 1 A 91 91 ALA HA H 91 4.204 4.493 -0.289 2
1 863 . 1 1 A 91 91 ALA CA C 91 51.080 51.504 -0.423 2
1 864 . 1 1 A 91 91 ALA CB C 91 16.036 20.181 -4.145 2
1 865 . 1 1 A 91 91 ALA N N 91 121.985 119.512 2.473 2
1 866 . 1 1 A 92 92 ASP H H 92 8.022 8.822 -0.800 2
1 867 . 1 1 A 92 92 ASP HA H 92 4.455 4.904 -0.449 2
1 870 . 1 1 A 92 92 ASP CA C 92 52.664 53.978 -1.314 2
1 871 . 1 1 A 92 92 ASP CB C 92 37.925 42.021 -4.096 2
1 872 . 1 1 A 92 92 ASP N N 92 118.621 122.119 -3.498 2
1 873 . 1 1 A 93 93 GLU H H 93 8.282 8.208 0.074 2
1 874 . 1 1 A 93 93 GLU HA H 93 3.912 4.287 -0.375 2
1 879 . 1 1 A 93 93 GLU CA C 93 56.947 57.590 -0.643 2
1 880 . 1 1 A 93 93 GLU CB C 93 27.413 30.128 -2.716 2
1 882 . 1 1 A 93 93 GLU N N 93 122.247 117.921 4.326 2
1 883 . 1 1 A 94 94 GLU H H 94 8.194 8.162 0.032 2
1 884 . 1 1 A 94 94 GLU HA H 94 3.940 4.417 -0.477 2
1 889 . 1 1 A 94 94 GLU CA C 94 56.681 57.978 -1.297 2
1 890 . 1 1 A 94 94 GLU CB C 94 26.127 30.966 -4.839 2
1 892 . 1 1 A 94 94 GLU N N 94 118.024 118.968 -0.944 2
1 893 . 1 1 A 95 95 GLU H H 95 7.816 8.427 -0.611 2
1 894 . 1 1 A 95 95 GLU HA H 95 4.121 4.120 0.001 2
1 898 . 1 1 A 95 95 GLU CA C 95 56.162 58.805 -2.643 2
1 899 . 1 1 A 95 95 GLU CB C 95 26.403 28.721 -2.318 2
1 901 . 1 1 A 95 95 GLU N N 95 120.028 119.239 0.789 2
1 902 . 1 1 A 96 96 LEU H H 96 7.637 7.869 -0.232 2
1 903 . 1 1 A 96 96 LEU HA H 96 3.988 4.073 -0.085 2
1 913 . 1 1 A 96 96 LEU CA C 96 55.303 57.520 -2.217 2
1 914 . 1 1 A 96 96 LEU CB C 96 39.038 41.535 -2.497 2
1 918 . 1 1 A 96 96 LEU N N 96 119.866 118.207 1.659 2
1 919 . 1 1 A 97 97 ILE H H 97 8.044 7.531 0.513 2
1 920 . 1 1 A 97 97 ILE HA H 97 3.478 3.924 -0.446 2
1 930 . 1 1 A 97 97 ILE CA C 97 62.054 64.054 -2.000 2
1 931 . 1 1 A 97 97 ILE CB C 97 34.541 37.984 -3.443 2
1 935 . 1 1 A 97 97 ILE N N 97 119.088 119.540 -0.452 2
1 936 . 1 1 A 98 98 ARG H H 98 7.991 8.268 -0.277 2
1 937 . 1 1 A 98 98 ARG HA H 98 3.793 4.032 -0.239 2
1 944 . 1 1 A 98 98 ARG CA C 98 57.509 58.789 -1.280 2
1 945 . 1 1 A 98 98 ARG CB C 98 27.191 30.018 -2.827 2
1 948 . 1 1 A 98 98 ARG N N 98 119.225 120.850 -1.625 2
1 949 . 1 1 A 99 99 LYS H H 99 8.101 8.174 -0.073 2
1 950 . 1 1 A 99 99 LYS HA H 99 3.968 4.071 -0.103 2
1 959 . 1 1 A 99 99 LYS CA C 99 56.455 59.063 -2.608 2
1 960 . 1 1 A 99 99 LYS CB C 99 29.531 32.068 -2.537 2
1 964 . 1 1 A 99 99 LYS N N 99 119.464 118.633 0.831 2
1 965 . 1 1 A 100 100 ALA H H 100 8.167 7.968 0.199 2
1 966 . 1 1 A 100 100 ALA HA H 100 3.789 4.106 -0.317 2
1 970 . 1 1 A 100 100 ALA CA C 100 52.451 54.566 -2.115 2
1 971 . 1 1 A 100 100 ALA CB C 100 16.259 18.337 -2.077 2
1 972 . 1 1 A 100 100 ALA N N 100 122.398 121.275 1.123 2
1 973 . 1 1 A 101 101 ILE H H 101 8.777 7.728 1.049 2
1 974 . 1 1 A 101 101 ILE HA H 101 3.191 3.699 -0.508 2
1 984 . 1 1 A 101 101 ILE CA C 101 62.910 64.730 -1.820 2
1 985 . 1 1 A 101 101 ILE CB C 101 34.544 37.504 -2.960 2
1 989 . 1 1 A 101 101 ILE N N 101 120.431 118.258 2.173 2
1 990 . 1 1 A 102 102 GLU H H 102 7.890 7.801 0.089 2
1 991 . 1 1 A 102 102 GLU HA H 102 3.848 4.193 -0.345 2
1 996 . 1 1 A 102 102 GLU CA C 102 57.079 57.998 -0.919 2
1 997 . 1 1 A 102 102 GLU CB C 102 26.769 29.866 -3.097 2
1 999 . 1 1 A 102 102 GLU N N 102 120.248 120.578 -0.330 2
1 1000 . 1 1 A 103 103 LEU H H 103 8.194 7.837 0.357 2
1 1001 . 1 1 A 103 103 LEU HA H 103 3.912 4.264 -0.352 2
1 1011 . 1 1 A 103 103 LEU CA C 103 55.078 56.760 -1.682 2
1 1012 . 1 1 A 103 103 LEU CB C 103 38.963 42.300 -3.337 2
1 1016 . 1 1 A 103 103 LEU N N 103 120.341 118.848 1.493 2
1 1017 . 1 1 A 104 104 SER H H 104 8.268 7.889 0.379 2
1 1018 . 1 1 A 104 104 SER HA H 104 4.120 4.433 -0.313 2
1 1021 . 1 1 A 104 104 SER CA C 104 58.301 59.328 -1.027 2
1 1022 . 1 1 A 104 104 SER CB C 104 60.193 63.778 -3.585 2
1 1023 . 1 1 A 104 104 SER N N 104 115.150 114.283 0.867 2
1 1024 . 1 1 A 105 105 LEU H H 105 7.501 7.536 -0.035 2
1 1025 . 1 1 A 105 105 LEU HA H 105 4.041 4.037 0.004 2
1 1035 . 1 1 A 105 105 LEU CA C 105 53.995 56.624 -2.629 2
1 1036 . 1 1 A 105 105 LEU CB C 105 39.597 42.048 -2.451 2
1 1040 . 1 1 A 105 105 LEU N N 105 124.223 120.518 3.705 2
1 1041 . 1 1 A 106 106 LYS H H 106 7.542 8.092 -0.550 2
1 1042 . 1 1 A 106 106 LYS HA H 106 4.090 4.025 0.065 2
1 1050 . 1 1 A 106 106 LYS CA C 106 55.495 58.928 -3.433 2
1 1051 . 1 1 A 106 106 LYS CB C 106 29.941 31.974 -2.034 2
1 1055 . 1 1 A 106 106 LYS N N 106 120.328 118.693 1.635 2
1 1056 . 1 1 A 107 107 GLU H H 107 7.884 8.172 -0.288 2
1 1057 . 1 1 A 107 107 GLU HA H 107 4.210 4.073 0.137 2
1 1060 . 1 1 A 107 107 GLU CA C 107 54.509 59.207 -4.698 2
1 1061 . 1 1 A 107 107 GLU CB C 107 27.239 29.380 -2.141 2
1 1062 . 1 1 A 107 107 GLU N N 107 118.621 120.217 -1.596 2
1 1063 . 1 1 A 108 108 SER H H 108 7.923 8.076 -0.153 2
1 1064 . 1 1 A 108 108 SER HA H 108 4.385 4.226 0.159 2
1 1067 . 1 1 A 108 108 SER CA C 108 56.442 61.039 -4.597 2
1 1068 . 1 1 A 108 108 SER CB C 108 60.953 62.950 -1.997 2
1 1069 . 1 1 A 108 108 SER N N 108 115.670 115.543 0.127 2
1 1070 . 1 1 A 109 109 ARG H H 109 8.068 7.760 0.308 2
1 1071 . 1 1 A 109 109 ARG HA H 109 4.307 4.049 0.258 2
1 1078 . 1 1 A 109 109 ARG CA C 109 53.732 59.014 -5.282 2
1 1079 . 1 1 A 109 109 ARG CB C 109 27.968 29.746 -1.778 2
1 1082 . 1 1 A 109 109 ARG N N 109 122.313 121.589 0.724 2
1 1083 . 1 1 A 110 110 ASN H H 110 8.292 8.202 0.090 2
1 1084 . 1 1 A 110 110 ASN HA H 110 4.720 4.497 0.223 2
1 1087 . 1 1 A 110 110 ASN CA C 110 50.750 55.953 -5.203 2
1 1088 . 1 1 A 110 110 ASN CB C 110 36.197 38.391 -2.194 2
1 1089 . 1 1 A 110 110 ASN N N 110 119.304 118.012 1.292 2
1 1090 . 1 1 A 111 111 SER H H 111 8.244 7.964 0.280 2
1 1091 . 1 1 A 111 111 SER HA H 111 4.423 4.323 0.100 2
1 1094 . 1 1 A 111 111 SER CA C 111 55.990 60.724 -4.734 2
1 1095 . 1 1 A 111 111 SER CB C 111 61.027 62.969 -1.942 2
1 1096 . 1 1 A 111 111 SER N N 111 116.119 115.012 1.107 2
1 1097 . 1 1 A 112 112 GLY H H 112 8.327 8.203 0.124 2
1 1098 . 1 1 A 112 112 GLY HA2 H 112 3.944 3.872 0.072 2
1 1099 . 1 1 A 112 112 GLY HA3 H 112 3.912 3.924 -0.012 2
1 1100 . 1 1 A 112 112 GLY CA C 112 42.733 46.586 -3.853 2
1 1101 . 1 1 A 112 112 GLY N N 112 110.442 108.906 1.536 2
1 1102 . 1 1 A 113 113 GLY H H 113 8.097 8.146 -0.049 2
1 1103 . 1 1 A 113 113 GLY HA2 H 113 3.831 3.744 0.087 2
1 1104 . 1 1 A 113 113 GLY HA3 H 113 3.785 3.789 -0.004 2
1 1105 . 1 1 A 113 113 GLY CA C 113 42.435 46.732 -4.297 2
1 1106 . 1 1 A 113 113 GLY N N 113 108.745 109.346 -0.601 2
stop_
save_