data_25932 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 25932 _Entry.PDB_ID 2NA9 save_ save_delta_chem_shifts _Entity_delta_chem_shifts.Sf_category delta_chem_shifts _Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts _Entity_delta_chem_shifts.Model_type single _Entity_delta_chem_shifts.Entry_ID 25932 _Entity_delta_chem_shifts.ID 1 loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Conformer_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_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.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 1 . 1 1 433 433 SER C C 433 174.143 174.143 172.786 1.357 25932 2 1 1 . 1 1 433 433 SER CA C 433 57.715 57.715 58.146 -0.431 25932 3 1 1 . 1 1 433 433 SER CB C 433 63.602 63.602 63.514 0.088 25932 4 1 1 . 1 1 434 434 TRP N N 434 122.746 122.746 126.575 -3.829 25932 5 1 1 . 1 1 434 434 TRP C C 434 175.587 175.587 175.610 -0.023 25932 6 1 1 . 1 1 434 434 TRP CA C 434 56.604 56.604 56.904 -0.300 25932 7 1 1 . 1 1 434 434 TRP CB C 434 29.269 29.269 28.801 0.468 25932 8 1 1 . 1 1 434 434 TRP H H 434 8.283 8.283 7.629 0.654 25932 9 1 1 . 1 1 435 435 ASP N N 435 121.374 121.374 126.946 -5.572 25932 10 1 1 . 1 1 435 435 ASP C C 435 176.543 176.543 177.407 -0.864 25932 11 1 1 . 1 1 435 435 ASP CA C 435 53.562 53.562 54.743 -1.181 25932 12 1 1 . 1 1 435 435 ASP CB C 435 40.854 40.854 41.020 -0.166 25932 13 1 1 . 1 1 435 435 ASP H H 435 8.219 8.219 8.436 -0.217 25932 14 1 1 . 1 1 436 436 THR N N 436 116.111 116.111 118.712 -2.601 25932 15 1 1 . 1 1 436 436 THR C C 436 175.651 175.651 176.305 -0.654 25932 16 1 1 . 1 1 436 436 THR CA C 436 65.015 65.015 65.657 -0.642 25932 17 1 1 . 1 1 436 436 THR CB C 436 68.416 68.416 68.564 -0.148 25932 18 1 1 . 1 1 436 436 THR H H 436 8.251 8.251 8.238 0.013 25932 19 1 1 . 1 1 437 437 GLU N N 437 121.374 121.374 121.570 -0.196 25932 20 1 1 . 1 1 437 437 GLU C C 437 177.988 177.988 178.914 -0.926 25932 21 1 1 . 1 1 437 437 GLU CA C 437 59.513 59.513 59.959 -0.446 25932 22 1 1 . 1 1 437 437 GLU CB C 437 28.370 28.370 29.155 -0.785 25932 23 1 1 . 1 1 437 437 GLU H H 437 8.897 8.897 8.732 0.165 25932 24 1 1 . 1 1 438 438 SER N N 438 115.658 115.658 115.729 -0.071 25932 25 1 1 . 1 1 438 438 SER C C 438 175.832 175.832 176.558 -0.726 25932 26 1 1 . 1 1 438 438 SER CA C 438 60.889 60.889 62.020 -1.131 25932 27 1 1 . 1 1 438 438 SER CB C 438 62.491 62.491 63.110 -0.619 25932 28 1 1 . 1 1 438 438 SER H H 438 8.018 8.018 8.903 -0.885 25932 29 1 1 . 1 1 439 439 VAL N N 439 122.608 122.608 122.821 -0.213 25932 30 1 1 . 1 1 439 439 VAL C C 439 177.743 177.743 177.932 -0.189 25932 31 1 1 . 1 1 439 439 VAL CA C 439 65.861 65.861 65.492 0.369 25932 32 1 1 . 1 1 439 439 VAL CB C 439 30.698 30.698 31.233 -0.535 25932 33 1 1 . 1 1 439 439 VAL H H 439 7.908 7.908 7.288 0.620 25932 34 1 1 . 1 1 440 440 LEU N N 440 120.077 120.077 120.954 -0.877 25932 35 1 1 . 1 1 440 440 LEU C C 440 178.466 178.466 178.151 0.315 25932 36 1 1 . 1 1 440 440 LEU CA C 440 57.953 57.953 58.449 -0.496 25932 37 1 1 . 1 1 440 440 LEU CB C 440 40.378 40.378 41.685 -1.307 25932 38 1 1 . 1 1 440 440 LEU H H 440 8.171 8.171 8.949 -0.778 25932 39 1 1 . 1 1 441 441 ALA N N 441 119.465 119.465 121.130 -1.665 25932 40 1 1 . 1 1 441 441 ALA C C 441 178.986 178.986 179.486 -0.500 25932 41 1 1 . 1 1 441 441 ALA CA C 441 55.122 55.122 54.800 0.322 25932 42 1 1 . 1 1 441 441 ALA CB C 441 17.367 17.367 18.128 -0.761 25932 43 1 1 . 1 1 441 441 ALA H H 441 8.090 8.090 8.259 -0.169 25932 44 1 1 . 1 1 442 442 MET N N 442 116.111 116.111 117.197 -1.086 25932 45 1 1 . 1 1 442 442 MET C C 442 178.073 178.073 178.039 0.034 25932 46 1 1 . 1 1 442 442 MET CA C 442 58.217 58.217 59.236 -1.019 25932 47 1 1 . 1 1 442 442 MET CB C 442 31.597 31.597 32.569 -0.973 25932 48 1 1 . 1 1 442 442 MET H H 442 7.875 7.875 7.794 0.081 25932 49 1 1 . 1 1 443 443 TRP N N 443 119.802 119.802 118.717 1.085 25932 50 1 1 . 1 1 443 443 TRP C C 443 178.445 178.445 177.794 0.651 25932 51 1 1 . 1 1 443 443 TRP CA C 443 60.624 60.624 59.243 1.381 25932 52 1 1 . 1 1 443 443 TRP CB C 443 28.899 28.899 28.477 0.422 25932 53 1 1 . 1 1 443 443 TRP H H 443 8.196 8.196 7.558 0.638 25932 54 1 1 . 1 1 444 444 VAL N N 444 118.509 118.509 122.004 -3.495 25932 55 1 1 . 1 1 444 444 VAL C C 444 177.563 177.563 178.275 -0.712 25932 56 1 1 . 1 1 444 444 VAL CA C 444 66.866 66.866 65.487 1.379 25932 57 1 1 . 1 1 444 444 VAL CB C 444 30.221 30.221 30.290 -0.069 25932 58 1 1 . 1 1 444 444 VAL H H 444 8.353 8.353 6.745 1.608 25932 59 1 1 . 1 1 445 445 LEU N N 445 119.328 119.328 120.955 -1.627 25932 60 1 1 . 1 1 445 445 LEU C C 445 178.168 178.168 178.458 -0.290 25932 61 1 1 . 1 1 445 445 LEU CA C 445 57.979 57.979 58.078 -0.099 25932 62 1 1 . 1 1 445 445 LEU CB C 445 40.431 40.431 41.297 -0.866 25932 63 1 1 . 1 1 445 445 LEU H H 445 8.233 8.233 7.555 0.678 25932 64 1 1 . 1 1 446 446 ALA N N 446 120.009 120.009 121.896 -1.887 25932 65 1 1 . 1 1 446 446 ALA C C 446 179.071 179.071 179.830 -0.759 25932 66 1 1 . 1 1 446 446 ALA CA C 446 55.096 55.096 55.192 -0.096 25932 67 1 1 . 1 1 446 446 ALA CB C 446 16.996 16.996 18.243 -1.247 25932 68 1 1 . 1 1 446 446 ALA H H 446 8.402 8.402 8.054 0.348 25932 69 1 1 . 1 1 447 447 LEU N N 447 117.136 117.136 119.664 -2.528 25932 70 1 1 . 1 1 447 447 LEU C C 447 178.678 178.678 179.097 -0.419 25932 71 1 1 . 1 1 447 447 LEU CA C 447 57.767 57.767 57.952 -0.185 25932 72 1 1 . 1 1 447 447 LEU CB C 447 40.378 40.378 42.145 -1.767 25932 73 1 1 . 1 1 447 447 LEU H H 447 8.244 8.244 8.092 0.152 25932 74 1 1 . 1 1 448 448 ILE N N 448 119.121 119.121 120.039 -0.918 25932 75 1 1 . 1 1 448 448 ILE C C 448 177.574 177.574 178.145 -0.571 25932 76 1 1 . 1 1 448 448 ILE CA C 448 65.702 65.702 65.686 0.016 25932 77 1 1 . 1 1 448 448 ILE CB C 448 36.464 36.464 37.643 -1.179 25932 78 1 1 . 1 1 448 448 ILE H H 448 8.286 8.286 8.000 0.286 25932 79 1 1 . 1 1 449 449 VAL N N 449 119.052 119.052 120.029 -0.977 25932 80 1 1 . 1 1 449 449 VAL C C 449 179.135 179.135 177.961 1.174 25932 81 1 1 . 1 1 449 449 VAL CA C 449 67.051 67.051 67.122 -0.071 25932 82 1 1 . 1 1 449 449 VAL CB C 449 30.175 30.175 31.351 -1.176 25932 83 1 1 . 1 1 449 449 VAL H H 449 8.327 8.327 7.767 0.560 25932 84 1 1 . 1 1 450 450 ILE N N 450 123.014 123.014 120.398 2.616 25932 85 1 1 . 1 1 450 450 ILE C C 450 177.074 177.074 177.868 -0.794 25932 86 1 1 . 1 1 450 450 ILE CA C 450 65.594 65.594 65.403 0.191 25932 87 1 1 . 1 1 450 450 ILE CB C 450 36.594 36.594 37.545 -0.951 25932 88 1 1 . 1 1 450 450 ILE H H 450 8.670 8.670 7.675 0.995 25932 89 1 1 . 1 1 451 451 PHE N N 451 119.392 119.392 119.001 0.391 25932 90 1 1 . 1 1 451 451 PHE C C 451 177.297 177.297 177.956 -0.659 25932 91 1 1 . 1 1 451 451 PHE CA C 451 61.389 61.389 62.728 -1.339 25932 92 1 1 . 1 1 451 451 PHE CB C 451 37.970 37.970 38.338 -0.368 25932 93 1 1 . 1 1 451 451 PHE H H 451 8.651 8.651 7.832 0.819 25932 94 1 1 . 1 1 452 452 LEU N N 452 118.367 118.367 119.326 -0.959 25932 95 1 1 . 1 1 452 452 LEU C C 452 177.967 177.967 178.857 -0.890 25932 96 1 1 . 1 1 452 452 LEU CA C 452 57.606 57.606 58.331 -0.726 25932 97 1 1 . 1 1 452 452 LEU CB C 452 40.924 40.924 41.435 -0.511 25932 98 1 1 . 1 1 452 452 LEU H H 452 8.731 8.731 7.965 0.766 25932 99 1 1 . 1 1 453 453 THR N N 453 116.173 116.173 116.650 -0.477 25932 100 1 1 . 1 1 453 453 THR C C 453 176.220 176.220 176.766 -0.546 25932 101 1 1 . 1 1 453 453 THR CA C 453 67.919 67.919 67.282 0.637 25932 102 1 1 . 1 1 453 453 THR CB C 453 67.006 67.006 68.417 -1.411 25932 103 1 1 . 1 1 453 453 THR H H 453 8.104 8.104 7.969 0.135 25932 104 1 1 . 1 1 454 454 ILE N N 454 120.077 120.077 121.005 -0.928 25932 105 1 1 . 1 1 454 454 ILE C C 454 176.915 176.915 177.338 -0.423 25932 106 1 1 . 1 1 454 454 ILE CA C 454 65.041 65.041 65.089 -0.048 25932 107 1 1 . 1 1 454 454 ILE CB C 454 36.464 36.464 37.645 -1.181 25932 108 1 1 . 1 1 454 454 ILE H H 454 8.043 8.043 8.237 -0.194 25932 109 1 1 . 1 1 455 455 ALA N N 455 121.174 121.174 123.326 -2.152 25932 110 1 1 . 1 1 455 455 ALA C C 455 178.806 178.806 179.753 -0.947 25932 111 1 1 . 1 1 455 455 ALA CA C 455 55.346 55.346 55.591 -0.245 25932 112 1 1 . 1 1 455 455 ALA CB C 455 16.890 16.890 18.063 -1.173 25932 113 1 1 . 1 1 455 455 ALA H H 455 8.265 8.265 8.529 -0.264 25932 114 1 1 . 1 1 456 456 VAL N N 456 116.661 116.661 118.525 -1.864 25932 115 1 1 . 1 1 456 456 VAL C C 456 177.489 177.489 178.224 -0.735 25932 116 1 1 . 1 1 456 456 VAL CA C 456 66.494 66.494 66.837 -0.343 25932 117 1 1 . 1 1 456 456 VAL CB C 456 30.226 30.226 31.156 -0.930 25932 118 1 1 . 1 1 456 456 VAL H H 456 8.211 8.211 8.191 0.020 25932 119 1 1 . 1 1 457 457 LEU N N 457 119.465 119.465 119.977 -0.512 25932 120 1 1 . 1 1 457 457 LEU C C 457 179.517 179.517 179.356 0.161 25932 121 1 1 . 1 1 457 457 LEU CA C 457 58.056 58.056 58.160 -0.104 25932 122 1 1 . 1 1 457 457 LEU CB C 457 40.414 40.414 41.533 -1.119 25932 123 1 1 . 1 1 457 457 LEU H H 457 8.150 8.150 7.407 0.743 25932 124 1 1 . 1 1 458 458 LEU N N 458 118.436 118.436 119.416 -0.980 25932 125 1 1 . 1 1 458 458 LEU C C 458 178.891 178.891 178.967 -0.076 25932 126 1 1 . 1 1 458 458 LEU CA C 458 57.395 57.395 58.146 -0.751 25932 127 1 1 . 1 1 458 458 LEU CB C 458 40.484 40.484 41.476 -0.992 25932 128 1 1 . 1 1 458 458 LEU H H 458 8.542 8.542 8.152 0.390 25932 129 1 1 . 1 1 459 459 ALA N N 459 122.337 122.337 121.839 0.498 25932 130 1 1 . 1 1 459 459 ALA C C 459 179.793 179.793 179.692 0.101 25932 131 1 1 . 1 1 459 459 ALA CA C 459 55.122 55.122 54.859 0.263 25932 132 1 1 . 1 1 459 459 ALA CB C 459 17.208 17.208 18.689 -1.481 25932 133 1 1 . 1 1 459 459 ALA H H 459 8.401 8.401 8.254 0.147 25932 134 1 1 . 1 1 460 460 LEU N N 460 117.961 117.961 120.556 -2.595 25932 135 1 1 . 1 1 460 460 LEU C C 460 179.262 179.262 178.795 0.467 25932 136 1 1 . 1 1 460 460 LEU CA C 460 57.673 57.673 58.043 -0.370 25932 137 1 1 . 1 1 460 460 LEU CB C 460 40.414 40.414 41.642 -1.228 25932 138 1 1 . 1 1 460 460 LEU H H 460 8.518 8.518 8.600 -0.082 25932 139 1 1 . 1 1 461 461 ARG N N 461 119.534 119.534 119.587 -0.053 25932 140 1 1 . 1 1 461 461 ARG C C 461 178.625 178.625 178.359 0.266 25932 141 1 1 . 1 1 461 461 ARG CA C 461 57.818 57.818 58.688 -0.870 25932 142 1 1 . 1 1 461 461 ARG CB C 461 28.443 28.443 29.820 -1.377 25932 143 1 1 . 1 1 461 461 ARG H H 461 8.029 8.029 7.976 0.053 25932 144 1 1 . 1 1 462 462 PHE N N 462 118.777 118.777 120.205 -1.428 25932 145 1 1 . 1 1 462 462 PHE C C 462 177.127 177.127 176.533 0.594 25932 146 1 1 . 1 1 462 462 PHE CA C 462 60.624 60.624 61.079 -0.455 25932 147 1 1 . 1 1 462 462 PHE CB C 462 38.633 38.633 38.917 -0.284 25932 148 1 1 . 1 1 462 462 PHE H H 462 8.460 8.460 8.397 0.063 25932 149 1 1 . 1 1 463 463 CYS N N 463 116.386 116.386 116.182 0.204 25932 150 1 1 . 1 1 463 463 CYS C C 463 175.980 175.980 176.571 -0.591 25932 151 1 1 . 1 1 463 463 CYS CA C 463 61.999 61.999 61.421 0.578 25932 152 1 1 . 1 1 463 463 CYS CB C 463 26.966 26.966 28.878 -1.912 25932 153 1 1 . 1 1 463 463 CYS H H 463 8.278 8.278 8.162 0.116 25932 154 1 1 . 1 1 464 464 GLY N N 464 107.774 107.774 109.172 -1.398 25932 155 1 1 . 1 1 464 464 GLY C C 464 174.990 174.990 176.336 -1.346 25932 156 1 1 . 1 1 464 464 GLY CA C 464 45.944 45.944 46.980 -1.036 25932 157 1 1 . 1 1 464 464 GLY H H 464 8.050 8.050 7.883 0.167 25932 158 1 1 . 1 1 465 465 ILE N N 465 119.940 119.940 120.522 -0.582 25932 159 1 1 . 1 1 465 465 ILE C C 465 176.458 176.458 176.136 0.322 25932 160 1 1 . 1 1 465 465 ILE CA C 465 62.423 62.423 63.099 -0.676 25932 161 1 1 . 1 1 465 465 ILE CB C 465 37.409 37.409 38.381 -0.972 25932 162 1 1 . 1 1 465 465 ILE H H 465 7.745 7.745 8.233 -0.488 25932 163 1 1 . 1 1 466 466 TYR N N 466 118.846 118.846 119.419 -0.573 25932 164 1 1 . 1 1 466 466 TYR C C 466 176.150 176.150 176.153 -0.003 25932 165 1 1 . 1 1 466 466 TYR CA C 466 58.429 58.429 59.483 -1.054 25932 166 1 1 . 1 1 466 466 TYR CB C 466 37.917 37.917 38.479 -0.562 25932 167 1 1 . 1 1 466 466 TYR H H 466 7.807 7.807 7.251 0.556 25932 168 1 1 . 1 1 467 467 GLY N N 467 107.987 107.987 107.217 0.770 25932 169 1 1 . 1 1 467 467 GLY C C 467 174.143 174.143 175.060 -0.917 25932 170 1 1 . 1 1 467 467 GLY CA C 467 45.547 45.547 45.982 -0.435 25932 171 1 1 . 1 1 467 467 GLY H H 467 7.887 7.887 7.649 0.238 25932 172 1 1 . 1 1 468 468 TYR N N 468 119.878 119.878 120.383 -0.505 25932 173 1 1 . 1 1 468 468 TYR C C 468 175.524 175.524 177.185 -1.661 25932 174 1 1 . 1 1 468 468 TYR CA C 468 58.164 58.164 60.455 -2.291 25932 175 1 1 . 1 1 468 468 TYR CB C 468 37.786 37.786 38.386 -0.600 25932 176 1 1 . 1 1 468 468 TYR H H 468 7.867 7.867 7.728 0.139 25932 177 1 1 . 1 1 469 469 ARG N N 469 121.174 121.174 117.688 3.486 25932 178 1 1 . 1 1 469 469 ARG C C 469 175.800 175.800 175.707 0.093 25932 179 1 1 . 1 1 469 469 ARG CA C 469 55.334 55.334 56.208 -0.874 25932 180 1 1 . 1 1 469 469 ARG CB C 469 30.035 30.035 27.746 2.289 25932 181 1 1 . 1 1 469 469 ARG H H 469 7.873 7.873 8.357 -0.484 25932 182 1 1 . 1 1 470 470 LEU N N 470 121.718 121.718 116.847 4.871 25932 183 1 1 . 1 1 470 470 LEU C C 470 176.618 176.618 177.912 -1.294 25932 184 1 1 . 1 1 470 470 LEU CA C 470 54.858 54.858 56.715 -1.857 25932 185 1 1 . 1 1 470 470 LEU CB C 470 41.331 41.331 41.615 -0.284 25932 186 1 1 . 1 1 470 470 LEU H H 470 7.940 7.940 8.218 -0.278 25932 187 1 1 . 1 1 471 471 ARG N N 471 120.624 120.624 120.484 0.140 25932 188 1 1 . 1 1 471 471 ARG CA C 471 55.308 55.308 56.414 -1.106 25932 189 1 1 . 1 1 471 471 ARG CB C 471 30.010 30.010 29.808 0.202 25932 190 1 1 . 1 1 471 471 ARG H H 471 7.922 7.922 7.467 0.455 25932 191 1 1 . 1 1 472 472 ARG C C 472 175.258 175.258 175.363 -0.105 25932 192 1 1 . 1 1 472 472 ARG CA C 472 55.704 55.704 55.923 -0.220 25932 193 1 1 . 1 1 472 472 ARG CB C 472 29.851 29.851 31.108 -1.257 25932 194 1 2 . 1 1 433 433 SER C C 433 174.143 174.143 174.332 -0.189 25932 195 1 2 . 1 1 433 433 SER CA C 433 57.715 57.715 59.776 -2.061 25932 196 1 2 . 1 1 433 433 SER CB C 433 63.602 63.602 63.472 0.130 25932 197 1 2 . 1 1 434 434 TRP N N 434 122.746 122.746 121.005 1.741 25932 198 1 2 . 1 1 434 434 TRP C C 434 175.587 175.587 175.002 0.585 25932 199 1 2 . 1 1 434 434 TRP CA C 434 56.604 56.604 56.321 0.283 25932 200 1 2 . 1 1 434 434 TRP CB C 434 29.269 29.269 30.605 -1.336 25932 201 1 2 . 1 1 434 434 TRP H H 434 8.283 8.283 7.736 0.547 25932 202 1 2 . 1 1 435 435 ASP N N 435 121.374 121.374 123.528 -2.154 25932 203 1 2 . 1 1 435 435 ASP C C 435 176.543 176.543 177.172 -0.629 25932 204 1 2 . 1 1 435 435 ASP CA C 435 53.562 53.562 53.741 -0.179 25932 205 1 2 . 1 1 435 435 ASP CB C 435 40.854 40.854 42.038 -1.184 25932 206 1 2 . 1 1 435 435 ASP H H 435 8.219 8.219 8.747 -0.528 25932 207 1 2 . 1 1 436 436 THR N N 436 116.111 116.111 117.143 -1.032 25932 208 1 2 . 1 1 436 436 THR C C 436 175.651 175.651 176.356 -0.705 25932 209 1 2 . 1 1 436 436 THR CA C 436 65.015 65.015 64.961 0.054 25932 210 1 2 . 1 1 436 436 THR CB C 436 68.416 68.416 69.174 -0.758 25932 211 1 2 . 1 1 436 436 THR H H 436 8.251 8.251 8.568 -0.317 25932 212 1 2 . 1 1 437 437 GLU N N 437 121.374 121.374 120.764 0.610 25932 213 1 2 . 1 1 437 437 GLU C C 437 177.988 177.988 178.620 -0.632 25932 214 1 2 . 1 1 437 437 GLU CA C 437 59.513 59.513 59.774 -0.261 25932 215 1 2 . 1 1 437 437 GLU CB C 437 28.370 28.370 29.447 -1.077 25932 216 1 2 . 1 1 437 437 GLU H H 437 8.897 8.897 8.803 0.094 25932 217 1 2 . 1 1 438 438 SER N N 438 115.658 115.658 115.524 0.134 25932 218 1 2 . 1 1 438 438 SER C C 438 175.832 175.832 176.862 -1.030 25932 219 1 2 . 1 1 438 438 SER CA C 438 60.889 60.889 61.467 -0.578 25932 220 1 2 . 1 1 438 438 SER CB C 438 62.491 62.491 62.569 -0.078 25932 221 1 2 . 1 1 438 438 SER H H 438 8.018 8.018 7.740 0.278 25932 222 1 2 . 1 1 439 439 VAL N N 439 122.608 122.608 122.186 0.422 25932 223 1 2 . 1 1 439 439 VAL C C 439 177.743 177.743 177.966 -0.223 25932 224 1 2 . 1 1 439 439 VAL CA C 439 65.861 65.861 66.208 -0.347 25932 225 1 2 . 1 1 439 439 VAL CB C 439 30.698 30.698 31.449 -0.751 25932 226 1 2 . 1 1 439 439 VAL H H 439 7.908 7.908 7.260 0.648 25932 227 1 2 . 1 1 440 440 LEU N N 440 120.077 120.077 119.672 0.405 25932 228 1 2 . 1 1 440 440 LEU C C 440 178.466 178.466 178.632 -0.166 25932 229 1 2 . 1 1 440 440 LEU CA C 440 57.953 57.953 58.087 -0.134 25932 230 1 2 . 1 1 440 440 LEU CB C 440 40.378 40.378 41.548 -1.170 25932 231 1 2 . 1 1 440 440 LEU H H 440 8.171 8.171 8.296 -0.125 25932 232 1 2 . 1 1 441 441 ALA N N 441 119.465 119.465 121.161 -1.696 25932 233 1 2 . 1 1 441 441 ALA C C 441 178.986 178.986 179.339 -0.353 25932 234 1 2 . 1 1 441 441 ALA CA C 441 55.122 55.122 54.642 0.480 25932 235 1 2 . 1 1 441 441 ALA CB C 441 17.367 17.367 18.119 -0.752 25932 236 1 2 . 1 1 441 441 ALA H H 441 8.090 8.090 7.705 0.385 25932 237 1 2 . 1 1 442 442 MET N N 442 116.111 116.111 117.211 -1.100 25932 238 1 2 . 1 1 442 442 MET C C 442 178.073 178.073 178.058 0.015 25932 239 1 2 . 1 1 442 442 MET CA C 442 58.217 58.217 59.149 -0.932 25932 240 1 2 . 1 1 442 442 MET CB C 442 31.597 31.597 32.511 -0.914 25932 241 1 2 . 1 1 442 442 MET H H 442 7.875 7.875 7.434 0.441 25932 242 1 2 . 1 1 443 443 TRP N N 443 119.802 119.802 118.151 1.651 25932 243 1 2 . 1 1 443 443 TRP C C 443 178.445 178.445 177.786 0.659 25932 244 1 2 . 1 1 443 443 TRP CA C 443 60.624 60.624 59.263 1.361 25932 245 1 2 . 1 1 443 443 TRP CB C 443 28.899 28.899 28.383 0.516 25932 246 1 2 . 1 1 443 443 TRP H H 443 8.196 8.196 7.456 0.740 25932 247 1 2 . 1 1 444 444 VAL N N 444 118.509 118.509 121.553 -3.044 25932 248 1 2 . 1 1 444 444 VAL C C 444 177.563 177.563 178.248 -0.685 25932 249 1 2 . 1 1 444 444 VAL CA C 444 66.866 66.866 66.725 0.141 25932 250 1 2 . 1 1 444 444 VAL CB C 444 30.221 30.221 30.702 -0.481 25932 251 1 2 . 1 1 444 444 VAL H H 444 8.353 8.353 6.424 1.929 25932 252 1 2 . 1 1 445 445 LEU N N 445 119.328 119.328 119.697 -0.369 25932 253 1 2 . 1 1 445 445 LEU C C 445 178.168 178.168 178.824 -0.656 25932 254 1 2 . 1 1 445 445 LEU CA C 445 57.979 57.979 58.014 -0.035 25932 255 1 2 . 1 1 445 445 LEU CB C 445 40.431 40.431 41.171 -0.740 25932 256 1 2 . 1 1 445 445 LEU H H 445 8.233 8.233 7.406 0.827 25932 257 1 2 . 1 1 446 446 ALA N N 446 120.009 120.009 122.264 -2.255 25932 258 1 2 . 1 1 446 446 ALA C C 446 179.071 179.071 179.724 -0.653 25932 259 1 2 . 1 1 446 446 ALA CA C 446 55.096 55.096 55.188 -0.091 25932 260 1 2 . 1 1 446 446 ALA CB C 446 16.996 16.996 18.178 -1.182 25932 261 1 2 . 1 1 446 446 ALA H H 446 8.402 8.402 7.779 0.623 25932 262 1 2 . 1 1 447 447 LEU N N 447 117.136 117.136 119.334 -2.198 25932 263 1 2 . 1 1 447 447 LEU C C 447 178.678 178.678 179.180 -0.502 25932 264 1 2 . 1 1 447 447 LEU CA C 447 57.767 57.767 57.936 -0.169 25932 265 1 2 . 1 1 447 447 LEU CB C 447 40.378 40.378 41.969 -1.591 25932 266 1 2 . 1 1 447 447 LEU H H 447 8.244 8.244 8.190 0.054 25932 267 1 2 . 1 1 448 448 ILE N N 448 119.121 119.121 119.750 -0.629 25932 268 1 2 . 1 1 448 448 ILE C C 448 177.574 177.574 178.200 -0.626 25932 269 1 2 . 1 1 448 448 ILE CA C 448 65.702 65.702 65.734 -0.032 25932 270 1 2 . 1 1 448 448 ILE CB C 448 36.464 36.464 37.731 -1.267 25932 271 1 2 . 1 1 448 448 ILE H H 448 8.286 8.286 7.791 0.495 25932 272 1 2 . 1 1 449 449 VAL N N 449 119.052 119.052 120.191 -1.139 25932 273 1 2 . 1 1 449 449 VAL C C 449 179.135 179.135 178.376 0.759 25932 274 1 2 . 1 1 449 449 VAL CA C 449 67.051 67.051 66.956 0.095 25932 275 1 2 . 1 1 449 449 VAL CB C 449 30.175 30.175 31.222 -1.047 25932 276 1 2 . 1 1 449 449 VAL H H 449 8.327 8.327 7.804 0.523 25932 277 1 2 . 1 1 450 450 ILE N N 450 123.014 123.014 120.702 2.312 25932 278 1 2 . 1 1 450 450 ILE C C 450 177.074 177.074 178.352 -1.278 25932 279 1 2 . 1 1 450 450 ILE CA C 450 65.594 65.594 64.125 1.469 25932 280 1 2 . 1 1 450 450 ILE CB C 450 36.594 36.594 36.491 0.103 25932 281 1 2 . 1 1 450 450 ILE H H 450 8.670 8.670 7.917 0.753 25932 282 1 2 . 1 1 451 451 PHE N N 451 119.392 119.392 119.352 0.040 25932 283 1 2 . 1 1 451 451 PHE C C 451 177.297 177.297 178.288 -0.991 25932 284 1 2 . 1 1 451 451 PHE CA C 451 61.389 61.389 62.757 -1.367 25932 285 1 2 . 1 1 451 451 PHE CB C 451 37.970 37.970 38.122 -0.152 25932 286 1 2 . 1 1 451 451 PHE H H 451 8.651 8.651 7.959 0.692 25932 287 1 2 . 1 1 452 452 LEU N N 452 118.367 118.367 119.565 -1.198 25932 288 1 2 . 1 1 452 452 LEU C C 452 177.967 177.967 179.038 -1.071 25932 289 1 2 . 1 1 452 452 LEU CA C 452 57.606 57.606 58.315 -0.709 25932 290 1 2 . 1 1 452 452 LEU CB C 452 40.924 40.924 41.472 -0.548 25932 291 1 2 . 1 1 452 452 LEU H H 452 8.731 8.731 8.215 0.516 25932 292 1 2 . 1 1 453 453 THR N N 453 116.173 116.173 116.831 -0.658 25932 293 1 2 . 1 1 453 453 THR C C 453 176.220 176.220 176.828 -0.608 25932 294 1 2 . 1 1 453 453 THR CA C 453 67.919 67.919 67.263 0.656 25932 295 1 2 . 1 1 453 453 THR CB C 453 67.006 67.006 68.729 -1.723 25932 296 1 2 . 1 1 453 453 THR H H 453 8.104 8.104 8.232 -0.128 25932 297 1 2 . 1 1 454 454 ILE N N 454 120.077 120.077 121.505 -1.428 25932 298 1 2 . 1 1 454 454 ILE C C 454 176.915 176.915 177.549 -0.634 25932 299 1 2 . 1 1 454 454 ILE CA C 454 65.041 65.041 65.145 -0.104 25932 300 1 2 . 1 1 454 454 ILE CB C 454 36.464 36.464 37.679 -1.215 25932 301 1 2 . 1 1 454 454 ILE H H 454 8.043 8.043 8.301 -0.258 25932 302 1 2 . 1 1 455 455 ALA N N 455 121.174 121.174 122.733 -1.559 25932 303 1 2 . 1 1 455 455 ALA C C 455 178.806 178.806 179.620 -0.814 25932 304 1 2 . 1 1 455 455 ALA CA C 455 55.346 55.346 55.483 -0.137 25932 305 1 2 . 1 1 455 455 ALA CB C 455 16.890 16.890 18.062 -1.172 25932 306 1 2 . 1 1 455 455 ALA H H 455 8.265 8.265 8.497 -0.232 25932 307 1 2 . 1 1 456 456 VAL N N 456 116.661 116.661 119.020 -2.359 25932 308 1 2 . 1 1 456 456 VAL C C 456 177.489 177.489 178.017 -0.528 25932 309 1 2 . 1 1 456 456 VAL CA C 456 66.494 66.494 66.754 -0.260 25932 310 1 2 . 1 1 456 456 VAL CB C 456 30.226 30.226 31.777 -1.551 25932 311 1 2 . 1 1 456 456 VAL H H 456 8.211 8.211 7.854 0.357 25932 312 1 2 . 1 1 457 457 LEU N N 457 119.465 119.465 119.988 -0.523 25932 313 1 2 . 1 1 457 457 LEU C C 457 179.517 179.517 179.147 0.370 25932 314 1 2 . 1 1 457 457 LEU CA C 457 58.056 58.056 58.035 0.021 25932 315 1 2 . 1 1 457 457 LEU CB C 457 40.414 40.414 41.556 -1.141 25932 316 1 2 . 1 1 457 457 LEU H H 457 8.150 8.150 7.482 0.668 25932 317 1 2 . 1 1 458 458 LEU N N 458 118.436 118.436 119.249 -0.813 25932 318 1 2 . 1 1 458 458 LEU C C 458 178.891 178.891 179.083 -0.192 25932 319 1 2 . 1 1 458 458 LEU CA C 458 57.395 57.395 58.017 -0.622 25932 320 1 2 . 1 1 458 458 LEU CB C 458 40.484 40.484 41.460 -0.976 25932 321 1 2 . 1 1 458 458 LEU H H 458 8.542 8.542 7.998 0.544 25932 322 1 2 . 1 1 459 459 ALA N N 459 122.337 122.337 121.749 0.588 25932 323 1 2 . 1 1 459 459 ALA C C 459 179.793 179.793 179.476 0.317 25932 324 1 2 . 1 1 459 459 ALA CA C 459 55.122 55.122 55.087 0.036 25932 325 1 2 . 1 1 459 459 ALA CB C 459 17.208 17.208 18.628 -1.420 25932 326 1 2 . 1 1 459 459 ALA H H 459 8.401 8.401 8.105 0.296 25932 327 1 2 . 1 1 460 460 LEU N N 460 117.961 117.961 120.624 -2.663 25932 328 1 2 . 1 1 460 460 LEU C C 460 179.262 179.262 178.720 0.542 25932 329 1 2 . 1 1 460 460 LEU CA C 460 57.673 57.673 58.019 -0.346 25932 330 1 2 . 1 1 460 460 LEU CB C 460 40.414 40.414 41.493 -1.079 25932 331 1 2 . 1 1 460 460 LEU H H 460 8.518 8.518 8.461 0.057 25932 332 1 2 . 1 1 461 461 ARG N N 461 119.534 119.534 119.516 0.018 25932 333 1 2 . 1 1 461 461 ARG C C 461 178.625 178.625 178.505 0.120 25932 334 1 2 . 1 1 461 461 ARG CA C 461 57.818 57.818 59.079 -1.261 25932 335 1 2 . 1 1 461 461 ARG CB C 461 28.443 28.443 29.861 -1.418 25932 336 1 2 . 1 1 461 461 ARG H H 461 8.029 8.029 7.945 0.084 25932 337 1 2 . 1 1 462 462 PHE N N 462 118.777 118.777 120.640 -1.863 25932 338 1 2 . 1 1 462 462 PHE C C 462 177.127 177.127 177.785 -0.658 25932 339 1 2 . 1 1 462 462 PHE CA C 462 60.624 60.624 61.264 -0.640 25932 340 1 2 . 1 1 462 462 PHE CB C 462 38.633 38.633 39.120 -0.487 25932 341 1 2 . 1 1 462 462 PHE H H 462 8.460 8.460 8.083 0.377 25932 342 1 2 . 1 1 463 463 CYS N N 463 116.386 116.386 117.472 -1.086 25932 343 1 2 . 1 1 463 463 CYS C C 463 175.980 175.980 177.043 -1.063 25932 344 1 2 . 1 1 463 463 CYS CA C 463 61.999 61.999 63.043 -1.044 25932 345 1 2 . 1 1 463 463 CYS CB C 463 26.966 26.966 28.211 -1.245 25932 346 1 2 . 1 1 463 463 CYS H H 463 8.278 8.278 8.797 -0.519 25932 347 1 2 . 1 1 464 464 GLY N N 464 107.774 107.774 109.340 -1.566 25932 348 1 2 . 1 1 464 464 GLY C C 464 174.990 174.990 175.428 -0.438 25932 349 1 2 . 1 1 464 464 GLY CA C 464 45.944 45.944 46.876 -0.932 25932 350 1 2 . 1 1 464 464 GLY H H 464 8.050 8.050 8.190 -0.140 25932 351 1 2 . 1 1 465 465 ILE N N 465 119.940 119.940 118.694 1.246 25932 352 1 2 . 1 1 465 465 ILE C C 465 176.458 176.458 175.288 1.170 25932 353 1 2 . 1 1 465 465 ILE CA C 465 62.423 62.423 61.525 0.898 25932 354 1 2 . 1 1 465 465 ILE CB C 465 37.409 37.409 38.222 -0.813 25932 355 1 2 . 1 1 465 465 ILE H H 465 7.745 7.745 7.650 0.095 25932 356 1 2 . 1 1 466 466 TYR N N 466 118.846 118.846 118.949 -0.103 25932 357 1 2 . 1 1 466 466 TYR C C 466 176.150 176.150 175.766 0.384 25932 358 1 2 . 1 1 466 466 TYR CA C 466 58.429 58.429 57.010 1.419 25932 359 1 2 . 1 1 466 466 TYR CB C 466 37.917 37.917 39.210 -1.293 25932 360 1 2 . 1 1 466 466 TYR H H 466 7.807 7.807 7.362 0.445 25932 361 1 2 . 1 1 467 467 GLY N N 467 107.987 107.987 106.973 1.014 25932 362 1 2 . 1 1 467 467 GLY C C 467 174.143 174.143 174.327 -0.184 25932 363 1 2 . 1 1 467 467 GLY CA C 467 45.547 45.547 45.201 0.346 25932 364 1 2 . 1 1 467 467 GLY H H 467 7.887 7.887 7.638 0.249 25932 365 1 2 . 1 1 468 468 TYR N N 468 119.878 119.878 119.389 0.489 25932 366 1 2 . 1 1 468 468 TYR C C 468 175.524 175.524 174.874 0.650 25932 367 1 2 . 1 1 468 468 TYR CA C 468 58.164 58.164 58.403 -0.239 25932 368 1 2 . 1 1 468 468 TYR CB C 468 37.786 37.786 38.181 -0.395 25932 369 1 2 . 1 1 468 468 TYR H H 468 7.867 7.867 7.913 -0.046 25932 370 1 2 . 1 1 469 469 ARG N N 469 121.174 121.174 125.661 -4.487 25932 371 1 2 . 1 1 469 469 ARG C C 469 175.800 175.800 174.984 0.816 25932 372 1 2 . 1 1 469 469 ARG CA C 469 55.334 55.334 55.837 -0.502 25932 373 1 2 . 1 1 469 469 ARG CB C 469 30.035 30.035 30.918 -0.883 25932 374 1 2 . 1 1 469 469 ARG H H 469 7.873 7.873 8.050 -0.177 25932 375 1 2 . 1 1 470 470 LEU N N 470 121.718 121.718 123.046 -1.328 25932 376 1 2 . 1 1 470 470 LEU C C 470 176.618 176.618 177.159 -0.541 25932 377 1 2 . 1 1 470 470 LEU CA C 470 54.858 54.858 53.858 1.000 25932 378 1 2 . 1 1 470 470 LEU CB C 470 41.331 41.331 42.356 -1.025 25932 379 1 2 . 1 1 470 470 LEU H H 470 7.940 7.940 8.169 -0.229 25932 380 1 2 . 1 1 471 471 ARG N N 471 120.624 120.624 123.953 -3.329 25932 381 1 2 . 1 1 471 471 ARG CA C 471 55.308 55.308 57.115 -1.807 25932 382 1 2 . 1 1 471 471 ARG CB C 471 30.010 30.010 30.761 -0.750 25932 383 1 2 . 1 1 471 471 ARG H H 471 7.922 7.922 8.539 -0.617 25932 384 1 2 . 1 1 472 472 ARG C C 472 175.258 175.258 174.777 0.481 25932 385 1 2 . 1 1 472 472 ARG CA C 472 55.704 55.704 57.604 -1.900 25932 386 1 2 . 1 1 472 472 ARG CB C 472 29.851 29.851 28.884 0.967 25932 387 1 3 . 1 1 433 433 SER C C 433 174.143 174.143 175.129 -0.986 25932 388 1 3 . 1 1 433 433 SER CA C 433 57.715 57.715 60.329 -2.614 25932 389 1 3 . 1 1 433 433 SER CB C 433 63.602 63.602 62.931 0.671 25932 390 1 3 . 1 1 434 434 TRP N N 434 122.746 122.746 122.660 0.086 25932 391 1 3 . 1 1 434 434 TRP C C 434 175.587 175.587 178.426 -2.839 25932 392 1 3 . 1 1 434 434 TRP CA C 434 56.604 56.604 59.836 -3.232 25932 393 1 3 . 1 1 434 434 TRP CB C 434 29.269 29.269 29.203 0.066 25932 394 1 3 . 1 1 434 434 TRP H H 434 8.283 8.283 7.959 0.324 25932 395 1 3 . 1 1 435 435 ASP N N 435 121.374 121.374 117.919 3.455 25932 396 1 3 . 1 1 435 435 ASP C C 435 176.543 176.543 178.045 -1.502 25932 397 1 3 . 1 1 435 435 ASP CA C 435 53.562 53.562 56.582 -3.020 25932 398 1 3 . 1 1 435 435 ASP CB C 435 40.854 40.854 39.529 1.325 25932 399 1 3 . 1 1 435 435 ASP H H 435 8.219 8.219 8.106 0.113 25932 400 1 3 . 1 1 436 436 THR N N 436 116.111 116.111 112.152 3.959 25932 401 1 3 . 1 1 436 436 THR C C 436 175.651 175.651 176.496 -0.845 25932 402 1 3 . 1 1 436 436 THR CA C 436 65.015 65.015 65.159 -0.144 25932 403 1 3 . 1 1 436 436 THR CB C 436 68.416 68.416 68.195 0.221 25932 404 1 3 . 1 1 436 436 THR H H 436 8.251 8.251 7.672 0.579 25932 405 1 3 . 1 1 437 437 GLU N N 437 121.374 121.374 121.618 -0.244 25932 406 1 3 . 1 1 437 437 GLU C C 437 177.988 177.988 178.865 -0.877 25932 407 1 3 . 1 1 437 437 GLU CA C 437 59.513 59.513 59.498 0.014 25932 408 1 3 . 1 1 437 437 GLU CB C 437 28.370 28.370 29.180 -0.810 25932 409 1 3 . 1 1 437 437 GLU H H 437 8.897 8.897 7.819 1.078 25932 410 1 3 . 1 1 438 438 SER N N 438 115.658 115.658 115.555 0.103 25932 411 1 3 . 1 1 438 438 SER C C 438 175.832 175.832 176.661 -0.829 25932 412 1 3 . 1 1 438 438 SER CA C 438 60.889 60.889 61.432 -0.543 25932 413 1 3 . 1 1 438 438 SER CB C 438 62.491 62.491 62.622 -0.131 25932 414 1 3 . 1 1 438 438 SER H H 438 8.018 8.018 7.767 0.251 25932 415 1 3 . 1 1 439 439 VAL N N 439 122.608 122.608 122.533 0.075 25932 416 1 3 . 1 1 439 439 VAL C C 439 177.743 177.743 177.843 -0.100 25932 417 1 3 . 1 1 439 439 VAL CA C 439 65.861 65.861 65.680 0.181 25932 418 1 3 . 1 1 439 439 VAL CB C 439 30.698 30.698 31.437 -0.739 25932 419 1 3 . 1 1 439 439 VAL H H 439 7.908 7.908 7.299 0.609 25932 420 1 3 . 1 1 440 440 LEU N N 440 120.077 120.077 119.573 0.504 25932 421 1 3 . 1 1 440 440 LEU C C 440 178.466 178.466 178.649 -0.183 25932 422 1 3 . 1 1 440 440 LEU CA C 440 57.953 57.953 58.231 -0.278 25932 423 1 3 . 1 1 440 440 LEU CB C 440 40.378 40.378 41.486 -1.108 25932 424 1 3 . 1 1 440 440 LEU H H 440 8.171 8.171 8.333 -0.162 25932 425 1 3 . 1 1 441 441 ALA N N 441 119.465 119.465 121.187 -1.722 25932 426 1 3 . 1 1 441 441 ALA C C 441 178.986 178.986 179.388 -0.402 25932 427 1 3 . 1 1 441 441 ALA CA C 441 55.122 55.122 54.666 0.456 25932 428 1 3 . 1 1 441 441 ALA CB C 441 17.367 17.367 18.146 -0.779 25932 429 1 3 . 1 1 441 441 ALA H H 441 8.090 8.090 7.707 0.383 25932 430 1 3 . 1 1 442 442 MET N N 442 116.111 116.111 117.228 -1.117 25932 431 1 3 . 1 1 442 442 MET C C 442 178.073 178.073 178.085 -0.012 25932 432 1 3 . 1 1 442 442 MET CA C 442 58.217 58.217 59.144 -0.927 25932 433 1 3 . 1 1 442 442 MET CB C 442 31.597 31.597 32.530 -0.933 25932 434 1 3 . 1 1 442 442 MET H H 442 7.875 7.875 7.457 0.418 25932 435 1 3 . 1 1 443 443 TRP N N 443 119.802 119.802 118.242 1.560 25932 436 1 3 . 1 1 443 443 TRP C C 443 178.445 178.445 177.779 0.666 25932 437 1 3 . 1 1 443 443 TRP CA C 443 60.624 60.624 59.335 1.289 25932 438 1 3 . 1 1 443 443 TRP CB C 443 28.899 28.899 28.391 0.508 25932 439 1 3 . 1 1 443 443 TRP H H 443 8.196 8.196 7.505 0.691 25932 440 1 3 . 1 1 444 444 VAL N N 444 118.509 118.509 121.581 -3.072 25932 441 1 3 . 1 1 444 444 VAL C C 444 177.563 177.563 178.245 -0.682 25932 442 1 3 . 1 1 444 444 VAL CA C 444 66.866 66.866 66.413 0.453 25932 443 1 3 . 1 1 444 444 VAL CB C 444 30.221 30.221 30.479 -0.258 25932 444 1 3 . 1 1 444 444 VAL H H 444 8.353 8.353 6.379 1.974 25932 445 1 3 . 1 1 445 445 LEU N N 445 119.328 119.328 121.094 -1.766 25932 446 1 3 . 1 1 445 445 LEU C C 445 178.168 178.168 178.347 -0.179 25932 447 1 3 . 1 1 445 445 LEU CA C 445 57.979 57.979 57.965 0.014 25932 448 1 3 . 1 1 445 445 LEU CB C 445 40.431 40.431 41.128 -0.697 25932 449 1 3 . 1 1 445 445 LEU H H 445 8.233 8.233 7.453 0.780 25932 450 1 3 . 1 1 446 446 ALA N N 446 120.009 120.009 122.046 -2.037 25932 451 1 3 . 1 1 446 446 ALA C C 446 179.071 179.071 179.741 -0.670 25932 452 1 3 . 1 1 446 446 ALA CA C 446 55.096 55.096 55.243 -0.147 25932 453 1 3 . 1 1 446 446 ALA CB C 446 16.996 16.996 18.226 -1.230 25932 454 1 3 . 1 1 446 446 ALA H H 446 8.402 8.402 7.806 0.596 25932 455 1 3 . 1 1 447 447 LEU N N 447 117.136 117.136 119.682 -2.546 25932 456 1 3 . 1 1 447 447 LEU C C 447 178.678 178.678 179.089 -0.411 25932 457 1 3 . 1 1 447 447 LEU CA C 447 57.767 57.767 58.221 -0.454 25932 458 1 3 . 1 1 447 447 LEU CB C 447 40.378 40.378 41.934 -1.556 25932 459 1 3 . 1 1 447 447 LEU H H 447 8.244 8.244 8.347 -0.103 25932 460 1 3 . 1 1 448 448 ILE N N 448 119.121 119.121 120.016 -0.895 25932 461 1 3 . 1 1 448 448 ILE C C 448 177.574 177.574 178.167 -0.593 25932 462 1 3 . 1 1 448 448 ILE CA C 448 65.702 65.702 65.892 -0.190 25932 463 1 3 . 1 1 448 448 ILE CB C 448 36.464 36.464 37.726 -1.262 25932 464 1 3 . 1 1 448 448 ILE H H 448 8.286 8.286 8.032 0.254 25932 465 1 3 . 1 1 449 449 VAL N N 449 119.052 119.052 119.993 -0.941 25932 466 1 3 . 1 1 449 449 VAL C C 449 179.135 179.135 178.263 0.872 25932 467 1 3 . 1 1 449 449 VAL CA C 449 67.051 67.051 67.182 -0.131 25932 468 1 3 . 1 1 449 449 VAL CB C 449 30.175 30.175 31.255 -1.080 25932 469 1 3 . 1 1 449 449 VAL H H 449 8.327 8.327 7.868 0.459 25932 470 1 3 . 1 1 450 450 ILE N N 450 123.014 123.014 120.737 2.277 25932 471 1 3 . 1 1 450 450 ILE C C 450 177.074 177.074 177.983 -0.909 25932 472 1 3 . 1 1 450 450 ILE CA C 450 65.594 65.594 65.512 0.082 25932 473 1 3 . 1 1 450 450 ILE CB C 450 36.594 36.594 37.597 -1.004 25932 474 1 3 . 1 1 450 450 ILE H H 450 8.670 8.670 7.777 0.893 25932 475 1 3 . 1 1 451 451 PHE N N 451 119.392 119.392 118.922 0.470 25932 476 1 3 . 1 1 451 451 PHE C C 451 177.297 177.297 177.954 -0.657 25932 477 1 3 . 1 1 451 451 PHE CA C 451 61.389 61.389 62.620 -1.231 25932 478 1 3 . 1 1 451 451 PHE CB C 451 37.970 37.970 38.284 -0.314 25932 479 1 3 . 1 1 451 451 PHE H H 451 8.651 8.651 7.882 0.769 25932 480 1 3 . 1 1 452 452 LEU N N 452 118.367 118.367 119.670 -1.303 25932 481 1 3 . 1 1 452 452 LEU C C 452 177.967 177.967 179.039 -1.072 25932 482 1 3 . 1 1 452 452 LEU CA C 452 57.606 57.606 58.336 -0.730 25932 483 1 3 . 1 1 452 452 LEU CB C 452 40.924 40.924 41.473 -0.549 25932 484 1 3 . 1 1 452 452 LEU H H 452 8.731 8.731 8.298 0.433 25932 485 1 3 . 1 1 453 453 THR N N 453 116.173 116.173 116.723 -0.550 25932 486 1 3 . 1 1 453 453 THR C C 453 176.220 176.220 176.785 -0.565 25932 487 1 3 . 1 1 453 453 THR CA C 453 67.919 67.919 67.459 0.460 25932 488 1 3 . 1 1 453 453 THR CB C 453 67.006 67.006 68.747 -1.741 25932 489 1 3 . 1 1 453 453 THR H H 453 8.104 8.104 8.206 -0.102 25932 490 1 3 . 1 1 454 454 ILE N N 454 120.077 120.077 121.426 -1.349 25932 491 1 3 . 1 1 454 454 ILE C C 454 176.915 176.915 177.513 -0.598 25932 492 1 3 . 1 1 454 454 ILE CA C 454 65.041 65.041 65.216 -0.175 25932 493 1 3 . 1 1 454 454 ILE CB C 454 36.464 36.464 37.724 -1.260 25932 494 1 3 . 1 1 454 454 ILE H H 454 8.043 8.043 8.284 -0.241 25932 495 1 3 . 1 1 455 455 ALA N N 455 121.174 121.174 122.855 -1.681 25932 496 1 3 . 1 1 455 455 ALA C C 455 178.806 178.806 179.666 -0.860 25932 497 1 3 . 1 1 455 455 ALA CA C 455 55.346 55.346 55.561 -0.215 25932 498 1 3 . 1 1 455 455 ALA CB C 455 16.890 16.890 18.144 -1.254 25932 499 1 3 . 1 1 455 455 ALA H H 455 8.265 8.265 8.598 -0.333 25932 500 1 3 . 1 1 456 456 VAL N N 456 116.661 116.661 119.197 -2.536 25932 501 1 3 . 1 1 456 456 VAL C C 456 177.489 177.489 177.995 -0.506 25932 502 1 3 . 1 1 456 456 VAL CA C 456 66.494 66.494 66.384 0.110 25932 503 1 3 . 1 1 456 456 VAL CB C 456 30.226 30.226 31.453 -1.226 25932 504 1 3 . 1 1 456 456 VAL H H 456 8.211 8.211 7.834 0.377 25932 505 1 3 . 1 1 457 457 LEU N N 457 119.465 119.465 119.854 -0.389 25932 506 1 3 . 1 1 457 457 LEU C C 457 179.517 179.517 179.161 0.356 25932 507 1 3 . 1 1 457 457 LEU CA C 457 58.056 58.056 58.176 -0.120 25932 508 1 3 . 1 1 457 457 LEU CB C 457 40.414 40.414 41.505 -1.091 25932 509 1 3 . 1 1 457 457 LEU H H 457 8.150 8.150 7.503 0.647 25932 510 1 3 . 1 1 458 458 LEU N N 458 118.436 118.436 119.262 -0.826 25932 511 1 3 . 1 1 458 458 LEU C C 458 178.891 178.891 179.082 -0.191 25932 512 1 3 . 1 1 458 458 LEU CA C 458 57.395 57.395 58.026 -0.631 25932 513 1 3 . 1 1 458 458 LEU CB C 458 40.484 40.484 41.461 -0.977 25932 514 1 3 . 1 1 458 458 LEU H H 458 8.542 8.542 8.014 0.528 25932 515 1 3 . 1 1 459 459 ALA N N 459 122.337 122.337 121.720 0.617 25932 516 1 3 . 1 1 459 459 ALA C C 459 179.793 179.793 179.480 0.313 25932 517 1 3 . 1 1 459 459 ALA CA C 459 55.122 55.122 55.078 0.044 25932 518 1 3 . 1 1 459 459 ALA CB C 459 17.208 17.208 18.631 -1.423 25932 519 1 3 . 1 1 459 459 ALA H H 459 8.401 8.401 8.117 0.284 25932 520 1 3 . 1 1 460 460 LEU N N 460 117.961 117.961 120.619 -2.658 25932 521 1 3 . 1 1 460 460 LEU C C 460 179.262 179.262 178.720 0.542 25932 522 1 3 . 1 1 460 460 LEU CA C 460 57.673 57.673 58.015 -0.342 25932 523 1 3 . 1 1 460 460 LEU CB C 460 40.414 40.414 41.500 -1.086 25932 524 1 3 . 1 1 460 460 LEU H H 460 8.518 8.518 8.476 0.042 25932 525 1 3 . 1 1 461 461 ARG N N 461 119.534 119.534 119.543 -0.009 25932 526 1 3 . 1 1 461 461 ARG C C 461 178.625 178.625 178.479 0.146 25932 527 1 3 . 1 1 461 461 ARG CA C 461 57.818 57.818 59.106 -1.288 25932 528 1 3 . 1 1 461 461 ARG CB C 461 28.443 28.443 29.861 -1.418 25932 529 1 3 . 1 1 461 461 ARG H H 461 8.029 8.029 7.983 0.046 25932 530 1 3 . 1 1 462 462 PHE N N 462 118.777 118.777 120.477 -1.700 25932 531 1 3 . 1 1 462 462 PHE C C 462 177.127 177.127 177.620 -0.493 25932 532 1 3 . 1 1 462 462 PHE CA C 462 60.624 60.624 61.216 -0.592 25932 533 1 3 . 1 1 462 462 PHE CB C 462 38.633 38.633 39.134 -0.501 25932 534 1 3 . 1 1 462 462 PHE H H 462 8.460 8.460 8.045 0.415 25932 535 1 3 . 1 1 463 463 CYS N N 463 116.386 116.386 117.451 -1.065 25932 536 1 3 . 1 1 463 463 CYS C C 463 175.980 175.980 177.027 -1.047 25932 537 1 3 . 1 1 463 463 CYS CA C 463 61.999 61.999 63.508 -1.509 25932 538 1 3 . 1 1 463 463 CYS CB C 463 26.966 26.966 28.614 -1.648 25932 539 1 3 . 1 1 463 463 CYS H H 463 8.278 8.278 8.703 -0.425 25932 540 1 3 . 1 1 464 464 GLY N N 464 107.774 107.774 109.329 -1.555 25932 541 1 3 . 1 1 464 464 GLY C C 464 174.990 174.990 175.398 -0.408 25932 542 1 3 . 1 1 464 464 GLY CA C 464 45.944 45.944 46.868 -0.924 25932 543 1 3 . 1 1 464 464 GLY H H 464 8.050 8.050 8.240 -0.190 25932 544 1 3 . 1 1 465 465 ILE N N 465 119.940 119.940 118.711 1.229 25932 545 1 3 . 1 1 465 465 ILE C C 465 176.458 176.458 175.252 1.206 25932 546 1 3 . 1 1 465 465 ILE CA C 465 62.423 62.423 61.534 0.889 25932 547 1 3 . 1 1 465 465 ILE CB C 465 37.409 37.409 38.215 -0.806 25932 548 1 3 . 1 1 465 465 ILE H H 465 7.745 7.745 7.725 0.020 25932 549 1 3 . 1 1 466 466 TYR N N 466 118.846 118.846 118.981 -0.135 25932 550 1 3 . 1 1 466 466 TYR C C 466 176.150 176.150 175.680 0.470 25932 551 1 3 . 1 1 466 466 TYR CA C 466 58.429 58.429 57.124 1.305 25932 552 1 3 . 1 1 466 466 TYR CB C 466 37.917 37.917 39.122 -1.205 25932 553 1 3 . 1 1 466 466 TYR H H 466 7.807 7.807 7.317 0.490 25932 554 1 3 . 1 1 467 467 GLY N N 467 107.987 107.987 107.092 0.895 25932 555 1 3 . 1 1 467 467 GLY C C 467 174.143 174.143 174.252 -0.109 25932 556 1 3 . 1 1 467 467 GLY CA C 467 45.547 45.547 45.295 0.252 25932 557 1 3 . 1 1 467 467 GLY H H 467 7.887 7.887 7.614 0.273 25932 558 1 3 . 1 1 468 468 TYR N N 468 119.878 119.878 120.032 -0.154 25932 559 1 3 . 1 1 468 468 TYR C C 468 175.524 175.524 174.256 1.268 25932 560 1 3 . 1 1 468 468 TYR CA C 468 58.164 58.164 59.281 -1.117 25932 561 1 3 . 1 1 468 468 TYR CB C 468 37.786 37.786 38.047 -0.261 25932 562 1 3 . 1 1 468 468 TYR H H 468 7.867 7.867 8.223 -0.356 25932 563 1 3 . 1 1 469 469 ARG N N 469 121.174 121.174 125.499 -4.325 25932 564 1 3 . 1 1 469 469 ARG C C 469 175.800 175.800 174.879 0.921 25932 565 1 3 . 1 1 469 469 ARG CA C 469 55.334 55.334 54.657 0.677 25932 566 1 3 . 1 1 469 469 ARG CB C 469 30.035 30.035 32.400 -2.365 25932 567 1 3 . 1 1 469 469 ARG H H 469 7.873 7.873 7.905 -0.032 25932 568 1 3 . 1 1 470 470 LEU N N 470 121.718 121.718 122.662 -0.944 25932 569 1 3 . 1 1 470 470 LEU C C 470 176.618 176.618 176.992 -0.374 25932 570 1 3 . 1 1 470 470 LEU CA C 470 54.858 54.858 54.007 0.851 25932 571 1 3 . 1 1 470 470 LEU CB C 470 41.331 41.331 42.837 -1.506 25932 572 1 3 . 1 1 470 470 LEU H H 470 7.940 7.940 8.271 -0.331 25932 573 1 3 . 1 1 471 471 ARG N N 471 120.624 120.624 122.818 -2.194 25932 574 1 3 . 1 1 471 471 ARG CA C 471 55.308 55.308 55.827 -0.519 25932 575 1 3 . 1 1 471 471 ARG CB C 471 30.010 30.010 30.849 -0.838 25932 576 1 3 . 1 1 471 471 ARG H H 471 7.922 7.922 8.380 -0.458 25932 577 1 3 . 1 1 472 472 ARG C C 472 175.258 175.258 175.819 -0.561 25932 578 1 3 . 1 1 472 472 ARG CA C 472 55.704 55.704 56.065 -0.361 25932 579 1 3 . 1 1 472 472 ARG CB C 472 29.851 29.851 30.621 -0.770 25932 580 1 4 . 1 1 433 433 SER C C 433 174.143 174.143 173.556 0.587 25932 581 1 4 . 1 1 433 433 SER CA C 433 57.715 57.715 57.738 -0.023 25932 582 1 4 . 1 1 433 433 SER CB C 433 63.602 63.602 64.162 -0.560 25932 583 1 4 . 1 1 434 434 TRP N N 434 122.746 122.746 121.661 1.085 25932 584 1 4 . 1 1 434 434 TRP C C 434 175.587 175.587 176.089 -0.502 25932 585 1 4 . 1 1 434 434 TRP CA C 434 56.604 56.604 57.732 -1.128 25932 586 1 4 . 1 1 434 434 TRP CB C 434 29.269 29.269 29.692 -0.423 25932 587 1 4 . 1 1 434 434 TRP H H 434 8.283 8.283 8.185 0.098 25932 588 1 4 . 1 1 435 435 ASP N N 435 121.374 121.374 120.643 0.731 25932 589 1 4 . 1 1 435 435 ASP C C 435 176.543 176.543 177.639 -1.096 25932 590 1 4 . 1 1 435 435 ASP CA C 435 53.562 53.562 54.502 -0.940 25932 591 1 4 . 1 1 435 435 ASP CB C 435 40.854 40.854 42.033 -1.179 25932 592 1 4 . 1 1 435 435 ASP H H 435 8.219 8.219 8.473 -0.254 25932 593 1 4 . 1 1 436 436 THR N N 436 116.111 116.111 114.713 1.398 25932 594 1 4 . 1 1 436 436 THR C C 436 175.651 175.651 176.582 -0.931 25932 595 1 4 . 1 1 436 436 THR CA C 436 65.015 65.015 65.500 -0.485 25932 596 1 4 . 1 1 436 436 THR CB C 436 68.416 68.416 69.406 -0.990 25932 597 1 4 . 1 1 436 436 THR H H 436 8.251 8.251 8.527 -0.276 25932 598 1 4 . 1 1 437 437 GLU N N 437 121.374 121.374 121.969 -0.595 25932 599 1 4 . 1 1 437 437 GLU C C 437 177.988 177.988 178.482 -0.494 25932 600 1 4 . 1 1 437 437 GLU CA C 437 59.513 59.513 59.426 0.087 25932 601 1 4 . 1 1 437 437 GLU CB C 437 28.370 28.370 29.154 -0.784 25932 602 1 4 . 1 1 437 437 GLU H H 437 8.897 8.897 8.769 0.128 25932 603 1 4 . 1 1 438 438 SER N N 438 115.658 115.658 115.135 0.523 25932 604 1 4 . 1 1 438 438 SER C C 438 175.832 175.832 176.669 -0.837 25932 605 1 4 . 1 1 438 438 SER CA C 438 60.889 60.889 61.425 -0.536 25932 606 1 4 . 1 1 438 438 SER CB C 438 62.491 62.491 62.433 0.058 25932 607 1 4 . 1 1 438 438 SER H H 438 8.018 8.018 7.826 0.192 25932 608 1 4 . 1 1 439 439 VAL N N 439 122.608 122.608 123.815 -1.207 25932 609 1 4 . 1 1 439 439 VAL C C 439 177.743 177.743 177.864 -0.121 25932 610 1 4 . 1 1 439 439 VAL CA C 439 65.861 65.861 65.829 0.033 25932 611 1 4 . 1 1 439 439 VAL CB C 439 30.698 30.698 31.220 -0.521 25932 612 1 4 . 1 1 439 439 VAL H H 439 7.908 7.908 7.252 0.656 25932 613 1 4 . 1 1 440 440 LEU N N 440 120.077 120.077 120.595 -0.518 25932 614 1 4 . 1 1 440 440 LEU C C 440 178.466 178.466 177.978 0.488 25932 615 1 4 . 1 1 440 440 LEU CA C 440 57.953 57.953 58.318 -0.365 25932 616 1 4 . 1 1 440 440 LEU CB C 440 40.378 40.378 41.780 -1.402 25932 617 1 4 . 1 1 440 440 LEU H H 440 8.171 8.171 8.152 0.019 25932 618 1 4 . 1 1 441 441 ALA N N 441 119.465 119.465 120.992 -1.527 25932 619 1 4 . 1 1 441 441 ALA C C 441 178.986 178.986 179.095 -0.109 25932 620 1 4 . 1 1 441 441 ALA CA C 441 55.122 55.122 54.728 0.394 25932 621 1 4 . 1 1 441 441 ALA CB C 441 17.367 17.367 18.316 -0.949 25932 622 1 4 . 1 1 441 441 ALA H H 441 8.090 8.090 7.642 0.448 25932 623 1 4 . 1 1 442 442 MET N N 442 116.111 116.111 117.353 -1.242 25932 624 1 4 . 1 1 442 442 MET C C 442 178.073 178.073 178.109 -0.036 25932 625 1 4 . 1 1 442 442 MET CA C 442 58.217 58.217 59.221 -1.004 25932 626 1 4 . 1 1 442 442 MET CB C 442 31.597 31.597 32.565 -0.968 25932 627 1 4 . 1 1 442 442 MET H H 442 7.875 7.875 7.577 0.298 25932 628 1 4 . 1 1 443 443 TRP N N 443 119.802 119.802 118.424 1.378 25932 629 1 4 . 1 1 443 443 TRP C C 443 178.445 178.445 177.779 0.666 25932 630 1 4 . 1 1 443 443 TRP CA C 443 60.624 60.624 59.387 1.237 25932 631 1 4 . 1 1 443 443 TRP CB C 443 28.899 28.899 28.506 0.393 25932 632 1 4 . 1 1 443 443 TRP H H 443 8.196 8.196 7.605 0.591 25932 633 1 4 . 1 1 444 444 VAL N N 444 118.509 118.509 121.681 -3.172 25932 634 1 4 . 1 1 444 444 VAL C C 444 177.563 177.563 178.285 -0.722 25932 635 1 4 . 1 1 444 444 VAL CA C 444 66.866 66.866 66.419 0.447 25932 636 1 4 . 1 1 444 444 VAL CB C 444 30.221 30.221 30.455 -0.234 25932 637 1 4 . 1 1 444 444 VAL H H 444 8.353 8.353 6.482 1.871 25932 638 1 4 . 1 1 445 445 LEU N N 445 119.328 119.328 121.045 -1.717 25932 639 1 4 . 1 1 445 445 LEU C C 445 178.168 178.168 178.366 -0.198 25932 640 1 4 . 1 1 445 445 LEU CA C 445 57.979 57.979 57.906 0.073 25932 641 1 4 . 1 1 445 445 LEU CB C 445 40.431 40.431 41.096 -0.665 25932 642 1 4 . 1 1 445 445 LEU H H 445 8.233 8.233 7.561 0.672 25932 643 1 4 . 1 1 446 446 ALA N N 446 120.009 120.009 122.137 -2.128 25932 644 1 4 . 1 1 446 446 ALA C C 446 179.071 179.071 179.724 -0.653 25932 645 1 4 . 1 1 446 446 ALA CA C 446 55.096 55.096 55.237 -0.141 25932 646 1 4 . 1 1 446 446 ALA CB C 446 16.996 16.996 18.240 -1.244 25932 647 1 4 . 1 1 446 446 ALA H H 446 8.402 8.402 7.838 0.564 25932 648 1 4 . 1 1 447 447 LEU N N 447 117.136 117.136 119.899 -2.763 25932 649 1 4 . 1 1 447 447 LEU C C 447 178.678 178.678 179.159 -0.481 25932 650 1 4 . 1 1 447 447 LEU CA C 447 57.767 57.767 58.309 -0.542 25932 651 1 4 . 1 1 447 447 LEU CB C 447 40.378 40.378 41.823 -1.445 25932 652 1 4 . 1 1 447 447 LEU H H 447 8.244 8.244 8.423 -0.179 25932 653 1 4 . 1 1 448 448 ILE N N 448 119.121 119.121 119.766 -0.645 25932 654 1 4 . 1 1 448 448 ILE C C 448 177.574 177.574 178.400 -0.826 25932 655 1 4 . 1 1 448 448 ILE CA C 448 65.702 65.702 65.227 0.475 25932 656 1 4 . 1 1 448 448 ILE CB C 448 36.464 36.464 36.949 -0.485 25932 657 1 4 . 1 1 448 448 ILE H H 448 8.286 8.286 8.111 0.175 25932 658 1 4 . 1 1 449 449 VAL N N 449 119.052 119.052 120.207 -1.155 25932 659 1 4 . 1 1 449 449 VAL C C 449 179.135 179.135 178.282 0.853 25932 660 1 4 . 1 1 449 449 VAL CA C 449 67.051 67.051 66.987 0.064 25932 661 1 4 . 1 1 449 449 VAL CB C 449 30.175 30.175 31.219 -1.044 25932 662 1 4 . 1 1 449 449 VAL H H 449 8.327 8.327 7.874 0.453 25932 663 1 4 . 1 1 450 450 ILE N N 450 123.014 123.014 120.582 2.432 25932 664 1 4 . 1 1 450 450 ILE C C 450 177.074 177.074 177.797 -0.723 25932 665 1 4 . 1 1 450 450 ILE CA C 450 65.594 65.594 65.451 0.143 25932 666 1 4 . 1 1 450 450 ILE CB C 450 36.594 36.594 37.580 -0.986 25932 667 1 4 . 1 1 450 450 ILE H H 450 8.670 8.670 7.666 1.004 25932 668 1 4 . 1 1 451 451 PHE N N 451 119.392 119.392 118.842 0.550 25932 669 1 4 . 1 1 451 451 PHE C C 451 177.297 177.297 177.965 -0.668 25932 670 1 4 . 1 1 451 451 PHE CA C 451 61.389 61.389 62.562 -1.173 25932 671 1 4 . 1 1 451 451 PHE CB C 451 37.970 37.970 38.300 -0.329 25932 672 1 4 . 1 1 451 451 PHE H H 451 8.651 8.651 7.876 0.775 25932 673 1 4 . 1 1 452 452 LEU N N 452 118.367 118.367 119.729 -1.362 25932 674 1 4 . 1 1 452 452 LEU C C 452 177.967 177.967 179.049 -1.082 25932 675 1 4 . 1 1 452 452 LEU CA C 452 57.606 57.606 58.242 -0.636 25932 676 1 4 . 1 1 452 452 LEU CB C 452 40.924 40.924 41.435 -0.512 25932 677 1 4 . 1 1 452 452 LEU H H 452 8.731 8.731 8.191 0.540 25932 678 1 4 . 1 1 453 453 THR N N 453 116.173 116.173 116.355 -0.182 25932 679 1 4 . 1 1 453 453 THR C C 453 176.220 176.220 176.704 -0.484 25932 680 1 4 . 1 1 453 453 THR CA C 453 67.919 67.919 67.155 0.764 25932 681 1 4 . 1 1 453 453 THR CB C 453 67.006 67.006 68.502 -1.496 25932 682 1 4 . 1 1 453 453 THR H H 453 8.104 8.104 8.152 -0.048 25932 683 1 4 . 1 1 454 454 ILE N N 454 120.077 120.077 121.137 -1.060 25932 684 1 4 . 1 1 454 454 ILE C C 454 176.915 176.915 177.421 -0.506 25932 685 1 4 . 1 1 454 454 ILE CA C 454 65.041 65.041 65.350 -0.309 25932 686 1 4 . 1 1 454 454 ILE CB C 454 36.464 36.464 37.619 -1.155 25932 687 1 4 . 1 1 454 454 ILE H H 454 8.043 8.043 8.354 -0.311 25932 688 1 4 . 1 1 455 455 ALA N N 455 121.174 121.174 122.735 -1.561 25932 689 1 4 . 1 1 455 455 ALA C C 455 178.806 178.806 179.769 -0.963 25932 690 1 4 . 1 1 455 455 ALA CA C 455 55.346 55.346 55.520 -0.174 25932 691 1 4 . 1 1 455 455 ALA CB C 455 16.890 16.890 18.088 -1.198 25932 692 1 4 . 1 1 455 455 ALA H H 455 8.265 8.265 8.504 -0.239 25932 693 1 4 . 1 1 456 456 VAL N N 456 116.661 116.661 119.294 -2.633 25932 694 1 4 . 1 1 456 456 VAL C C 456 177.489 177.489 178.189 -0.700 25932 695 1 4 . 1 1 456 456 VAL CA C 456 66.494 66.494 66.910 -0.416 25932 696 1 4 . 1 1 456 456 VAL CB C 456 30.226 30.226 31.291 -1.065 25932 697 1 4 . 1 1 456 456 VAL H H 456 8.211 8.211 7.773 0.438 25932 698 1 4 . 1 1 457 457 LEU N N 457 119.465 119.465 120.222 -0.757 25932 699 1 4 . 1 1 457 457 LEU C C 457 179.517 179.517 179.573 -0.056 25932 700 1 4 . 1 1 457 457 LEU CA C 457 58.056 58.056 58.225 -0.169 25932 701 1 4 . 1 1 457 457 LEU CB C 457 40.414 40.414 40.831 -0.417 25932 702 1 4 . 1 1 457 457 LEU H H 457 8.150 8.150 7.509 0.641 25932 703 1 4 . 1 1 458 458 LEU N N 458 118.436 118.436 119.469 -1.033 25932 704 1 4 . 1 1 458 458 LEU C C 458 178.891 178.891 179.053 -0.162 25932 705 1 4 . 1 1 458 458 LEU CA C 458 57.395 57.395 58.227 -0.832 25932 706 1 4 . 1 1 458 458 LEU CB C 458 40.484 40.484 41.356 -0.872 25932 707 1 4 . 1 1 458 458 LEU H H 458 8.542 8.542 8.059 0.483 25932 708 1 4 . 1 1 459 459 ALA N N 459 122.337 122.337 121.755 0.582 25932 709 1 4 . 1 1 459 459 ALA C C 459 179.793 179.793 179.475 0.318 25932 710 1 4 . 1 1 459 459 ALA CA C 459 55.122 55.122 55.085 0.037 25932 711 1 4 . 1 1 459 459 ALA CB C 459 17.208 17.208 18.625 -1.417 25932 712 1 4 . 1 1 459 459 ALA H H 459 8.401 8.401 8.134 0.267 25932 713 1 4 . 1 1 460 460 LEU N N 460 117.961 117.961 120.582 -2.621 25932 714 1 4 . 1 1 460 460 LEU C C 460 179.262 179.262 178.590 0.672 25932 715 1 4 . 1 1 460 460 LEU CA C 460 57.673 57.673 58.129 -0.456 25932 716 1 4 . 1 1 460 460 LEU CB C 460 40.414 40.414 41.393 -0.979 25932 717 1 4 . 1 1 460 460 LEU H H 460 8.518 8.518 8.558 -0.040 25932 718 1 4 . 1 1 461 461 ARG N N 461 119.534 119.534 119.489 0.045 25932 719 1 4 . 1 1 461 461 ARG C C 461 178.625 178.625 178.504 0.121 25932 720 1 4 . 1 1 461 461 ARG CA C 461 57.818 57.818 59.078 -1.260 25932 721 1 4 . 1 1 461 461 ARG CB C 461 28.443 28.443 29.792 -1.349 25932 722 1 4 . 1 1 461 461 ARG H H 461 8.029 8.029 8.001 0.028 25932 723 1 4 . 1 1 462 462 PHE N N 462 118.777 118.777 120.046 -1.269 25932 724 1 4 . 1 1 462 462 PHE C C 462 177.127 177.127 176.743 0.384 25932 725 1 4 . 1 1 462 462 PHE CA C 462 60.624 60.624 61.046 -0.422 25932 726 1 4 . 1 1 462 462 PHE CB C 462 38.633 38.633 38.968 -0.335 25932 727 1 4 . 1 1 462 462 PHE H H 462 8.460 8.460 8.124 0.336 25932 728 1 4 . 1 1 463 463 CYS N N 463 116.386 116.386 116.973 -0.587 25932 729 1 4 . 1 1 463 463 CYS C C 463 175.980 175.980 176.508 -0.528 25932 730 1 4 . 1 1 463 463 CYS CA C 463 61.999 61.999 62.073 -0.074 25932 731 1 4 . 1 1 463 463 CYS CB C 463 26.966 26.966 28.828 -1.862 25932 732 1 4 . 1 1 463 463 CYS H H 463 8.278 8.278 8.697 -0.419 25932 733 1 4 . 1 1 464 464 GLY N N 464 107.774 107.774 109.295 -1.521 25932 734 1 4 . 1 1 464 464 GLY C C 464 174.990 174.990 176.163 -1.173 25932 735 1 4 . 1 1 464 464 GLY CA C 464 45.944 45.944 46.953 -1.010 25932 736 1 4 . 1 1 464 464 GLY H H 464 8.050 8.050 8.319 -0.269 25932 737 1 4 . 1 1 465 465 ILE N N 465 119.940 119.940 120.555 -0.615 25932 738 1 4 . 1 1 465 465 ILE C C 465 176.458 176.458 175.310 1.148 25932 739 1 4 . 1 1 465 465 ILE CA C 465 62.423 62.423 62.571 -0.148 25932 740 1 4 . 1 1 465 465 ILE CB C 465 37.409 37.409 37.957 -0.548 25932 741 1 4 . 1 1 465 465 ILE H H 465 7.745 7.745 7.964 -0.219 25932 742 1 4 . 1 1 466 466 TYR N N 466 118.846 118.846 118.862 -0.016 25932 743 1 4 . 1 1 466 466 TYR C C 466 176.150 176.150 175.894 0.256 25932 744 1 4 . 1 1 466 466 TYR CA C 466 58.429 58.429 57.893 0.536 25932 745 1 4 . 1 1 466 466 TYR CB C 466 37.917 37.917 38.909 -0.992 25932 746 1 4 . 1 1 466 466 TYR H H 466 7.807 7.807 7.536 0.271 25932 747 1 4 . 1 1 467 467 GLY N N 467 107.987 107.987 106.899 1.088 25932 748 1 4 . 1 1 467 467 GLY C C 467 174.143 174.143 173.725 0.418 25932 749 1 4 . 1 1 467 467 GLY CA C 467 45.547 45.547 45.422 0.125 25932 750 1 4 . 1 1 467 467 GLY H H 467 7.887 7.887 7.703 0.184 25932 751 1 4 . 1 1 468 468 TYR N N 468 119.878 119.878 120.241 -0.363 25932 752 1 4 . 1 1 468 468 TYR C C 468 175.524 175.524 174.434 1.090 25932 753 1 4 . 1 1 468 468 TYR CA C 468 58.164 58.164 56.950 1.214 25932 754 1 4 . 1 1 468 468 TYR CB C 468 37.786 37.786 40.534 -2.748 25932 755 1 4 . 1 1 468 468 TYR H H 468 7.867 7.867 8.068 -0.201 25932 756 1 4 . 1 1 469 469 ARG N N 469 121.174 121.174 121.243 -0.069 25932 757 1 4 . 1 1 469 469 ARG C C 469 175.800 175.800 174.999 0.801 25932 758 1 4 . 1 1 469 469 ARG CA C 469 55.334 55.334 54.969 0.365 25932 759 1 4 . 1 1 469 469 ARG CB C 469 30.035 30.035 33.401 -3.366 25932 760 1 4 . 1 1 469 469 ARG H H 469 7.873 7.873 8.556 -0.683 25932 761 1 4 . 1 1 470 470 LEU N N 470 121.718 121.718 122.116 -0.398 25932 762 1 4 . 1 1 470 470 LEU C C 470 176.618 176.618 176.942 -0.324 25932 763 1 4 . 1 1 470 470 LEU CA C 470 54.858 54.858 54.254 0.605 25932 764 1 4 . 1 1 470 470 LEU CB C 470 41.331 41.331 43.033 -1.702 25932 765 1 4 . 1 1 470 470 LEU H H 470 7.940 7.940 8.571 -0.631 25932 766 1 4 . 1 1 471 471 ARG N N 471 120.624 120.624 122.125 -1.501 25932 767 1 4 . 1 1 471 471 ARG CA C 471 55.308 55.308 56.613 -1.305 25932 768 1 4 . 1 1 471 471 ARG CB C 471 30.010 30.010 28.994 1.016 25932 769 1 4 . 1 1 471 471 ARG H H 471 7.922 7.922 8.767 -0.845 25932 770 1 4 . 1 1 472 472 ARG C C 472 175.258 175.258 176.863 -1.605 25932 771 1 4 . 1 1 472 472 ARG CA C 472 55.704 55.704 57.852 -2.148 25932 772 1 4 . 1 1 472 472 ARG CB C 472 29.851 29.851 30.695 -0.844 25932 773 1 5 . 1 1 433 433 SER C C 433 174.143 174.143 173.192 0.951 25932 774 1 5 . 1 1 433 433 SER CA C 433 57.715 57.715 57.264 0.451 25932 775 1 5 . 1 1 433 433 SER CB C 433 63.602 63.602 64.295 -0.693 25932 776 1 5 . 1 1 434 434 TRP N N 434 122.746 122.746 121.689 1.057 25932 777 1 5 . 1 1 434 434 TRP C C 434 175.587 175.587 175.829 -0.242 25932 778 1 5 . 1 1 434 434 TRP CA C 434 56.604 56.604 56.852 -0.248 25932 779 1 5 . 1 1 434 434 TRP CB C 434 29.269 29.269 30.495 -1.226 25932 780 1 5 . 1 1 434 434 TRP H H 434 8.283 8.283 8.283 0.000 25932 781 1 5 . 1 1 435 435 ASP N N 435 121.374 121.374 123.343 -1.969 25932 782 1 5 . 1 1 435 435 ASP C C 435 176.543 176.543 177.547 -1.004 25932 783 1 5 . 1 1 435 435 ASP CA C 435 53.562 53.562 53.926 -0.364 25932 784 1 5 . 1 1 435 435 ASP CB C 435 40.854 40.854 42.623 -1.769 25932 785 1 5 . 1 1 435 435 ASP H H 435 8.219 8.219 8.564 -0.345 25932 786 1 5 . 1 1 436 436 THR N N 436 116.111 116.111 115.823 0.288 25932 787 1 5 . 1 1 436 436 THR C C 436 175.651 175.651 176.268 -0.617 25932 788 1 5 . 1 1 436 436 THR CA C 436 65.015 65.015 64.944 0.071 25932 789 1 5 . 1 1 436 436 THR CB C 436 68.416 68.416 69.105 -0.688 25932 790 1 5 . 1 1 436 436 THR H H 436 8.251 8.251 8.489 -0.238 25932 791 1 5 . 1 1 437 437 GLU N N 437 121.374 121.374 121.370 0.004 25932 792 1 5 . 1 1 437 437 GLU C C 437 177.988 177.988 178.854 -0.866 25932 793 1 5 . 1 1 437 437 GLU CA C 437 59.513 59.513 59.755 -0.242 25932 794 1 5 . 1 1 437 437 GLU CB C 437 28.370 28.370 29.181 -0.811 25932 795 1 5 . 1 1 437 437 GLU H H 437 8.897 8.897 8.912 -0.015 25932 796 1 5 . 1 1 438 438 SER N N 438 115.658 115.658 115.207 0.451 25932 797 1 5 . 1 1 438 438 SER C C 438 175.832 175.832 176.599 -0.767 25932 798 1 5 . 1 1 438 438 SER CA C 438 60.889 60.889 61.539 -0.650 25932 799 1 5 . 1 1 438 438 SER CB C 438 62.491 62.491 63.108 -0.617 25932 800 1 5 . 1 1 438 438 SER H H 438 8.018 8.018 7.781 0.237 25932 801 1 5 . 1 1 439 439 VAL N N 439 122.608 122.608 123.594 -0.986 25932 802 1 5 . 1 1 439 439 VAL C C 439 177.743 177.743 177.774 -0.031 25932 803 1 5 . 1 1 439 439 VAL CA C 439 65.861 65.861 66.013 -0.152 25932 804 1 5 . 1 1 439 439 VAL CB C 439 30.698 30.698 31.793 -1.095 25932 805 1 5 . 1 1 439 439 VAL H H 439 7.908 7.908 7.143 0.765 25932 806 1 5 . 1 1 440 440 LEU N N 440 120.077 120.077 120.312 -0.235 25932 807 1 5 . 1 1 440 440 LEU C C 440 178.466 178.466 177.972 0.494 25932 808 1 5 . 1 1 440 440 LEU CA C 440 57.953 57.953 58.055 -0.102 25932 809 1 5 . 1 1 440 440 LEU CB C 440 40.378 40.378 41.944 -1.566 25932 810 1 5 . 1 1 440 440 LEU H H 440 8.171 8.171 8.204 -0.033 25932 811 1 5 . 1 1 441 441 ALA N N 441 119.465 119.465 121.102 -1.637 25932 812 1 5 . 1 1 441 441 ALA C C 441 178.986 178.986 179.508 -0.522 25932 813 1 5 . 1 1 441 441 ALA CA C 441 55.122 55.122 54.772 0.350 25932 814 1 5 . 1 1 441 441 ALA CB C 441 17.367 17.367 18.192 -0.824 25932 815 1 5 . 1 1 441 441 ALA H H 441 8.090 8.090 7.666 0.424 25932 816 1 5 . 1 1 442 442 MET N N 442 116.111 116.111 117.050 -0.939 25932 817 1 5 . 1 1 442 442 MET C C 442 178.073 178.073 178.105 -0.032 25932 818 1 5 . 1 1 442 442 MET CA C 442 58.217 58.217 57.698 0.519 25932 819 1 5 . 1 1 442 442 MET CB C 442 31.597 31.597 31.691 -0.094 25932 820 1 5 . 1 1 442 442 MET H H 442 7.875 7.875 7.437 0.438 25932 821 1 5 . 1 1 443 443 TRP N N 443 119.802 119.802 118.623 1.179 25932 822 1 5 . 1 1 443 443 TRP C C 443 178.445 178.445 178.033 0.412 25932 823 1 5 . 1 1 443 443 TRP CA C 443 60.624 60.624 59.345 1.279 25932 824 1 5 . 1 1 443 443 TRP CB C 443 28.899 28.899 28.194 0.705 25932 825 1 5 . 1 1 443 443 TRP H H 443 8.196 8.196 7.469 0.727 25932 826 1 5 . 1 1 444 444 VAL N N 444 118.509 118.509 121.529 -3.020 25932 827 1 5 . 1 1 444 444 VAL C C 444 177.563 177.563 178.244 -0.681 25932 828 1 5 . 1 1 444 444 VAL CA C 444 66.866 66.866 66.492 0.374 25932 829 1 5 . 1 1 444 444 VAL CB C 444 30.221 30.221 30.617 -0.396 25932 830 1 5 . 1 1 444 444 VAL H H 444 8.353 8.353 6.410 1.943 25932 831 1 5 . 1 1 445 445 LEU N N 445 119.328 119.328 119.682 -0.354 25932 832 1 5 . 1 1 445 445 LEU C C 445 178.168 178.168 178.859 -0.691 25932 833 1 5 . 1 1 445 445 LEU CA C 445 57.979 57.979 58.001 -0.022 25932 834 1 5 . 1 1 445 445 LEU CB C 445 40.431 40.431 41.151 -0.720 25932 835 1 5 . 1 1 445 445 LEU H H 445 8.233 8.233 7.373 0.860 25932 836 1 5 . 1 1 446 446 ALA N N 446 120.009 120.009 122.177 -2.168 25932 837 1 5 . 1 1 446 446 ALA C C 446 179.071 179.071 179.706 -0.635 25932 838 1 5 . 1 1 446 446 ALA CA C 446 55.096 55.096 55.171 -0.075 25932 839 1 5 . 1 1 446 446 ALA CB C 446 16.996 16.996 18.177 -1.181 25932 840 1 5 . 1 1 446 446 ALA H H 446 8.402 8.402 7.751 0.651 25932 841 1 5 . 1 1 447 447 LEU N N 447 117.136 117.136 119.467 -2.331 25932 842 1 5 . 1 1 447 447 LEU C C 447 178.678 178.678 179.246 -0.568 25932 843 1 5 . 1 1 447 447 LEU CA C 447 57.767 57.767 57.799 -0.032 25932 844 1 5 . 1 1 447 447 LEU CB C 447 40.378 40.378 41.848 -1.470 25932 845 1 5 . 1 1 447 447 LEU H H 447 8.244 8.244 8.086 0.158 25932 846 1 5 . 1 1 448 448 ILE N N 448 119.121 119.121 119.613 -0.492 25932 847 1 5 . 1 1 448 448 ILE C C 448 177.574 177.574 178.551 -0.977 25932 848 1 5 . 1 1 448 448 ILE CA C 448 65.702 65.702 64.205 1.497 25932 849 1 5 . 1 1 448 448 ILE CB C 448 36.464 36.464 36.378 0.086 25932 850 1 5 . 1 1 448 448 ILE H H 448 8.286 8.286 7.719 0.567 25932 851 1 5 . 1 1 449 449 VAL N N 449 119.052 119.052 120.387 -1.335 25932 852 1 5 . 1 1 449 449 VAL C C 449 179.135 179.135 178.237 0.898 25932 853 1 5 . 1 1 449 449 VAL CA C 449 67.051 67.051 66.954 0.098 25932 854 1 5 . 1 1 449 449 VAL CB C 449 30.175 30.175 31.249 -1.074 25932 855 1 5 . 1 1 449 449 VAL H H 449 8.327 8.327 7.688 0.639 25932 856 1 5 . 1 1 450 450 ILE N N 450 123.014 123.014 120.653 2.361 25932 857 1 5 . 1 1 450 450 ILE C C 450 177.074 177.074 177.804 -0.730 25932 858 1 5 . 1 1 450 450 ILE CA C 450 65.594 65.594 65.526 0.068 25932 859 1 5 . 1 1 450 450 ILE CB C 450 36.594 36.594 37.581 -0.987 25932 860 1 5 . 1 1 450 450 ILE H H 450 8.670 8.670 7.817 0.853 25932 861 1 5 . 1 1 451 451 PHE N N 451 119.392 119.392 118.762 0.630 25932 862 1 5 . 1 1 451 451 PHE C C 451 177.297 177.297 177.974 -0.677 25932 863 1 5 . 1 1 451 451 PHE CA C 451 61.389 61.389 62.605 -1.216 25932 864 1 5 . 1 1 451 451 PHE CB C 451 37.970 37.970 38.313 -0.343 25932 865 1 5 . 1 1 451 451 PHE H H 451 8.651 8.651 7.949 0.702 25932 866 1 5 . 1 1 452 452 LEU N N 452 118.367 118.367 119.875 -1.508 25932 867 1 5 . 1 1 452 452 LEU C C 452 177.967 177.967 179.079 -1.112 25932 868 1 5 . 1 1 452 452 LEU CA C 452 57.606 57.606 58.267 -0.661 25932 869 1 5 . 1 1 452 452 LEU CB C 452 40.924 40.924 41.442 -0.518 25932 870 1 5 . 1 1 452 452 LEU H H 452 8.731 8.731 8.263 0.468 25932 871 1 5 . 1 1 453 453 THR N N 453 116.173 116.173 116.507 -0.334 25932 872 1 5 . 1 1 453 453 THR C C 453 176.220 176.220 176.806 -0.586 25932 873 1 5 . 1 1 453 453 THR CA C 453 67.919 67.919 66.900 1.019 25932 874 1 5 . 1 1 453 453 THR CB C 453 67.006 67.006 68.428 -1.422 25932 875 1 5 . 1 1 453 453 THR H H 453 8.104 8.104 8.327 -0.223 25932 876 1 5 . 1 1 454 454 ILE N N 454 120.077 120.077 121.166 -1.089 25932 877 1 5 . 1 1 454 454 ILE C C 454 176.915 176.915 177.439 -0.524 25932 878 1 5 . 1 1 454 454 ILE CA C 454 65.041 65.041 65.329 -0.288 25932 879 1 5 . 1 1 454 454 ILE CB C 454 36.464 36.464 37.568 -1.104 25932 880 1 5 . 1 1 454 454 ILE H H 454 8.043 8.043 8.386 -0.343 25932 881 1 5 . 1 1 455 455 ALA N N 455 121.174 121.174 123.002 -1.828 25932 882 1 5 . 1 1 455 455 ALA C C 455 178.806 178.806 179.672 -0.866 25932 883 1 5 . 1 1 455 455 ALA CA C 455 55.346 55.346 55.580 -0.234 25932 884 1 5 . 1 1 455 455 ALA CB C 455 16.890 16.890 18.117 -1.228 25932 885 1 5 . 1 1 455 455 ALA H H 455 8.265 8.265 8.581 -0.316 25932 886 1 5 . 1 1 456 456 VAL N N 456 116.661 116.661 119.068 -2.407 25932 887 1 5 . 1 1 456 456 VAL C C 456 177.489 177.489 178.040 -0.551 25932 888 1 5 . 1 1 456 456 VAL CA C 456 66.494 66.494 66.271 0.223 25932 889 1 5 . 1 1 456 456 VAL CB C 456 30.226 30.226 31.411 -1.185 25932 890 1 5 . 1 1 456 456 VAL H H 456 8.211 8.211 7.864 0.347 25932 891 1 5 . 1 1 457 457 LEU N N 457 119.465 119.465 119.840 -0.375 25932 892 1 5 . 1 1 457 457 LEU C C 457 179.517 179.517 179.172 0.345 25932 893 1 5 . 1 1 457 457 LEU CA C 457 58.056 58.056 58.175 -0.119 25932 894 1 5 . 1 1 457 457 LEU CB C 457 40.414 40.414 41.520 -1.106 25932 895 1 5 . 1 1 457 457 LEU H H 457 8.150 8.150 7.487 0.663 25932 896 1 5 . 1 1 458 458 LEU N N 458 118.436 118.436 119.233 -0.797 25932 897 1 5 . 1 1 458 458 LEU C C 458 178.891 178.891 179.043 -0.152 25932 898 1 5 . 1 1 458 458 LEU CA C 458 57.395 57.395 58.005 -0.610 25932 899 1 5 . 1 1 458 458 LEU CB C 458 40.484 40.484 41.447 -0.963 25932 900 1 5 . 1 1 458 458 LEU H H 458 8.542 8.542 8.091 0.451 25932 901 1 5 . 1 1 459 459 ALA N N 459 122.337 122.337 121.684 0.653 25932 902 1 5 . 1 1 459 459 ALA C C 459 179.793 179.793 179.435 0.358 25932 903 1 5 . 1 1 459 459 ALA CA C 459 55.122 55.122 55.039 0.083 25932 904 1 5 . 1 1 459 459 ALA CB C 459 17.208 17.208 18.600 -1.392 25932 905 1 5 . 1 1 459 459 ALA H H 459 8.401 8.401 8.106 0.295 25932 906 1 5 . 1 1 460 460 LEU N N 460 117.961 117.961 120.617 -2.656 25932 907 1 5 . 1 1 460 460 LEU C C 460 179.262 179.262 178.638 0.624 25932 908 1 5 . 1 1 460 460 LEU CA C 460 57.673 57.673 58.022 -0.349 25932 909 1 5 . 1 1 460 460 LEU CB C 460 40.414 40.414 41.518 -1.104 25932 910 1 5 . 1 1 460 460 LEU H H 460 8.518 8.518 8.463 0.055 25932 911 1 5 . 1 1 461 461 ARG N N 461 119.534 119.534 119.338 0.196 25932 912 1 5 . 1 1 461 461 ARG C C 461 178.625 178.625 178.255 0.370 25932 913 1 5 . 1 1 461 461 ARG CA C 461 57.818 57.818 59.337 -1.519 25932 914 1 5 . 1 1 461 461 ARG CB C 461 28.443 28.443 29.823 -1.380 25932 915 1 5 . 1 1 461 461 ARG H H 461 8.029 8.029 7.990 0.039 25932 916 1 5 . 1 1 462 462 PHE N N 462 118.777 118.777 120.962 -2.185 25932 917 1 5 . 1 1 462 462 PHE C C 462 177.127 177.127 176.843 0.284 25932 918 1 5 . 1 1 462 462 PHE CA C 462 60.624 60.624 61.177 -0.553 25932 919 1 5 . 1 1 462 462 PHE CB C 462 38.633 38.633 38.947 -0.314 25932 920 1 5 . 1 1 462 462 PHE H H 462 8.460 8.460 7.908 0.552 25932 921 1 5 . 1 1 463 463 CYS N N 463 116.386 116.386 116.274 0.112 25932 922 1 5 . 1 1 463 463 CYS C C 463 175.980 175.980 176.451 -0.471 25932 923 1 5 . 1 1 463 463 CYS CA C 463 61.999 61.999 62.250 -0.251 25932 924 1 5 . 1 1 463 463 CYS CB C 463 26.966 26.966 27.415 -0.449 25932 925 1 5 . 1 1 463 463 CYS H H 463 8.278 8.278 8.411 -0.133 25932 926 1 5 . 1 1 464 464 GLY N N 464 107.774 107.774 108.813 -1.039 25932 927 1 5 . 1 1 464 464 GLY C C 464 174.990 174.990 175.421 -0.431 25932 928 1 5 . 1 1 464 464 GLY CA C 464 45.944 45.944 46.715 -0.771 25932 929 1 5 . 1 1 464 464 GLY H H 464 8.050 8.050 8.031 0.019 25932 930 1 5 . 1 1 465 465 ILE N N 465 119.940 119.940 118.630 1.310 25932 931 1 5 . 1 1 465 465 ILE C C 465 176.458 176.458 175.531 0.927 25932 932 1 5 . 1 1 465 465 ILE CA C 465 62.423 62.423 61.419 1.004 25932 933 1 5 . 1 1 465 465 ILE CB C 465 37.409 37.409 38.421 -1.012 25932 934 1 5 . 1 1 465 465 ILE H H 465 7.745 7.745 7.682 0.063 25932 935 1 5 . 1 1 466 466 TYR N N 466 118.846 118.846 120.064 -1.218 25932 936 1 5 . 1 1 466 466 TYR C C 466 176.150 176.150 175.986 0.164 25932 937 1 5 . 1 1 466 466 TYR CA C 466 58.429 58.429 57.728 0.701 25932 938 1 5 . 1 1 466 466 TYR CB C 466 37.917 37.917 39.162 -1.245 25932 939 1 5 . 1 1 466 466 TYR H H 466 7.807 7.807 7.023 0.784 25932 940 1 5 . 1 1 467 467 GLY N N 467 107.987 107.987 107.329 0.658 25932 941 1 5 . 1 1 467 467 GLY C C 467 174.143 174.143 174.443 -0.300 25932 942 1 5 . 1 1 467 467 GLY CA C 467 45.547 45.547 45.485 0.062 25932 943 1 5 . 1 1 467 467 GLY H H 467 7.887 7.887 7.576 0.311 25932 944 1 5 . 1 1 468 468 TYR N N 468 119.878 119.878 117.922 1.956 25932 945 1 5 . 1 1 468 468 TYR C C 468 175.524 175.524 175.409 0.115 25932 946 1 5 . 1 1 468 468 TYR CA C 468 58.164 58.164 61.269 -3.105 25932 947 1 5 . 1 1 468 468 TYR CB C 468 37.786 37.786 37.106 0.680 25932 948 1 5 . 1 1 468 468 TYR H H 468 7.867 7.867 7.948 -0.081 25932 949 1 5 . 1 1 469 469 ARG N N 469 121.174 121.174 120.557 0.617 25932 950 1 5 . 1 1 469 469 ARG C C 469 175.800 175.800 176.227 -0.427 25932 951 1 5 . 1 1 469 469 ARG CA C 469 55.334 55.334 55.056 0.278 25932 952 1 5 . 1 1 469 469 ARG CB C 469 30.035 30.035 32.307 -2.272 25932 953 1 5 . 1 1 469 469 ARG H H 469 7.873 7.873 8.298 -0.425 25932 954 1 5 . 1 1 470 470 LEU N N 470 121.718 121.718 121.950 -0.232 25932 955 1 5 . 1 1 470 470 LEU C C 470 176.618 176.618 177.706 -1.088 25932 956 1 5 . 1 1 470 470 LEU CA C 470 54.858 54.858 56.285 -1.427 25932 957 1 5 . 1 1 470 470 LEU CB C 470 41.331 41.331 42.361 -1.030 25932 958 1 5 . 1 1 470 470 LEU H H 470 7.940 7.940 8.508 -0.568 25932 959 1 5 . 1 1 471 471 ARG N N 471 120.624 120.624 118.698 1.926 25932 960 1 5 . 1 1 471 471 ARG CA C 471 55.308 55.308 55.331 -0.023 25932 961 1 5 . 1 1 471 471 ARG CB C 471 30.010 30.010 31.633 -1.623 25932 962 1 5 . 1 1 471 471 ARG H H 471 7.922 7.922 7.738 0.184 25932 963 1 5 . 1 1 472 472 ARG C C 472 175.258 175.258 175.840 -0.582 25932 964 1 5 . 1 1 472 472 ARG CA C 472 55.704 55.704 55.621 0.083 25932 965 1 5 . 1 1 472 472 ARG CB C 472 29.851 29.851 31.677 -1.826 25932 966 1 6 . 1 1 433 433 SER C C 433 174.143 174.143 173.115 1.028 25932 967 1 6 . 1 1 433 433 SER CA C 433 57.715 57.715 57.466 0.249 25932 968 1 6 . 1 1 433 433 SER CB C 433 63.602 63.602 65.029 -1.427 25932 969 1 6 . 1 1 434 434 TRP N N 434 122.746 122.746 121.667 1.079 25932 970 1 6 . 1 1 434 434 TRP C C 434 175.587 175.587 175.766 -0.179 25932 971 1 6 . 1 1 434 434 TRP CA C 434 56.604 56.604 56.881 -0.277 25932 972 1 6 . 1 1 434 434 TRP CB C 434 29.269 29.269 30.712 -1.444 25932 973 1 6 . 1 1 434 434 TRP H H 434 8.283 8.283 8.319 -0.036 25932 974 1 6 . 1 1 435 435 ASP N N 435 121.374 121.374 123.097 -1.723 25932 975 1 6 . 1 1 435 435 ASP C C 435 176.543 176.543 177.332 -0.789 25932 976 1 6 . 1 1 435 435 ASP CA C 435 53.562 53.562 53.320 0.242 25932 977 1 6 . 1 1 435 435 ASP CB C 435 40.854 40.854 41.738 -0.884 25932 978 1 6 . 1 1 435 435 ASP H H 435 8.219 8.219 8.808 -0.589 25932 979 1 6 . 1 1 436 436 THR N N 436 116.111 116.111 118.050 -1.939 25932 980 1 6 . 1 1 436 436 THR C C 436 175.651 175.651 176.387 -0.736 25932 981 1 6 . 1 1 436 436 THR CA C 436 65.015 65.015 64.828 0.187 25932 982 1 6 . 1 1 436 436 THR CB C 436 68.416 68.416 69.101 -0.685 25932 983 1 6 . 1 1 436 436 THR H H 436 8.251 8.251 8.663 -0.412 25932 984 1 6 . 1 1 437 437 GLU N N 437 121.374 121.374 122.284 -0.910 25932 985 1 6 . 1 1 437 437 GLU C C 437 177.988 177.988 178.880 -0.892 25932 986 1 6 . 1 1 437 437 GLU CA C 437 59.513 59.513 59.443 0.070 25932 987 1 6 . 1 1 437 437 GLU CB C 437 28.370 28.370 29.265 -0.895 25932 988 1 6 . 1 1 437 437 GLU H H 437 8.897 8.897 9.389 -0.492 25932 989 1 6 . 1 1 438 438 SER N N 438 115.658 115.658 115.778 -0.120 25932 990 1 6 . 1 1 438 438 SER C C 438 175.832 175.832 176.442 -0.610 25932 991 1 6 . 1 1 438 438 SER CA C 438 60.889 60.889 61.929 -1.040 25932 992 1 6 . 1 1 438 438 SER CB C 438 62.491 62.491 62.891 -0.400 25932 993 1 6 . 1 1 438 438 SER H H 438 8.018 8.018 7.731 0.287 25932 994 1 6 . 1 1 439 439 VAL N N 439 122.608 122.608 121.759 0.849 25932 995 1 6 . 1 1 439 439 VAL C C 439 177.743 177.743 177.627 0.116 25932 996 1 6 . 1 1 439 439 VAL CA C 439 65.861 65.861 66.375 -0.514 25932 997 1 6 . 1 1 439 439 VAL CB C 439 30.698 30.698 31.628 -0.930 25932 998 1 6 . 1 1 439 439 VAL H H 439 7.908 7.908 7.191 0.717 25932 999 1 6 . 1 1 440 440 LEU N N 440 120.077 120.077 121.031 -0.954 25932 1000 1 6 . 1 1 440 440 LEU C C 440 178.466 178.466 178.230 0.236 25932 1001 1 6 . 1 1 440 440 LEU CA C 440 57.953 57.953 58.239 -0.286 25932 1002 1 6 . 1 1 440 440 LEU CB C 440 40.378 40.378 41.737 -1.359 25932 1003 1 6 . 1 1 440 440 LEU H H 440 8.171 8.171 8.388 -0.217 25932 1004 1 6 . 1 1 441 441 ALA N N 441 119.465 119.465 121.236 -1.771 25932 1005 1 6 . 1 1 441 441 ALA C C 441 178.986 178.986 179.574 -0.588 25932 1006 1 6 . 1 1 441 441 ALA CA C 441 55.122 55.122 54.818 0.304 25932 1007 1 6 . 1 1 441 441 ALA CB C 441 17.367 17.367 18.272 -0.905 25932 1008 1 6 . 1 1 441 441 ALA H H 441 8.090 8.090 7.836 0.254 25932 1009 1 6 . 1 1 442 442 MET N N 442 116.111 116.111 117.179 -1.068 25932 1010 1 6 . 1 1 442 442 MET C C 442 178.073 178.073 178.154 -0.081 25932 1011 1 6 . 1 1 442 442 MET CA C 442 58.217 58.217 57.691 0.526 25932 1012 1 6 . 1 1 442 442 MET CB C 442 31.597 31.597 31.770 -0.173 25932 1013 1 6 . 1 1 442 442 MET H H 442 7.875 7.875 7.635 0.240 25932 1014 1 6 . 1 1 443 443 TRP N N 443 119.802 119.802 118.933 0.869 25932 1015 1 6 . 1 1 443 443 TRP C C 443 178.445 178.445 177.854 0.591 25932 1016 1 6 . 1 1 443 443 TRP CA C 443 60.624 60.624 59.488 1.136 25932 1017 1 6 . 1 1 443 443 TRP CB C 443 28.899 28.899 28.044 0.855 25932 1018 1 6 . 1 1 443 443 TRP H H 443 8.196 8.196 7.633 0.563 25932 1019 1 6 . 1 1 444 444 VAL N N 444 118.509 118.509 121.792 -3.283 25932 1020 1 6 . 1 1 444 444 VAL C C 444 177.563 177.563 178.054 -0.491 25932 1021 1 6 . 1 1 444 444 VAL CA C 444 66.866 66.866 65.834 1.032 25932 1022 1 6 . 1 1 444 444 VAL CB C 444 30.221 30.221 30.283 -0.062 25932 1023 1 6 . 1 1 444 444 VAL H H 444 8.353 8.353 6.441 1.912 25932 1024 1 6 . 1 1 445 445 LEU N N 445 119.328 119.328 120.844 -1.516 25932 1025 1 6 . 1 1 445 445 LEU C C 445 178.168 178.168 178.304 -0.136 25932 1026 1 6 . 1 1 445 445 LEU CA C 445 57.979 57.979 57.891 0.088 25932 1027 1 6 . 1 1 445 445 LEU CB C 445 40.431 40.431 41.126 -0.695 25932 1028 1 6 . 1 1 445 445 LEU H H 445 8.233 8.233 7.369 0.864 25932 1029 1 6 . 1 1 446 446 ALA N N 446 120.009 120.009 122.121 -2.112 25932 1030 1 6 . 1 1 446 446 ALA C C 446 179.071 179.071 179.724 -0.653 25932 1031 1 6 . 1 1 446 446 ALA CA C 446 55.096 55.096 55.237 -0.141 25932 1032 1 6 . 1 1 446 446 ALA CB C 446 16.996 16.996 18.264 -1.268 25932 1033 1 6 . 1 1 446 446 ALA H H 446 8.402 8.402 7.763 0.639 25932 1034 1 6 . 1 1 447 447 LEU N N 447 117.136 117.136 119.659 -2.523 25932 1035 1 6 . 1 1 447 447 LEU C C 447 178.678 178.678 179.095 -0.417 25932 1036 1 6 . 1 1 447 447 LEU CA C 447 57.767 57.767 58.187 -0.420 25932 1037 1 6 . 1 1 447 447 LEU CB C 447 40.378 40.378 41.919 -1.541 25932 1038 1 6 . 1 1 447 447 LEU H H 447 8.244 8.244 8.422 -0.178 25932 1039 1 6 . 1 1 448 448 ILE N N 448 119.121 119.121 119.601 -0.480 25932 1040 1 6 . 1 1 448 448 ILE C C 448 177.574 177.574 178.092 -0.518 25932 1041 1 6 . 1 1 448 448 ILE CA C 448 65.702 65.702 66.014 -0.312 25932 1042 1 6 . 1 1 448 448 ILE CB C 448 36.464 36.464 37.826 -1.362 25932 1043 1 6 . 1 1 448 448 ILE H H 448 8.286 8.286 8.163 0.123 25932 1044 1 6 . 1 1 449 449 VAL N N 449 119.052 119.052 120.002 -0.950 25932 1045 1 6 . 1 1 449 449 VAL C C 449 179.135 179.135 177.996 1.139 25932 1046 1 6 . 1 1 449 449 VAL CA C 449 67.051 67.051 67.113 -0.062 25932 1047 1 6 . 1 1 449 449 VAL CB C 449 30.175 30.175 31.728 -1.553 25932 1048 1 6 . 1 1 449 449 VAL H H 449 8.327 8.327 7.703 0.624 25932 1049 1 6 . 1 1 450 450 ILE N N 450 123.014 123.014 120.393 2.621 25932 1050 1 6 . 1 1 450 450 ILE C C 450 177.074 177.074 177.867 -0.793 25932 1051 1 6 . 1 1 450 450 ILE CA C 450 65.594 65.594 65.313 0.281 25932 1052 1 6 . 1 1 450 450 ILE CB C 450 36.594 36.594 37.615 -1.021 25932 1053 1 6 . 1 1 450 450 ILE H H 450 8.670 8.670 7.558 1.112 25932 1054 1 6 . 1 1 451 451 PHE N N 451 119.392 119.392 118.938 0.454 25932 1055 1 6 . 1 1 451 451 PHE C C 451 177.297 177.297 177.976 -0.679 25932 1056 1 6 . 1 1 451 451 PHE CA C 451 61.389 61.389 62.480 -1.091 25932 1057 1 6 . 1 1 451 451 PHE CB C 451 37.970 37.970 38.228 -0.258 25932 1058 1 6 . 1 1 451 451 PHE H H 451 8.651 8.651 7.766 0.885 25932 1059 1 6 . 1 1 452 452 LEU N N 452 118.367 118.367 119.617 -1.250 25932 1060 1 6 . 1 1 452 452 LEU C C 452 177.967 177.967 179.215 -1.248 25932 1061 1 6 . 1 1 452 452 LEU CA C 452 57.606 57.606 58.610 -1.004 25932 1062 1 6 . 1 1 452 452 LEU CB C 452 40.924 40.924 41.197 -0.273 25932 1063 1 6 . 1 1 452 452 LEU H H 452 8.731 8.731 7.972 0.759 25932 1064 1 6 . 1 1 453 453 THR N N 453 116.173 116.173 116.966 -0.793 25932 1065 1 6 . 1 1 453 453 THR C C 453 176.220 176.220 177.065 -0.845 25932 1066 1 6 . 1 1 453 453 THR CA C 453 67.919 67.919 67.567 0.352 25932 1067 1 6 . 1 1 453 453 THR CB C 453 67.006 67.006 68.704 -1.698 25932 1068 1 6 . 1 1 453 453 THR H H 453 8.104 8.104 8.152 -0.048 25932 1069 1 6 . 1 1 454 454 ILE N N 454 120.077 120.077 121.327 -1.250 25932 1070 1 6 . 1 1 454 454 ILE C C 454 176.915 176.915 177.531 -0.616 25932 1071 1 6 . 1 1 454 454 ILE CA C 454 65.041 65.041 65.042 -0.001 25932 1072 1 6 . 1 1 454 454 ILE CB C 454 36.464 36.464 37.590 -1.126 25932 1073 1 6 . 1 1 454 454 ILE H H 454 8.043 8.043 8.330 -0.287 25932 1074 1 6 . 1 1 455 455 ALA N N 455 121.174 121.174 123.046 -1.872 25932 1075 1 6 . 1 1 455 455 ALA C C 455 178.806 178.806 179.744 -0.938 25932 1076 1 6 . 1 1 455 455 ALA CA C 455 55.346 55.346 55.507 -0.161 25932 1077 1 6 . 1 1 455 455 ALA CB C 455 16.890 16.890 18.087 -1.197 25932 1078 1 6 . 1 1 455 455 ALA H H 455 8.265 8.265 8.409 -0.144 25932 1079 1 6 . 1 1 456 456 VAL N N 456 116.661 116.661 118.790 -2.129 25932 1080 1 6 . 1 1 456 456 VAL C C 456 177.489 177.489 178.142 -0.653 25932 1081 1 6 . 1 1 456 456 VAL CA C 456 66.494 66.494 66.998 -0.504 25932 1082 1 6 . 1 1 456 456 VAL CB C 456 30.226 30.226 31.295 -1.069 25932 1083 1 6 . 1 1 456 456 VAL H H 456 8.211 8.211 8.014 0.197 25932 1084 1 6 . 1 1 457 457 LEU N N 457 119.465 119.465 119.979 -0.514 25932 1085 1 6 . 1 1 457 457 LEU C C 457 179.517 179.517 179.320 0.197 25932 1086 1 6 . 1 1 457 457 LEU CA C 457 58.056 58.056 58.137 -0.081 25932 1087 1 6 . 1 1 457 457 LEU CB C 457 40.414 40.414 41.544 -1.130 25932 1088 1 6 . 1 1 457 457 LEU H H 457 8.150 8.150 7.481 0.669 25932 1089 1 6 . 1 1 458 458 LEU N N 458 118.436 118.436 119.210 -0.774 25932 1090 1 6 . 1 1 458 458 LEU C C 458 178.891 178.891 179.025 -0.134 25932 1091 1 6 . 1 1 458 458 LEU CA C 458 57.395 57.395 57.977 -0.582 25932 1092 1 6 . 1 1 458 458 LEU CB C 458 40.484 40.484 41.447 -0.963 25932 1093 1 6 . 1 1 458 458 LEU H H 458 8.542 8.542 7.964 0.578 25932 1094 1 6 . 1 1 459 459 ALA N N 459 122.337 122.337 121.740 0.597 25932 1095 1 6 . 1 1 459 459 ALA C C 459 179.793 179.793 179.428 0.365 25932 1096 1 6 . 1 1 459 459 ALA CA C 459 55.122 55.122 55.011 0.111 25932 1097 1 6 . 1 1 459 459 ALA CB C 459 17.208 17.208 18.561 -1.353 25932 1098 1 6 . 1 1 459 459 ALA H H 459 8.401 8.401 8.067 0.334 25932 1099 1 6 . 1 1 460 460 LEU N N 460 117.961 117.961 120.608 -2.647 25932 1100 1 6 . 1 1 460 460 LEU C C 460 179.262 179.262 178.658 0.604 25932 1101 1 6 . 1 1 460 460 LEU CA C 460 57.673 57.673 58.000 -0.327 25932 1102 1 6 . 1 1 460 460 LEU CB C 460 40.414 40.414 41.469 -1.055 25932 1103 1 6 . 1 1 460 460 LEU H H 460 8.518 8.518 8.452 0.066 25932 1104 1 6 . 1 1 461 461 ARG N N 461 119.534 119.534 119.602 -0.068 25932 1105 1 6 . 1 1 461 461 ARG C C 461 178.625 178.625 178.449 0.176 25932 1106 1 6 . 1 1 461 461 ARG CA C 461 57.818 57.818 59.115 -1.297 25932 1107 1 6 . 1 1 461 461 ARG CB C 461 28.443 28.443 29.829 -1.386 25932 1108 1 6 . 1 1 461 461 ARG H H 461 8.029 8.029 7.931 0.098 25932 1109 1 6 . 1 1 462 462 PHE N N 462 118.777 118.777 119.966 -1.189 25932 1110 1 6 . 1 1 462 462 PHE C C 462 177.127 177.127 176.649 0.478 25932 1111 1 6 . 1 1 462 462 PHE CA C 462 60.624 60.624 61.006 -0.382 25932 1112 1 6 . 1 1 462 462 PHE CB C 462 38.633 38.633 38.916 -0.283 25932 1113 1 6 . 1 1 462 462 PHE H H 462 8.460 8.460 7.985 0.475 25932 1114 1 6 . 1 1 463 463 CYS N N 463 116.386 116.386 116.942 -0.556 25932 1115 1 6 . 1 1 463 463 CYS C C 463 175.980 175.980 176.653 -0.673 25932 1116 1 6 . 1 1 463 463 CYS CA C 463 61.999 61.999 62.572 -0.573 25932 1117 1 6 . 1 1 463 463 CYS CB C 463 26.966 26.966 28.840 -1.875 25932 1118 1 6 . 1 1 463 463 CYS H H 463 8.278 8.278 8.618 -0.340 25932 1119 1 6 . 1 1 464 464 GLY N N 464 107.774 107.774 109.115 -1.341 25932 1120 1 6 . 1 1 464 464 GLY C C 464 174.990 174.990 175.386 -0.396 25932 1121 1 6 . 1 1 464 464 GLY CA C 464 45.944 45.944 46.876 -0.932 25932 1122 1 6 . 1 1 464 464 GLY H H 464 8.050 8.050 8.346 -0.296 25932 1123 1 6 . 1 1 465 465 ILE N N 465 119.940 119.940 118.984 0.956 25932 1124 1 6 . 1 1 465 465 ILE C C 465 176.458 176.458 175.552 0.906 25932 1125 1 6 . 1 1 465 465 ILE CA C 465 62.423 62.423 61.383 1.040 25932 1126 1 6 . 1 1 465 465 ILE CB C 465 37.409 37.409 38.352 -0.943 25932 1127 1 6 . 1 1 465 465 ILE H H 465 7.745 7.745 7.848 -0.103 25932 1128 1 6 . 1 1 466 466 TYR N N 466 118.846 118.846 120.462 -1.616 25932 1129 1 6 . 1 1 466 466 TYR C C 466 176.150 176.150 175.878 0.272 25932 1130 1 6 . 1 1 466 466 TYR CA C 466 58.429 58.429 57.972 0.457 25932 1131 1 6 . 1 1 466 466 TYR CB C 466 37.917 37.917 38.995 -1.078 25932 1132 1 6 . 1 1 466 466 TYR H H 466 7.807 7.807 7.422 0.385 25932 1133 1 6 . 1 1 467 467 GLY N N 467 107.987 107.987 106.871 1.116 25932 1134 1 6 . 1 1 467 467 GLY C C 467 174.143 174.143 174.094 0.049 25932 1135 1 6 . 1 1 467 467 GLY CA C 467 45.547 45.547 45.196 0.351 25932 1136 1 6 . 1 1 467 467 GLY H H 467 7.887 7.887 7.443 0.444 25932 1137 1 6 . 1 1 468 468 TYR N N 468 119.878 119.878 120.593 -0.715 25932 1138 1 6 . 1 1 468 468 TYR C C 468 175.524 175.524 177.236 -1.712 25932 1139 1 6 . 1 1 468 468 TYR CA C 468 58.164 58.164 61.333 -3.169 25932 1140 1 6 . 1 1 468 468 TYR CB C 468 37.786 37.786 38.880 -1.093 25932 1141 1 6 . 1 1 468 468 TYR H H 468 7.867 7.867 8.177 -0.310 25932 1142 1 6 . 1 1 469 469 ARG N N 469 121.174 121.174 119.358 1.816 25932 1143 1 6 . 1 1 469 469 ARG C C 469 175.800 175.800 175.835 -0.035 25932 1144 1 6 . 1 1 469 469 ARG CA C 469 55.334 55.334 57.787 -2.453 25932 1145 1 6 . 1 1 469 469 ARG CB C 469 30.035 30.035 30.334 -0.299 25932 1146 1 6 . 1 1 469 469 ARG H H 469 7.873 7.873 8.221 -0.348 25932 1147 1 6 . 1 1 470 470 LEU N N 470 121.718 121.718 119.773 1.945 25932 1148 1 6 . 1 1 470 470 LEU C C 470 176.618 176.618 176.446 0.172 25932 1149 1 6 . 1 1 470 470 LEU CA C 470 54.858 54.858 54.447 0.411 25932 1150 1 6 . 1 1 470 470 LEU CB C 470 41.331 41.331 42.389 -1.058 25932 1151 1 6 . 1 1 470 470 LEU H H 470 7.940 7.940 8.001 -0.061 25932 1152 1 6 . 1 1 471 471 ARG N N 471 120.624 120.624 120.855 -0.231 25932 1153 1 6 . 1 1 471 471 ARG CA C 471 55.308 55.308 54.938 0.370 25932 1154 1 6 . 1 1 471 471 ARG CB C 471 30.010 30.010 32.454 -2.444 25932 1155 1 6 . 1 1 471 471 ARG H H 471 7.922 7.922 8.213 -0.291 25932 1156 1 6 . 1 1 472 472 ARG C C 472 175.258 175.258 176.060 -0.802 25932 1157 1 6 . 1 1 472 472 ARG CA C 472 55.704 55.704 56.901 -1.197 25932 1158 1 6 . 1 1 472 472 ARG CB C 472 29.851 29.851 29.339 0.512 25932 1159 1 7 . 1 1 433 433 SER C C 433 174.143 174.143 173.125 1.018 25932 1160 1 7 . 1 1 433 433 SER CA C 433 57.715 57.715 58.417 -0.702 25932 1161 1 7 . 1 1 433 433 SER CB C 433 63.602 63.602 63.577 0.025 25932 1162 1 7 . 1 1 434 434 TRP N N 434 122.746 122.746 123.673 -0.927 25932 1163 1 7 . 1 1 434 434 TRP C C 434 175.587 175.587 175.950 -0.363 25932 1164 1 7 . 1 1 434 434 TRP CA C 434 56.604 56.604 56.597 0.007 25932 1165 1 7 . 1 1 434 434 TRP CB C 434 29.269 29.269 31.085 -1.816 25932 1166 1 7 . 1 1 434 434 TRP H H 434 8.283 8.283 8.133 0.150 25932 1167 1 7 . 1 1 435 435 ASP N N 435 121.374 121.374 124.124 -2.750 25932 1168 1 7 . 1 1 435 435 ASP C C 435 176.543 176.543 176.931 -0.388 25932 1169 1 7 . 1 1 435 435 ASP CA C 435 53.562 53.562 52.809 0.754 25932 1170 1 7 . 1 1 435 435 ASP CB C 435 40.854 40.854 41.755 -0.901 25932 1171 1 7 . 1 1 435 435 ASP H H 435 8.219 8.219 8.719 -0.500 25932 1172 1 7 . 1 1 436 436 THR N N 436 116.111 116.111 121.864 -5.753 25932 1173 1 7 . 1 1 436 436 THR C C 436 175.651 175.651 175.967 -0.316 25932 1174 1 7 . 1 1 436 436 THR CA C 436 65.015 65.015 65.056 -0.041 25932 1175 1 7 . 1 1 436 436 THR CB C 436 68.416 68.416 69.124 -0.708 25932 1176 1 7 . 1 1 436 436 THR H H 436 8.251 8.251 8.740 -0.489 25932 1177 1 7 . 1 1 437 437 GLU N N 437 121.374 121.374 121.474 -0.100 25932 1178 1 7 . 1 1 437 437 GLU C C 437 177.988 177.988 178.497 -0.509 25932 1179 1 7 . 1 1 437 437 GLU CA C 437 59.513 59.513 59.970 -0.457 25932 1180 1 7 . 1 1 437 437 GLU CB C 437 28.370 28.370 29.592 -1.222 25932 1181 1 7 . 1 1 437 437 GLU H H 437 8.897 8.897 8.856 0.041 25932 1182 1 7 . 1 1 438 438 SER N N 438 115.658 115.658 115.228 0.430 25932 1183 1 7 . 1 1 438 438 SER C C 438 175.832 175.832 176.709 -0.877 25932 1184 1 7 . 1 1 438 438 SER CA C 438 60.889 60.889 61.344 -0.455 25932 1185 1 7 . 1 1 438 438 SER CB C 438 62.491 62.491 62.414 0.076 25932 1186 1 7 . 1 1 438 438 SER H H 438 8.018 8.018 7.806 0.212 25932 1187 1 7 . 1 1 439 439 VAL N N 439 122.608 122.608 123.562 -0.954 25932 1188 1 7 . 1 1 439 439 VAL C C 439 177.743 177.743 177.850 -0.107 25932 1189 1 7 . 1 1 439 439 VAL CA C 439 65.861 65.861 65.996 -0.135 25932 1190 1 7 . 1 1 439 439 VAL CB C 439 30.698 30.698 31.413 -0.715 25932 1191 1 7 . 1 1 439 439 VAL H H 439 7.908 7.908 7.209 0.699 25932 1192 1 7 . 1 1 440 440 LEU N N 440 120.077 120.077 119.516 0.561 25932 1193 1 7 . 1 1 440 440 LEU C C 440 178.466 178.466 178.579 -0.113 25932 1194 1 7 . 1 1 440 440 LEU CA C 440 57.953 57.953 58.178 -0.226 25932 1195 1 7 . 1 1 440 440 LEU CB C 440 40.378 40.378 41.495 -1.117 25932 1196 1 7 . 1 1 440 440 LEU H H 440 8.171 8.171 8.172 -0.001 25932 1197 1 7 . 1 1 441 441 ALA N N 441 119.465 119.465 121.142 -1.677 25932 1198 1 7 . 1 1 441 441 ALA C C 441 178.986 178.986 179.349 -0.363 25932 1199 1 7 . 1 1 441 441 ALA CA C 441 55.122 55.122 54.631 0.491 25932 1200 1 7 . 1 1 441 441 ALA CB C 441 17.367 17.367 18.101 -0.734 25932 1201 1 7 . 1 1 441 441 ALA H H 441 8.090 8.090 7.618 0.472 25932 1202 1 7 . 1 1 442 442 MET N N 442 116.111 116.111 116.811 -0.700 25932 1203 1 7 . 1 1 442 442 MET C C 442 178.073 178.073 177.761 0.312 25932 1204 1 7 . 1 1 442 442 MET CA C 442 58.217 58.217 59.199 -0.982 25932 1205 1 7 . 1 1 442 442 MET CB C 442 31.597 31.597 32.434 -0.838 25932 1206 1 7 . 1 1 442 442 MET H H 442 7.875 7.875 7.471 0.404 25932 1207 1 7 . 1 1 443 443 TRP N N 443 119.802 119.802 118.159 1.643 25932 1208 1 7 . 1 1 443 443 TRP C C 443 178.445 178.445 177.763 0.682 25932 1209 1 7 . 1 1 443 443 TRP CA C 443 60.624 60.624 59.074 1.550 25932 1210 1 7 . 1 1 443 443 TRP CB C 443 28.899 28.899 28.232 0.667 25932 1211 1 7 . 1 1 443 443 TRP H H 443 8.196 8.196 7.367 0.829 25932 1212 1 7 . 1 1 444 444 VAL N N 444 118.509 118.509 121.793 -3.284 25932 1213 1 7 . 1 1 444 444 VAL C C 444 177.563 177.563 178.046 -0.483 25932 1214 1 7 . 1 1 444 444 VAL CA C 444 66.866 66.866 65.976 0.890 25932 1215 1 7 . 1 1 444 444 VAL CB C 444 30.221 30.221 30.404 -0.182 25932 1216 1 7 . 1 1 444 444 VAL H H 444 8.353 8.353 6.455 1.898 25932 1217 1 7 . 1 1 445 445 LEU N N 445 119.328 119.328 120.818 -1.490 25932 1218 1 7 . 1 1 445 445 LEU C C 445 178.168 178.168 178.249 -0.081 25932 1219 1 7 . 1 1 445 445 LEU CA C 445 57.979 57.979 57.829 0.150 25932 1220 1 7 . 1 1 445 445 LEU CB C 445 40.431 40.431 41.163 -0.732 25932 1221 1 7 . 1 1 445 445 LEU H H 445 8.233 8.233 7.373 0.860 25932 1222 1 7 . 1 1 446 446 ALA N N 446 120.009 120.009 121.836 -1.827 25932 1223 1 7 . 1 1 446 446 ALA C C 446 179.071 179.071 179.831 -0.760 25932 1224 1 7 . 1 1 446 446 ALA CA C 446 55.096 55.096 55.151 -0.055 25932 1225 1 7 . 1 1 446 446 ALA CB C 446 16.996 16.996 18.189 -1.193 25932 1226 1 7 . 1 1 446 446 ALA H H 446 8.402 8.402 7.775 0.627 25932 1227 1 7 . 1 1 447 447 LEU N N 447 117.136 117.136 119.430 -2.294 25932 1228 1 7 . 1 1 447 447 LEU C C 447 178.678 178.678 179.244 -0.566 25932 1229 1 7 . 1 1 447 447 LEU CA C 447 57.767 57.767 57.763 0.004 25932 1230 1 7 . 1 1 447 447 LEU CB C 447 40.378 40.378 41.934 -1.556 25932 1231 1 7 . 1 1 447 447 LEU H H 447 8.244 8.244 8.025 0.219 25932 1232 1 7 . 1 1 448 448 ILE N N 448 119.121 119.121 119.301 -0.180 25932 1233 1 7 . 1 1 448 448 ILE C C 448 177.574 177.574 178.380 -0.806 25932 1234 1 7 . 1 1 448 448 ILE CA C 448 65.702 65.702 64.227 1.475 25932 1235 1 7 . 1 1 448 448 ILE CB C 448 36.464 36.464 36.824 -0.360 25932 1236 1 7 . 1 1 448 448 ILE H H 448 8.286 8.286 7.848 0.438 25932 1237 1 7 . 1 1 449 449 VAL N N 449 119.052 119.052 117.767 1.285 25932 1238 1 7 . 1 1 449 449 VAL C C 449 179.135 179.135 177.850 1.285 25932 1239 1 7 . 1 1 449 449 VAL CA C 449 67.051 67.051 66.380 0.671 25932 1240 1 7 . 1 1 449 449 VAL CB C 449 30.175 30.175 31.470 -1.294 25932 1241 1 7 . 1 1 449 449 VAL H H 449 8.327 8.327 7.725 0.602 25932 1242 1 7 . 1 1 450 450 ILE N N 450 123.014 123.014 121.082 1.932 25932 1243 1 7 . 1 1 450 450 ILE C C 450 177.074 177.074 177.472 -0.398 25932 1244 1 7 . 1 1 450 450 ILE CA C 450 65.594 65.594 64.977 0.617 25932 1245 1 7 . 1 1 450 450 ILE CB C 450 36.594 36.594 37.784 -1.190 25932 1246 1 7 . 1 1 450 450 ILE H H 450 8.670 8.670 7.456 1.214 25932 1247 1 7 . 1 1 451 451 PHE N N 451 119.392 119.392 118.822 0.570 25932 1248 1 7 . 1 1 451 451 PHE C C 451 177.297 177.297 177.919 -0.622 25932 1249 1 7 . 1 1 451 451 PHE CA C 451 61.389 61.389 62.605 -1.216 25932 1250 1 7 . 1 1 451 451 PHE CB C 451 37.970 37.970 38.328 -0.358 25932 1251 1 7 . 1 1 451 451 PHE H H 451 8.651 8.651 7.523 1.128 25932 1252 1 7 . 1 1 452 452 LEU N N 452 118.367 118.367 119.730 -1.363 25932 1253 1 7 . 1 1 452 452 LEU C C 452 177.967 177.967 179.001 -1.034 25932 1254 1 7 . 1 1 452 452 LEU CA C 452 57.606 57.606 58.222 -0.616 25932 1255 1 7 . 1 1 452 452 LEU CB C 452 40.924 40.924 41.436 -0.512 25932 1256 1 7 . 1 1 452 452 LEU H H 452 8.731 8.731 7.833 0.898 25932 1257 1 7 . 1 1 453 453 THR N N 453 116.173 116.173 116.427 -0.254 25932 1258 1 7 . 1 1 453 453 THR C C 453 176.220 176.220 176.709 -0.489 25932 1259 1 7 . 1 1 453 453 THR CA C 453 67.919 67.919 67.255 0.664 25932 1260 1 7 . 1 1 453 453 THR CB C 453 67.006 67.006 68.519 -1.513 25932 1261 1 7 . 1 1 453 453 THR H H 453 8.104 8.104 8.191 -0.087 25932 1262 1 7 . 1 1 454 454 ILE N N 454 120.077 120.077 121.219 -1.142 25932 1263 1 7 . 1 1 454 454 ILE C C 454 176.915 176.915 177.469 -0.554 25932 1264 1 7 . 1 1 454 454 ILE CA C 454 65.041 65.041 65.260 -0.219 25932 1265 1 7 . 1 1 454 454 ILE CB C 454 36.464 36.464 37.608 -1.144 25932 1266 1 7 . 1 1 454 454 ILE H H 454 8.043 8.043 8.284 -0.241 25932 1267 1 7 . 1 1 455 455 ALA N N 455 121.174 121.174 122.749 -1.575 25932 1268 1 7 . 1 1 455 455 ALA C C 455 178.806 178.806 179.586 -0.780 25932 1269 1 7 . 1 1 455 455 ALA CA C 455 55.346 55.346 55.487 -0.141 25932 1270 1 7 . 1 1 455 455 ALA CB C 455 16.890 16.890 18.048 -1.158 25932 1271 1 7 . 1 1 455 455 ALA H H 455 8.265 8.265 8.478 -0.213 25932 1272 1 7 . 1 1 456 456 VAL N N 456 116.661 116.661 119.034 -2.373 25932 1273 1 7 . 1 1 456 456 VAL C C 456 177.489 177.489 177.999 -0.510 25932 1274 1 7 . 1 1 456 456 VAL CA C 456 66.494 66.494 66.805 -0.311 25932 1275 1 7 . 1 1 456 456 VAL CB C 456 30.226 30.226 31.794 -1.568 25932 1276 1 7 . 1 1 456 456 VAL H H 456 8.211 8.211 7.778 0.433 25932 1277 1 7 . 1 1 457 457 LEU N N 457 119.465 119.465 119.948 -0.483 25932 1278 1 7 . 1 1 457 457 LEU C C 457 179.517 179.517 179.152 0.365 25932 1279 1 7 . 1 1 457 457 LEU CA C 457 58.056 58.056 58.019 0.037 25932 1280 1 7 . 1 1 457 457 LEU CB C 457 40.414 40.414 41.566 -1.152 25932 1281 1 7 . 1 1 457 457 LEU H H 457 8.150 8.150 7.471 0.679 25932 1282 1 7 . 1 1 458 458 LEU N N 458 118.436 118.436 119.256 -0.820 25932 1283 1 7 . 1 1 458 458 LEU C C 458 178.891 178.891 179.068 -0.177 25932 1284 1 7 . 1 1 458 458 LEU CA C 458 57.395 57.395 58.002 -0.607 25932 1285 1 7 . 1 1 458 458 LEU CB C 458 40.484 40.484 41.462 -0.978 25932 1286 1 7 . 1 1 458 458 LEU H H 458 8.542 8.542 8.031 0.511 25932 1287 1 7 . 1 1 459 459 ALA N N 459 122.337 122.337 121.765 0.572 25932 1288 1 7 . 1 1 459 459 ALA C C 459 179.793 179.793 179.469 0.324 25932 1289 1 7 . 1 1 459 459 ALA CA C 459 55.122 55.122 55.073 0.049 25932 1290 1 7 . 1 1 459 459 ALA CB C 459 17.208 17.208 18.604 -1.396 25932 1291 1 7 . 1 1 459 459 ALA H H 459 8.401 8.401 8.147 0.254 25932 1292 1 7 . 1 1 460 460 LEU N N 460 117.961 117.961 120.590 -2.629 25932 1293 1 7 . 1 1 460 460 LEU C C 460 179.262 179.262 178.732 0.530 25932 1294 1 7 . 1 1 460 460 LEU CA C 460 57.673 57.673 58.046 -0.373 25932 1295 1 7 . 1 1 460 460 LEU CB C 460 40.414 40.414 41.531 -1.117 25932 1296 1 7 . 1 1 460 460 LEU H H 460 8.518 8.518 8.476 0.042 25932 1297 1 7 . 1 1 461 461 ARG N N 461 119.534 119.534 119.559 -0.025 25932 1298 1 7 . 1 1 461 461 ARG C C 461 178.625 178.625 178.492 0.133 25932 1299 1 7 . 1 1 461 461 ARG CA C 461 57.818 57.818 59.084 -1.266 25932 1300 1 7 . 1 1 461 461 ARG CB C 461 28.443 28.443 29.846 -1.403 25932 1301 1 7 . 1 1 461 461 ARG H H 461 8.029 8.029 7.923 0.106 25932 1302 1 7 . 1 1 462 462 PHE N N 462 118.777 118.777 121.138 -2.361 25932 1303 1 7 . 1 1 462 462 PHE C C 462 177.127 177.127 177.617 -0.490 25932 1304 1 7 . 1 1 462 462 PHE CA C 462 60.624 60.624 61.308 -0.684 25932 1305 1 7 . 1 1 462 462 PHE CB C 462 38.633 38.633 39.106 -0.473 25932 1306 1 7 . 1 1 462 462 PHE H H 462 8.460 8.460 8.051 0.409 25932 1307 1 7 . 1 1 463 463 CYS N N 463 116.386 116.386 117.448 -1.062 25932 1308 1 7 . 1 1 463 463 CYS C C 463 175.980 175.980 177.142 -1.162 25932 1309 1 7 . 1 1 463 463 CYS CA C 463 61.999 61.999 62.891 -0.892 25932 1310 1 7 . 1 1 463 463 CYS CB C 463 26.966 26.966 28.373 -1.407 25932 1311 1 7 . 1 1 463 463 CYS H H 463 8.278 8.278 8.615 -0.337 25932 1312 1 7 . 1 1 464 464 GLY N N 464 107.774 107.774 109.497 -1.723 25932 1313 1 7 . 1 1 464 464 GLY C C 464 174.990 174.990 176.451 -1.461 25932 1314 1 7 . 1 1 464 464 GLY CA C 464 45.944 45.944 47.101 -1.157 25932 1315 1 7 . 1 1 464 464 GLY H H 464 8.050 8.050 8.388 -0.338 25932 1316 1 7 . 1 1 465 465 ILE N N 465 119.940 119.940 121.246 -1.306 25932 1317 1 7 . 1 1 465 465 ILE C C 465 176.458 176.458 175.409 1.049 25932 1318 1 7 . 1 1 465 465 ILE CA C 465 62.423 62.423 61.745 0.678 25932 1319 1 7 . 1 1 465 465 ILE CB C 465 37.409 37.409 36.904 0.505 25932 1320 1 7 . 1 1 465 465 ILE H H 465 7.745 7.745 7.839 -0.094 25932 1321 1 7 . 1 1 466 466 TYR N N 466 118.846 118.846 117.602 1.244 25932 1322 1 7 . 1 1 466 466 TYR C C 466 176.150 176.150 176.126 0.024 25932 1323 1 7 . 1 1 466 466 TYR CA C 466 58.429 58.429 57.773 0.656 25932 1324 1 7 . 1 1 466 466 TYR CB C 466 37.917 37.917 39.099 -1.182 25932 1325 1 7 . 1 1 466 466 TYR H H 466 7.807 7.807 7.453 0.354 25932 1326 1 7 . 1 1 467 467 GLY N N 467 107.987 107.987 107.574 0.413 25932 1327 1 7 . 1 1 467 467 GLY C C 467 174.143 174.143 174.189 -0.046 25932 1328 1 7 . 1 1 467 467 GLY CA C 467 45.547 45.547 45.408 0.139 25932 1329 1 7 . 1 1 467 467 GLY H H 467 7.887 7.887 7.764 0.123 25932 1330 1 7 . 1 1 468 468 TYR N N 468 119.878 119.878 122.029 -2.151 25932 1331 1 7 . 1 1 468 468 TYR C C 468 175.524 175.524 174.696 0.828 25932 1332 1 7 . 1 1 468 468 TYR CA C 468 58.164 58.164 59.100 -0.936 25932 1333 1 7 . 1 1 468 468 TYR CB C 468 37.786 37.786 39.168 -1.382 25932 1334 1 7 . 1 1 468 468 TYR H H 468 7.867 7.867 7.763 0.104 25932 1335 1 7 . 1 1 469 469 ARG N N 469 121.174 121.174 125.797 -4.623 25932 1336 1 7 . 1 1 469 469 ARG C C 469 175.800 175.800 174.570 1.230 25932 1337 1 7 . 1 1 469 469 ARG CA C 469 55.334 55.334 54.227 1.107 25932 1338 1 7 . 1 1 469 469 ARG CB C 469 30.035 30.035 33.471 -3.436 25932 1339 1 7 . 1 1 469 469 ARG H H 469 7.873 7.873 7.895 -0.022 25932 1340 1 7 . 1 1 470 470 LEU N N 470 121.718 121.718 122.250 -0.532 25932 1341 1 7 . 1 1 470 470 LEU C C 470 176.618 176.618 177.184 -0.566 25932 1342 1 7 . 1 1 470 470 LEU CA C 470 54.858 54.858 54.513 0.345 25932 1343 1 7 . 1 1 470 470 LEU CB C 470 41.331 41.331 42.623 -1.292 25932 1344 1 7 . 1 1 470 470 LEU H H 470 7.940 7.940 8.227 -0.287 25932 1345 1 7 . 1 1 471 471 ARG N N 471 120.624 120.624 122.838 -2.214 25932 1346 1 7 . 1 1 471 471 ARG CA C 471 55.308 55.308 55.445 -0.137 25932 1347 1 7 . 1 1 471 471 ARG CB C 471 30.010 30.010 31.867 -1.857 25932 1348 1 7 . 1 1 471 471 ARG H H 471 7.922 7.922 8.351 -0.429 25932 1349 1 7 . 1 1 472 472 ARG C C 472 175.258 175.258 176.538 -1.280 25932 1350 1 7 . 1 1 472 472 ARG CA C 472 55.704 55.704 55.864 -0.161 25932 1351 1 7 . 1 1 472 472 ARG CB C 472 29.851 29.851 31.070 -1.219 25932 1352 1 8 . 1 1 433 433 SER C C 433 174.143 174.143 173.943 0.200 25932 1353 1 8 . 1 1 433 433 SER CA C 433 57.715 57.715 59.955 -2.240 25932 1354 1 8 . 1 1 433 433 SER CB C 433 63.602 63.602 63.368 0.234 25932 1355 1 8 . 1 1 434 434 TRP N N 434 122.746 122.746 120.257 2.489 25932 1356 1 8 . 1 1 434 434 TRP C C 434 175.587 175.587 175.130 0.457 25932 1357 1 8 . 1 1 434 434 TRP CA C 434 56.604 56.604 56.471 0.133 25932 1358 1 8 . 1 1 434 434 TRP CB C 434 29.269 29.269 30.813 -1.544 25932 1359 1 8 . 1 1 434 434 TRP H H 434 8.283 8.283 7.580 0.703 25932 1360 1 8 . 1 1 435 435 ASP N N 435 121.374 121.374 122.617 -1.243 25932 1361 1 8 . 1 1 435 435 ASP C C 435 176.543 176.543 177.092 -0.549 25932 1362 1 8 . 1 1 435 435 ASP CA C 435 53.562 53.562 52.632 0.930 25932 1363 1 8 . 1 1 435 435 ASP CB C 435 40.854 40.854 42.020 -1.166 25932 1364 1 8 . 1 1 435 435 ASP H H 435 8.219 8.219 8.764 -0.545 25932 1365 1 8 . 1 1 436 436 THR N N 436 116.111 116.111 119.513 -3.402 25932 1366 1 8 . 1 1 436 436 THR C C 436 175.651 175.651 176.320 -0.669 25932 1367 1 8 . 1 1 436 436 THR CA C 436 65.015 65.015 64.127 0.888 25932 1368 1 8 . 1 1 436 436 THR CB C 436 68.416 68.416 68.658 -0.242 25932 1369 1 8 . 1 1 436 436 THR H H 436 8.251 8.251 8.743 -0.492 25932 1370 1 8 . 1 1 437 437 GLU N N 437 121.374 121.374 121.338 0.036 25932 1371 1 8 . 1 1 437 437 GLU C C 437 177.988 177.988 178.732 -0.744 25932 1372 1 8 . 1 1 437 437 GLU CA C 437 59.513 59.513 59.325 0.188 25932 1373 1 8 . 1 1 437 437 GLU CB C 437 28.370 28.370 29.356 -0.986 25932 1374 1 8 . 1 1 437 437 GLU H H 437 8.897 8.897 8.871 0.026 25932 1375 1 8 . 1 1 438 438 SER N N 438 115.658 115.658 115.234 0.424 25932 1376 1 8 . 1 1 438 438 SER C C 438 175.832 175.832 176.367 -0.535 25932 1377 1 8 . 1 1 438 438 SER CA C 438 60.889 60.889 61.622 -0.733 25932 1378 1 8 . 1 1 438 438 SER CB C 438 62.491 62.491 62.536 -0.045 25932 1379 1 8 . 1 1 438 438 SER H H 438 8.018 8.018 7.877 0.141 25932 1380 1 8 . 1 1 439 439 VAL N N 439 122.608 122.608 123.068 -0.460 25932 1381 1 8 . 1 1 439 439 VAL C C 439 177.743 177.743 178.012 -0.269 25932 1382 1 8 . 1 1 439 439 VAL CA C 439 65.861 65.861 65.959 -0.098 25932 1383 1 8 . 1 1 439 439 VAL CB C 439 30.698 30.698 31.405 -0.708 25932 1384 1 8 . 1 1 439 439 VAL H H 439 7.908 7.908 7.165 0.743 25932 1385 1 8 . 1 1 440 440 LEU N N 440 120.077 120.077 119.868 0.209 25932 1386 1 8 . 1 1 440 440 LEU C C 440 178.466 178.466 178.816 -0.350 25932 1387 1 8 . 1 1 440 440 LEU CA C 440 57.953 57.953 57.971 -0.018 25932 1388 1 8 . 1 1 440 440 LEU CB C 440 40.378 40.378 40.740 -0.362 25932 1389 1 8 . 1 1 440 440 LEU H H 440 8.171 8.171 7.778 0.393 25932 1390 1 8 . 1 1 441 441 ALA N N 441 119.465 119.465 121.265 -1.800 25932 1391 1 8 . 1 1 441 441 ALA C C 441 178.986 178.986 179.516 -0.530 25932 1392 1 8 . 1 1 441 441 ALA CA C 441 55.122 55.122 54.658 0.464 25932 1393 1 8 . 1 1 441 441 ALA CB C 441 17.367 17.367 18.155 -0.788 25932 1394 1 8 . 1 1 441 441 ALA H H 441 8.090 8.090 7.489 0.601 25932 1395 1 8 . 1 1 442 442 MET N N 442 116.111 116.111 116.768 -0.657 25932 1396 1 8 . 1 1 442 442 MET C C 442 178.073 178.073 177.760 0.313 25932 1397 1 8 . 1 1 442 442 MET CA C 442 58.217 58.217 59.223 -1.006 25932 1398 1 8 . 1 1 442 442 MET CB C 442 31.597 31.597 32.447 -0.850 25932 1399 1 8 . 1 1 442 442 MET H H 442 7.875 7.875 7.487 0.388 25932 1400 1 8 . 1 1 443 443 TRP N N 443 119.802 119.802 118.135 1.667 25932 1401 1 8 . 1 1 443 443 TRP C C 443 178.445 178.445 177.708 0.737 25932 1402 1 8 . 1 1 443 443 TRP CA C 443 60.624 60.624 59.108 1.516 25932 1403 1 8 . 1 1 443 443 TRP CB C 443 28.899 28.899 28.210 0.689 25932 1404 1 8 . 1 1 443 443 TRP H H 443 8.196 8.196 7.358 0.838 25932 1405 1 8 . 1 1 444 444 VAL N N 444 118.509 118.509 121.894 -3.385 25932 1406 1 8 . 1 1 444 444 VAL C C 444 177.563 177.563 178.087 -0.524 25932 1407 1 8 . 1 1 444 444 VAL CA C 444 66.866 66.866 66.167 0.699 25932 1408 1 8 . 1 1 444 444 VAL CB C 444 30.221 30.221 30.575 -0.354 25932 1409 1 8 . 1 1 444 444 VAL H H 444 8.353 8.353 6.493 1.860 25932 1410 1 8 . 1 1 445 445 LEU N N 445 119.328 119.328 119.633 -0.305 25932 1411 1 8 . 1 1 445 445 LEU C C 445 178.168 178.168 178.809 -0.641 25932 1412 1 8 . 1 1 445 445 LEU CA C 445 57.979 57.979 58.157 -0.178 25932 1413 1 8 . 1 1 445 445 LEU CB C 445 40.431 40.431 41.064 -0.633 25932 1414 1 8 . 1 1 445 445 LEU H H 445 8.233 8.233 7.361 0.872 25932 1415 1 8 . 1 1 446 446 ALA N N 446 120.009 120.009 122.478 -2.469 25932 1416 1 8 . 1 1 446 446 ALA C C 446 179.071 179.071 179.741 -0.670 25932 1417 1 8 . 1 1 446 446 ALA CA C 446 55.096 55.096 55.220 -0.124 25932 1418 1 8 . 1 1 446 446 ALA CB C 446 16.996 16.996 18.316 -1.320 25932 1419 1 8 . 1 1 446 446 ALA H H 446 8.402 8.402 7.801 0.601 25932 1420 1 8 . 1 1 447 447 LEU N N 447 117.136 117.136 119.747 -2.611 25932 1421 1 8 . 1 1 447 447 LEU C C 447 178.678 178.678 179.078 -0.400 25932 1422 1 8 . 1 1 447 447 LEU CA C 447 57.767 57.767 58.260 -0.493 25932 1423 1 8 . 1 1 447 447 LEU CB C 447 40.378 40.378 41.929 -1.551 25932 1424 1 8 . 1 1 447 447 LEU H H 447 8.244 8.244 8.438 -0.194 25932 1425 1 8 . 1 1 448 448 ILE N N 448 119.121 119.121 119.939 -0.818 25932 1426 1 8 . 1 1 448 448 ILE C C 448 177.574 177.574 178.144 -0.570 25932 1427 1 8 . 1 1 448 448 ILE CA C 448 65.702 65.702 65.829 -0.127 25932 1428 1 8 . 1 1 448 448 ILE CB C 448 36.464 36.464 37.720 -1.256 25932 1429 1 8 . 1 1 448 448 ILE H H 448 8.286 8.286 8.161 0.125 25932 1430 1 8 . 1 1 449 449 VAL N N 449 119.052 119.052 120.012 -0.960 25932 1431 1 8 . 1 1 449 449 VAL C C 449 179.135 179.135 177.996 1.139 25932 1432 1 8 . 1 1 449 449 VAL CA C 449 67.051 67.051 66.831 0.220 25932 1433 1 8 . 1 1 449 449 VAL CB C 449 30.175 30.175 31.253 -1.078 25932 1434 1 8 . 1 1 449 449 VAL H H 449 8.327 8.327 7.833 0.494 25932 1435 1 8 . 1 1 450 450 ILE N N 450 123.014 123.014 120.634 2.380 25932 1436 1 8 . 1 1 450 450 ILE C C 450 177.074 177.074 177.760 -0.686 25932 1437 1 8 . 1 1 450 450 ILE CA C 450 65.594 65.594 65.512 0.082 25932 1438 1 8 . 1 1 450 450 ILE CB C 450 36.594 36.594 37.577 -0.983 25932 1439 1 8 . 1 1 450 450 ILE H H 450 8.670 8.670 7.770 0.900 25932 1440 1 8 . 1 1 451 451 PHE N N 451 119.392 119.392 118.789 0.603 25932 1441 1 8 . 1 1 451 451 PHE C C 451 177.297 177.297 178.050 -0.753 25932 1442 1 8 . 1 1 451 451 PHE CA C 451 61.389 61.389 62.536 -1.147 25932 1443 1 8 . 1 1 451 451 PHE CB C 451 37.970 37.970 38.257 -0.287 25932 1444 1 8 . 1 1 451 451 PHE H H 451 8.651 8.651 7.815 0.836 25932 1445 1 8 . 1 1 452 452 LEU N N 452 118.367 118.367 119.648 -1.281 25932 1446 1 8 . 1 1 452 452 LEU C C 452 177.967 177.967 179.105 -1.138 25932 1447 1 8 . 1 1 452 452 LEU CA C 452 57.606 57.606 58.248 -0.643 25932 1448 1 8 . 1 1 452 452 LEU CB C 452 40.924 40.924 41.428 -0.504 25932 1449 1 8 . 1 1 452 452 LEU H H 452 8.731 8.731 8.206 0.525 25932 1450 1 8 . 1 1 453 453 THR N N 453 116.173 116.173 116.532 -0.359 25932 1451 1 8 . 1 1 453 453 THR C C 453 176.220 176.220 176.848 -0.628 25932 1452 1 8 . 1 1 453 453 THR CA C 453 67.919 67.919 66.789 1.130 25932 1453 1 8 . 1 1 453 453 THR CB C 453 67.006 67.006 68.415 -1.409 25932 1454 1 8 . 1 1 453 453 THR H H 453 8.104 8.104 8.219 -0.115 25932 1455 1 8 . 1 1 454 454 ILE N N 454 120.077 120.077 121.082 -1.005 25932 1456 1 8 . 1 1 454 454 ILE C C 454 176.915 176.915 177.472 -0.557 25932 1457 1 8 . 1 1 454 454 ILE CA C 454 65.041 65.041 65.226 -0.185 25932 1458 1 8 . 1 1 454 454 ILE CB C 454 36.464 36.464 37.562 -1.097 25932 1459 1 8 . 1 1 454 454 ILE H H 454 8.043 8.043 8.421 -0.378 25932 1460 1 8 . 1 1 455 455 ALA N N 455 121.174 121.174 123.176 -2.002 25932 1461 1 8 . 1 1 455 455 ALA C C 455 178.806 178.806 179.666 -0.860 25932 1462 1 8 . 1 1 455 455 ALA CA C 455 55.346 55.346 55.556 -0.210 25932 1463 1 8 . 1 1 455 455 ALA CB C 455 16.890 16.890 18.110 -1.220 25932 1464 1 8 . 1 1 455 455 ALA H H 455 8.265 8.265 8.421 -0.156 25932 1465 1 8 . 1 1 456 456 VAL N N 456 116.661 116.661 119.137 -2.476 25932 1466 1 8 . 1 1 456 456 VAL C C 456 177.489 177.489 177.993 -0.504 25932 1467 1 8 . 1 1 456 456 VAL CA C 456 66.494 66.494 66.218 0.276 25932 1468 1 8 . 1 1 456 456 VAL CB C 456 30.226 30.226 31.410 -1.184 25932 1469 1 8 . 1 1 456 456 VAL H H 456 8.211 8.211 7.859 0.352 25932 1470 1 8 . 1 1 457 457 LEU N N 457 119.465 119.465 119.867 -0.402 25932 1471 1 8 . 1 1 457 457 LEU C C 457 179.517 179.517 179.158 0.359 25932 1472 1 8 . 1 1 457 457 LEU CA C 457 58.056 58.056 58.188 -0.132 25932 1473 1 8 . 1 1 457 457 LEU CB C 457 40.414 40.414 41.504 -1.090 25932 1474 1 8 . 1 1 457 457 LEU H H 457 8.150 8.150 7.479 0.671 25932 1475 1 8 . 1 1 458 458 LEU N N 458 118.436 118.436 119.172 -0.736 25932 1476 1 8 . 1 1 458 458 LEU C C 458 178.891 178.891 179.034 -0.143 25932 1477 1 8 . 1 1 458 458 LEU CA C 458 57.395 57.395 57.977 -0.582 25932 1478 1 8 . 1 1 458 458 LEU CB C 458 40.484 40.484 41.456 -0.972 25932 1479 1 8 . 1 1 458 458 LEU H H 458 8.542 8.542 7.953 0.589 25932 1480 1 8 . 1 1 459 459 ALA N N 459 122.337 122.337 121.605 0.732 25932 1481 1 8 . 1 1 459 459 ALA C C 459 179.793 179.793 179.451 0.342 25932 1482 1 8 . 1 1 459 459 ALA CA C 459 55.122 55.122 55.025 0.097 25932 1483 1 8 . 1 1 459 459 ALA CB C 459 17.208 17.208 18.617 -1.409 25932 1484 1 8 . 1 1 459 459 ALA H H 459 8.401 8.401 7.985 0.416 25932 1485 1 8 . 1 1 460 460 LEU N N 460 117.961 117.961 120.589 -2.628 25932 1486 1 8 . 1 1 460 460 LEU C C 460 179.262 179.262 178.636 0.626 25932 1487 1 8 . 1 1 460 460 LEU CA C 460 57.673 57.673 57.998 -0.325 25932 1488 1 8 . 1 1 460 460 LEU CB C 460 40.414 40.414 41.520 -1.107 25932 1489 1 8 . 1 1 460 460 LEU H H 460 8.518 8.518 8.477 0.041 25932 1490 1 8 . 1 1 461 461 ARG N N 461 119.534 119.534 119.325 0.209 25932 1491 1 8 . 1 1 461 461 ARG C C 461 178.625 178.625 178.232 0.393 25932 1492 1 8 . 1 1 461 461 ARG CA C 461 57.818 57.818 59.350 -1.532 25932 1493 1 8 . 1 1 461 461 ARG CB C 461 28.443 28.443 29.732 -1.289 25932 1494 1 8 . 1 1 461 461 ARG H H 461 8.029 8.029 8.016 0.013 25932 1495 1 8 . 1 1 462 462 PHE N N 462 118.777 118.777 120.942 -2.165 25932 1496 1 8 . 1 1 462 462 PHE C C 462 177.127 177.127 176.960 0.167 25932 1497 1 8 . 1 1 462 462 PHE CA C 462 60.624 60.624 61.245 -0.621 25932 1498 1 8 . 1 1 462 462 PHE CB C 462 38.633 38.633 38.935 -0.302 25932 1499 1 8 . 1 1 462 462 PHE H H 462 8.460 8.460 7.830 0.630 25932 1500 1 8 . 1 1 463 463 CYS N N 463 116.386 116.386 116.395 -0.009 25932 1501 1 8 . 1 1 463 463 CYS C C 463 175.980 175.980 176.378 -0.398 25932 1502 1 8 . 1 1 463 463 CYS CA C 463 61.999 61.999 62.405 -0.406 25932 1503 1 8 . 1 1 463 463 CYS CB C 463 26.966 26.966 27.466 -0.500 25932 1504 1 8 . 1 1 463 463 CYS H H 463 8.278 8.278 8.267 0.011 25932 1505 1 8 . 1 1 464 464 GLY N N 464 107.774 107.774 108.608 -0.834 25932 1506 1 8 . 1 1 464 464 GLY C C 464 174.990 174.990 175.359 -0.369 25932 1507 1 8 . 1 1 464 464 GLY CA C 464 45.944 45.944 46.518 -0.574 25932 1508 1 8 . 1 1 464 464 GLY H H 464 8.050 8.050 8.000 0.050 25932 1509 1 8 . 1 1 465 465 ILE N N 465 119.940 119.940 118.569 1.371 25932 1510 1 8 . 1 1 465 465 ILE C C 465 176.458 176.458 175.488 0.970 25932 1511 1 8 . 1 1 465 465 ILE CA C 465 62.423 62.423 61.404 1.018 25932 1512 1 8 . 1 1 465 465 ILE CB C 465 37.409 37.409 38.377 -0.968 25932 1513 1 8 . 1 1 465 465 ILE H H 465 7.745 7.745 7.710 0.035 25932 1514 1 8 . 1 1 466 466 TYR N N 466 118.846 118.846 119.925 -1.079 25932 1515 1 8 . 1 1 466 466 TYR C C 466 176.150 176.150 175.874 0.276 25932 1516 1 8 . 1 1 466 466 TYR CA C 466 58.429 58.429 57.554 0.875 25932 1517 1 8 . 1 1 466 466 TYR CB C 466 37.917 37.917 38.937 -1.020 25932 1518 1 8 . 1 1 466 466 TYR H H 466 7.807 7.807 6.946 0.861 25932 1519 1 8 . 1 1 467 467 GLY N N 467 107.987 107.987 107.208 0.779 25932 1520 1 8 . 1 1 467 467 GLY C C 467 174.143 174.143 174.318 -0.175 25932 1521 1 8 . 1 1 467 467 GLY CA C 467 45.547 45.547 45.366 0.181 25932 1522 1 8 . 1 1 467 467 GLY H H 467 7.887 7.887 7.463 0.424 25932 1523 1 8 . 1 1 468 468 TYR N N 468 119.878 119.878 118.098 1.780 25932 1524 1 8 . 1 1 468 468 TYR C C 468 175.524 175.524 175.636 -0.112 25932 1525 1 8 . 1 1 468 468 TYR CA C 468 58.164 58.164 61.040 -2.876 25932 1526 1 8 . 1 1 468 468 TYR CB C 468 37.786 37.786 37.074 0.712 25932 1527 1 8 . 1 1 468 468 TYR H H 468 7.867 7.867 8.188 -0.321 25932 1528 1 8 . 1 1 469 469 ARG N N 469 121.174 121.174 122.234 -1.060 25932 1529 1 8 . 1 1 469 469 ARG C C 469 175.800 175.800 175.033 0.767 25932 1530 1 8 . 1 1 469 469 ARG CA C 469 55.334 55.334 55.492 -0.158 25932 1531 1 8 . 1 1 469 469 ARG CB C 469 30.035 30.035 31.661 -1.626 25932 1532 1 8 . 1 1 469 469 ARG H H 469 7.873 7.873 8.420 -0.547 25932 1533 1 8 . 1 1 470 470 LEU N N 470 121.718 121.718 127.198 -5.480 25932 1534 1 8 . 1 1 470 470 LEU C C 470 176.618 176.618 177.456 -0.838 25932 1535 1 8 . 1 1 470 470 LEU CA C 470 54.858 54.858 53.882 0.976 25932 1536 1 8 . 1 1 470 470 LEU CB C 470 41.331 41.331 43.190 -1.859 25932 1537 1 8 . 1 1 470 470 LEU H H 470 7.940 7.940 8.613 -0.673 25932 1538 1 8 . 1 1 471 471 ARG N N 471 120.624 120.624 123.241 -2.617 25932 1539 1 8 . 1 1 471 471 ARG CA C 471 55.308 55.308 57.299 -1.991 25932 1540 1 8 . 1 1 471 471 ARG CB C 471 30.010 30.010 30.336 -0.326 25932 1541 1 8 . 1 1 471 471 ARG H H 471 7.922 7.922 8.493 -0.571 25932 1542 1 8 . 1 1 472 472 ARG C C 472 175.258 175.258 175.865 -0.607 25932 1543 1 8 . 1 1 472 472 ARG CA C 472 55.704 55.704 55.864 -0.160 25932 1544 1 8 . 1 1 472 472 ARG CB C 472 29.851 29.851 30.660 -0.809 25932 1545 1 9 . 1 1 433 433 SER C C 433 174.143 174.143 174.339 -0.196 25932 1546 1 9 . 1 1 433 433 SER CA C 433 57.715 57.715 59.866 -2.151 25932 1547 1 9 . 1 1 433 433 SER CB C 433 63.602 63.602 63.251 0.351 25932 1548 1 9 . 1 1 434 434 TRP N N 434 122.746 122.746 121.491 1.255 25932 1549 1 9 . 1 1 434 434 TRP C C 434 175.587 175.587 175.231 0.356 25932 1550 1 9 . 1 1 434 434 TRP CA C 434 56.604 56.604 56.405 0.199 25932 1551 1 9 . 1 1 434 434 TRP CB C 434 29.269 29.269 30.732 -1.463 25932 1552 1 9 . 1 1 434 434 TRP H H 434 8.283 8.283 7.571 0.712 25932 1553 1 9 . 1 1 435 435 ASP N N 435 121.374 121.374 122.653 -1.279 25932 1554 1 9 . 1 1 435 435 ASP C C 435 176.543 176.543 177.203 -0.660 25932 1555 1 9 . 1 1 435 435 ASP CA C 435 53.562 53.562 53.207 0.355 25932 1556 1 9 . 1 1 435 435 ASP CB C 435 40.854 40.854 41.634 -0.780 25932 1557 1 9 . 1 1 435 435 ASP H H 435 8.219 8.219 8.813 -0.594 25932 1558 1 9 . 1 1 436 436 THR N N 436 116.111 116.111 117.629 -1.518 25932 1559 1 9 . 1 1 436 436 THR C C 436 175.651 175.651 176.301 -0.650 25932 1560 1 9 . 1 1 436 436 THR CA C 436 65.015 65.015 64.430 0.585 25932 1561 1 9 . 1 1 436 436 THR CB C 436 68.416 68.416 69.107 -0.691 25932 1562 1 9 . 1 1 436 436 THR H H 436 8.251 8.251 8.612 -0.361 25932 1563 1 9 . 1 1 437 437 GLU N N 437 121.374 121.374 121.820 -0.446 25932 1564 1 9 . 1 1 437 437 GLU C C 437 177.988 177.988 178.435 -0.447 25932 1565 1 9 . 1 1 437 437 GLU CA C 437 59.513 59.513 59.544 -0.031 25932 1566 1 9 . 1 1 437 437 GLU CB C 437 28.370 28.370 29.593 -1.223 25932 1567 1 9 . 1 1 437 437 GLU H H 437 8.897 8.897 9.384 -0.487 25932 1568 1 9 . 1 1 438 438 SER N N 438 115.658 115.658 115.311 0.347 25932 1569 1 9 . 1 1 438 438 SER C C 438 175.832 175.832 176.821 -0.989 25932 1570 1 9 . 1 1 438 438 SER CA C 438 60.889 60.889 61.326 -0.437 25932 1571 1 9 . 1 1 438 438 SER CB C 438 62.491 62.491 62.660 -0.169 25932 1572 1 9 . 1 1 438 438 SER H H 438 8.018 8.018 7.805 0.213 25932 1573 1 9 . 1 1 439 439 VAL N N 439 122.608 122.608 121.792 0.816 25932 1574 1 9 . 1 1 439 439 VAL C C 439 177.743 177.743 178.114 -0.371 25932 1575 1 9 . 1 1 439 439 VAL CA C 439 65.861 65.861 66.609 -0.748 25932 1576 1 9 . 1 1 439 439 VAL CB C 439 30.698 30.698 31.462 -0.764 25932 1577 1 9 . 1 1 439 439 VAL H H 439 7.908 7.908 7.341 0.567 25932 1578 1 9 . 1 1 440 440 LEU N N 440 120.077 120.077 119.772 0.305 25932 1579 1 9 . 1 1 440 440 LEU C C 440 178.466 178.466 178.637 -0.171 25932 1580 1 9 . 1 1 440 440 LEU CA C 440 57.953 57.953 58.147 -0.194 25932 1581 1 9 . 1 1 440 440 LEU CB C 440 40.378 40.378 41.463 -1.085 25932 1582 1 9 . 1 1 440 440 LEU H H 440 8.171 8.171 8.234 -0.063 25932 1583 1 9 . 1 1 441 441 ALA N N 441 119.465 119.465 121.308 -1.843 25932 1584 1 9 . 1 1 441 441 ALA C C 441 178.986 178.986 179.419 -0.433 25932 1585 1 9 . 1 1 441 441 ALA CA C 441 55.122 55.122 54.718 0.404 25932 1586 1 9 . 1 1 441 441 ALA CB C 441 17.367 17.367 18.118 -0.751 25932 1587 1 9 . 1 1 441 441 ALA H H 441 8.090 8.090 7.691 0.399 25932 1588 1 9 . 1 1 442 442 MET N N 442 116.111 116.111 117.290 -1.179 25932 1589 1 9 . 1 1 442 442 MET C C 442 178.073 178.073 178.107 -0.034 25932 1590 1 9 . 1 1 442 442 MET CA C 442 58.217 58.217 59.203 -0.986 25932 1591 1 9 . 1 1 442 442 MET CB C 442 31.597 31.597 32.577 -0.980 25932 1592 1 9 . 1 1 442 442 MET H H 442 7.875 7.875 7.560 0.315 25932 1593 1 9 . 1 1 443 443 TRP N N 443 119.802 119.802 118.295 1.507 25932 1594 1 9 . 1 1 443 443 TRP C C 443 178.445 178.445 177.711 0.734 25932 1595 1 9 . 1 1 443 443 TRP CA C 443 60.624 60.624 59.410 1.214 25932 1596 1 9 . 1 1 443 443 TRP CB C 443 28.899 28.899 28.327 0.572 25932 1597 1 9 . 1 1 443 443 TRP H H 443 8.196 8.196 7.559 0.637 25932 1598 1 9 . 1 1 444 444 VAL N N 444 118.509 118.509 121.992 -3.483 25932 1599 1 9 . 1 1 444 444 VAL C C 444 177.563 177.563 177.981 -0.418 25932 1600 1 9 . 1 1 444 444 VAL CA C 444 66.866 66.866 65.724 1.142 25932 1601 1 9 . 1 1 444 444 VAL CB C 444 30.221 30.221 30.900 -0.679 25932 1602 1 9 . 1 1 444 444 VAL H H 444 8.353 8.353 6.381 1.972 25932 1603 1 9 . 1 1 445 445 LEU N N 445 119.328 119.328 120.323 -0.995 25932 1604 1 9 . 1 1 445 445 LEU C C 445 178.168 178.168 178.196 -0.028 25932 1605 1 9 . 1 1 445 445 LEU CA C 445 57.979 57.979 57.753 0.226 25932 1606 1 9 . 1 1 445 445 LEU CB C 445 40.431 40.431 41.267 -0.836 25932 1607 1 9 . 1 1 445 445 LEU H H 445 8.233 8.233 7.420 0.813 25932 1608 1 9 . 1 1 446 446 ALA N N 446 120.009 120.009 122.241 -2.232 25932 1609 1 9 . 1 1 446 446 ALA C C 446 179.071 179.071 179.959 -0.888 25932 1610 1 9 . 1 1 446 446 ALA CA C 446 55.096 55.096 55.224 -0.128 25932 1611 1 9 . 1 1 446 446 ALA CB C 446 16.996 16.996 18.260 -1.264 25932 1612 1 9 . 1 1 446 446 ALA H H 446 8.402 8.402 7.803 0.599 25932 1613 1 9 . 1 1 447 447 LEU N N 447 117.136 117.136 119.194 -2.058 25932 1614 1 9 . 1 1 447 447 LEU C C 447 178.678 178.678 179.307 -0.629 25932 1615 1 9 . 1 1 447 447 LEU CA C 447 57.767 57.767 58.178 -0.411 25932 1616 1 9 . 1 1 447 447 LEU CB C 447 40.378 40.378 41.489 -1.111 25932 1617 1 9 . 1 1 447 447 LEU H H 447 8.244 8.244 8.340 -0.096 25932 1618 1 9 . 1 1 448 448 ILE N N 448 119.121 119.121 119.361 -0.240 25932 1619 1 9 . 1 1 448 448 ILE C C 448 177.574 177.574 178.136 -0.562 25932 1620 1 9 . 1 1 448 448 ILE CA C 448 65.702 65.702 65.775 -0.073 25932 1621 1 9 . 1 1 448 448 ILE CB C 448 36.464 36.464 37.896 -1.432 25932 1622 1 9 . 1 1 448 448 ILE H H 448 8.286 8.286 8.106 0.180 25932 1623 1 9 . 1 1 449 449 VAL N N 449 119.052 119.052 118.143 0.909 25932 1624 1 9 . 1 1 449 449 VAL C C 449 179.135 179.135 177.672 1.463 25932 1625 1 9 . 1 1 449 449 VAL CA C 449 67.051 67.051 66.032 1.019 25932 1626 1 9 . 1 1 449 449 VAL CB C 449 30.175 30.175 30.884 -0.709 25932 1627 1 9 . 1 1 449 449 VAL H H 449 8.327 8.327 7.786 0.541 25932 1628 1 9 . 1 1 450 450 ILE N N 450 123.014 123.014 121.413 1.601 25932 1629 1 9 . 1 1 450 450 ILE C C 450 177.074 177.074 178.016 -0.942 25932 1630 1 9 . 1 1 450 450 ILE CA C 450 65.594 65.594 63.806 1.788 25932 1631 1 9 . 1 1 450 450 ILE CB C 450 36.594 36.594 36.309 0.286 25932 1632 1 9 . 1 1 450 450 ILE H H 450 8.670 8.670 7.410 1.260 25932 1633 1 9 . 1 1 451 451 PHE N N 451 119.392 119.392 119.230 0.162 25932 1634 1 9 . 1 1 451 451 PHE C C 451 177.297 177.297 178.212 -0.915 25932 1635 1 9 . 1 1 451 451 PHE CA C 451 61.389 61.389 62.491 -1.102 25932 1636 1 9 . 1 1 451 451 PHE CB C 451 37.970 37.970 38.001 -0.031 25932 1637 1 9 . 1 1 451 451 PHE H H 451 8.651 8.651 7.557 1.094 25932 1638 1 9 . 1 1 452 452 LEU N N 452 118.367 118.367 119.726 -1.359 25932 1639 1 9 . 1 1 452 452 LEU C C 452 177.967 177.967 179.020 -1.053 25932 1640 1 9 . 1 1 452 452 LEU CA C 452 57.606 57.606 58.496 -0.890 25932 1641 1 9 . 1 1 452 452 LEU CB C 452 40.924 40.924 41.233 -0.309 25932 1642 1 9 . 1 1 452 452 LEU H H 452 8.731 8.731 7.894 0.837 25932 1643 1 9 . 1 1 453 453 THR N N 453 116.173 116.173 116.876 -0.703 25932 1644 1 9 . 1 1 453 453 THR C C 453 176.220 176.220 176.932 -0.712 25932 1645 1 9 . 1 1 453 453 THR CA C 453 67.919 67.919 67.464 0.455 25932 1646 1 9 . 1 1 453 453 THR CB C 453 67.006 67.006 68.684 -1.678 25932 1647 1 9 . 1 1 453 453 THR H H 453 8.104 8.104 8.163 -0.059 25932 1648 1 9 . 1 1 454 454 ILE N N 454 120.077 120.077 121.204 -1.127 25932 1649 1 9 . 1 1 454 454 ILE C C 454 176.915 176.915 177.518 -0.603 25932 1650 1 9 . 1 1 454 454 ILE CA C 454 65.041 65.041 65.085 -0.045 25932 1651 1 9 . 1 1 454 454 ILE CB C 454 36.464 36.464 37.700 -1.236 25932 1652 1 9 . 1 1 454 454 ILE H H 454 8.043 8.043 8.212 -0.169 25932 1653 1 9 . 1 1 455 455 ALA N N 455 121.174 121.174 122.993 -1.819 25932 1654 1 9 . 1 1 455 455 ALA C C 455 178.806 178.806 179.637 -0.831 25932 1655 1 9 . 1 1 455 455 ALA CA C 455 55.346 55.346 55.512 -0.166 25932 1656 1 9 . 1 1 455 455 ALA CB C 455 16.890 16.890 18.108 -1.218 25932 1657 1 9 . 1 1 455 455 ALA H H 455 8.265 8.265 8.336 -0.071 25932 1658 1 9 . 1 1 456 456 VAL N N 456 116.661 116.661 119.283 -2.622 25932 1659 1 9 . 1 1 456 456 VAL C C 456 177.489 177.489 178.128 -0.639 25932 1660 1 9 . 1 1 456 456 VAL CA C 456 66.494 66.494 66.171 0.323 25932 1661 1 9 . 1 1 456 456 VAL CB C 456 30.226 30.226 31.315 -1.089 25932 1662 1 9 . 1 1 456 456 VAL H H 456 8.211 8.211 7.887 0.324 25932 1663 1 9 . 1 1 457 457 LEU N N 457 119.465 119.465 120.100 -0.635 25932 1664 1 9 . 1 1 457 457 LEU C C 457 179.517 179.517 179.148 0.369 25932 1665 1 9 . 1 1 457 457 LEU CA C 457 58.056 58.056 58.531 -0.475 25932 1666 1 9 . 1 1 457 457 LEU CB C 457 40.414 40.414 41.407 -0.993 25932 1667 1 9 . 1 1 457 457 LEU H H 457 8.150 8.150 7.444 0.706 25932 1668 1 9 . 1 1 458 458 LEU N N 458 118.436 118.436 119.297 -0.861 25932 1669 1 9 . 1 1 458 458 LEU C C 458 178.891 178.891 179.004 -0.113 25932 1670 1 9 . 1 1 458 458 LEU CA C 458 57.395 57.395 58.209 -0.814 25932 1671 1 9 . 1 1 458 458 LEU CB C 458 40.484 40.484 41.315 -0.831 25932 1672 1 9 . 1 1 458 458 LEU H H 458 8.542 8.542 7.864 0.678 25932 1673 1 9 . 1 1 459 459 ALA N N 459 122.337 122.337 121.696 0.641 25932 1674 1 9 . 1 1 459 459 ALA C C 459 179.793 179.793 179.427 0.366 25932 1675 1 9 . 1 1 459 459 ALA CA C 459 55.122 55.122 55.005 0.117 25932 1676 1 9 . 1 1 459 459 ALA CB C 459 17.208 17.208 18.577 -1.369 25932 1677 1 9 . 1 1 459 459 ALA H H 459 8.401 8.401 8.026 0.375 25932 1678 1 9 . 1 1 460 460 LEU N N 460 117.961 117.961 120.609 -2.648 25932 1679 1 9 . 1 1 460 460 LEU C C 460 179.262 179.262 178.683 0.579 25932 1680 1 9 . 1 1 460 460 LEU CA C 460 57.673 57.673 57.990 -0.317 25932 1681 1 9 . 1 1 460 460 LEU CB C 460 40.414 40.414 41.472 -1.058 25932 1682 1 9 . 1 1 460 460 LEU H H 460 8.518 8.518 8.432 0.086 25932 1683 1 9 . 1 1 461 461 ARG N N 461 119.534 119.534 119.555 -0.021 25932 1684 1 9 . 1 1 461 461 ARG C C 461 178.625 178.625 178.503 0.122 25932 1685 1 9 . 1 1 461 461 ARG CA C 461 57.818 57.818 59.148 -1.331 25932 1686 1 9 . 1 1 461 461 ARG CB C 461 28.443 28.443 29.805 -1.361 25932 1687 1 9 . 1 1 461 461 ARG H H 461 8.029 8.029 7.947 0.082 25932 1688 1 9 . 1 1 462 462 PHE N N 462 118.777 118.777 120.967 -2.190 25932 1689 1 9 . 1 1 462 462 PHE C C 462 177.127 177.127 177.554 -0.427 25932 1690 1 9 . 1 1 462 462 PHE CA C 462 60.624 60.624 61.232 -0.608 25932 1691 1 9 . 1 1 462 462 PHE CB C 462 38.633 38.633 39.038 -0.405 25932 1692 1 9 . 1 1 462 462 PHE H H 462 8.460 8.460 7.958 0.502 25932 1693 1 9 . 1 1 463 463 CYS N N 463 116.386 116.386 117.652 -1.266 25932 1694 1 9 . 1 1 463 463 CYS C C 463 175.980 175.980 177.100 -1.120 25932 1695 1 9 . 1 1 463 463 CYS CA C 463 61.999 61.999 62.612 -0.613 25932 1696 1 9 . 1 1 463 463 CYS CB C 463 26.966 26.966 28.139 -1.173 25932 1697 1 9 . 1 1 463 463 CYS H H 463 8.278 8.278 8.597 -0.319 25932 1698 1 9 . 1 1 464 464 GLY N N 464 107.774 107.774 109.045 -1.271 25932 1699 1 9 . 1 1 464 464 GLY C C 464 174.990 174.990 176.271 -1.281 25932 1700 1 9 . 1 1 464 464 GLY CA C 464 45.944 45.944 47.023 -1.079 25932 1701 1 9 . 1 1 464 464 GLY H H 464 8.050 8.050 8.355 -0.305 25932 1702 1 9 . 1 1 465 465 ILE N N 465 119.940 119.940 120.360 -0.420 25932 1703 1 9 . 1 1 465 465 ILE C C 465 176.458 176.458 175.424 1.034 25932 1704 1 9 . 1 1 465 465 ILE CA C 465 62.423 62.423 61.717 0.706 25932 1705 1 9 . 1 1 465 465 ILE CB C 465 37.409 37.409 38.162 -0.753 25932 1706 1 9 . 1 1 465 465 ILE H H 465 7.745 7.745 7.868 -0.123 25932 1707 1 9 . 1 1 466 466 TYR N N 466 118.846 118.846 120.600 -1.754 25932 1708 1 9 . 1 1 466 466 TYR C C 466 176.150 176.150 175.897 0.253 25932 1709 1 9 . 1 1 466 466 TYR CA C 466 58.429 58.429 58.099 0.331 25932 1710 1 9 . 1 1 466 466 TYR CB C 466 37.917 37.917 39.206 -1.289 25932 1711 1 9 . 1 1 466 466 TYR H H 466 7.807 7.807 7.631 0.176 25932 1712 1 9 . 1 1 467 467 GLY N N 467 107.987 107.987 106.950 1.037 25932 1713 1 9 . 1 1 467 467 GLY C C 467 174.143 174.143 173.520 0.623 25932 1714 1 9 . 1 1 467 467 GLY CA C 467 45.547 45.547 44.997 0.550 25932 1715 1 9 . 1 1 467 467 GLY H H 467 7.887 7.887 7.363 0.524 25932 1716 1 9 . 1 1 468 468 TYR N N 468 119.878 119.878 122.147 -2.269 25932 1717 1 9 . 1 1 468 468 TYR C C 468 175.524 175.524 175.591 -0.067 25932 1718 1 9 . 1 1 468 468 TYR CA C 468 58.164 58.164 58.591 -0.427 25932 1719 1 9 . 1 1 468 468 TYR CB C 468 37.786 37.786 39.109 -1.323 25932 1720 1 9 . 1 1 468 468 TYR H H 468 7.867 7.867 7.959 -0.092 25932 1721 1 9 . 1 1 469 469 ARG N N 469 121.174 121.174 124.070 -2.896 25932 1722 1 9 . 1 1 469 469 ARG C C 469 175.800 175.800 174.865 0.935 25932 1723 1 9 . 1 1 469 469 ARG CA C 469 55.334 55.334 56.423 -1.089 25932 1724 1 9 . 1 1 469 469 ARG CB C 469 30.035 30.035 28.290 1.745 25932 1725 1 9 . 1 1 469 469 ARG H H 469 7.873 7.873 8.116 -0.243 25932 1726 1 9 . 1 1 470 470 LEU N N 470 121.718 121.718 122.321 -0.603 25932 1727 1 9 . 1 1 470 470 LEU C C 470 176.618 176.618 178.553 -1.935 25932 1728 1 9 . 1 1 470 470 LEU CA C 470 54.858 54.858 54.887 -0.029 25932 1729 1 9 . 1 1 470 470 LEU CB C 470 41.331 41.331 41.976 -0.645 25932 1730 1 9 . 1 1 470 470 LEU H H 470 7.940 7.940 8.363 -0.423 25932 1731 1 9 . 1 1 471 471 ARG N N 471 120.624 120.624 122.668 -2.044 25932 1732 1 9 . 1 1 471 471 ARG CA C 471 55.308 55.308 57.736 -2.428 25932 1733 1 9 . 1 1 471 471 ARG CB C 471 30.010 30.010 30.655 -0.645 25932 1734 1 9 . 1 1 471 471 ARG H H 471 7.922 7.922 8.550 -0.628 25932 1735 1 9 . 1 1 472 472 ARG C C 472 175.258 175.258 175.627 -0.369 25932 1736 1 9 . 1 1 472 472 ARG CA C 472 55.704 55.704 55.822 -0.118 25932 1737 1 9 . 1 1 472 472 ARG CB C 472 29.851 29.851 30.988 -1.137 25932 1738 1 10 . 1 1 433 433 SER C C 433 174.143 174.143 175.330 -1.187 25932 1739 1 10 . 1 1 433 433 SER CA C 433 57.715 57.715 57.494 0.221 25932 1740 1 10 . 1 1 433 433 SER CB C 433 63.602 63.602 64.826 -1.224 25932 1741 1 10 . 1 1 434 434 TRP N N 434 122.746 122.746 121.964 0.782 25932 1742 1 10 . 1 1 434 434 TRP C C 434 175.587 175.587 177.883 -2.296 25932 1743 1 10 . 1 1 434 434 TRP CA C 434 56.604 56.604 60.557 -3.953 25932 1744 1 10 . 1 1 434 434 TRP CB C 434 29.269 29.269 29.211 0.058 25932 1745 1 10 . 1 1 434 434 TRP H H 434 8.283 8.283 8.868 -0.585 25932 1746 1 10 . 1 1 435 435 ASP N N 435 121.374 121.374 117.290 4.084 25932 1747 1 10 . 1 1 435 435 ASP C C 435 176.543 176.543 178.449 -1.906 25932 1748 1 10 . 1 1 435 435 ASP CA C 435 53.562 53.562 57.277 -3.715 25932 1749 1 10 . 1 1 435 435 ASP CB C 435 40.854 40.854 40.208 0.646 25932 1750 1 10 . 1 1 435 435 ASP H H 435 8.219 8.219 8.395 -0.176 25932 1751 1 10 . 1 1 436 436 THR N N 436 116.111 116.111 112.668 3.443 25932 1752 1 10 . 1 1 436 436 THR C C 436 175.651 175.651 176.442 -0.791 25932 1753 1 10 . 1 1 436 436 THR CA C 436 65.015 65.015 65.484 -0.468 25932 1754 1 10 . 1 1 436 436 THR CB C 436 68.416 68.416 68.329 0.087 25932 1755 1 10 . 1 1 436 436 THR H H 436 8.251 8.251 7.778 0.473 25932 1756 1 10 . 1 1 437 437 GLU N N 437 121.374 121.374 121.626 -0.252 25932 1757 1 10 . 1 1 437 437 GLU C C 437 177.988 177.988 178.848 -0.860 25932 1758 1 10 . 1 1 437 437 GLU CA C 437 59.513 59.513 59.531 -0.018 25932 1759 1 10 . 1 1 437 437 GLU CB C 437 28.370 28.370 29.165 -0.795 25932 1760 1 10 . 1 1 437 437 GLU H H 437 8.897 8.897 7.783 1.114 25932 1761 1 10 . 1 1 438 438 SER N N 438 115.658 115.658 115.858 -0.200 25932 1762 1 10 . 1 1 438 438 SER C C 438 175.832 175.832 176.731 -0.899 25932 1763 1 10 . 1 1 438 438 SER CA C 438 60.889 60.889 61.712 -0.823 25932 1764 1 10 . 1 1 438 438 SER CB C 438 62.491 62.491 63.013 -0.522 25932 1765 1 10 . 1 1 438 438 SER H H 438 8.018 8.018 7.715 0.303 25932 1766 1 10 . 1 1 439 439 VAL N N 439 122.608 122.608 122.186 0.422 25932 1767 1 10 . 1 1 439 439 VAL C C 439 177.743 177.743 178.133 -0.390 25932 1768 1 10 . 1 1 439 439 VAL CA C 439 65.861 65.861 66.126 -0.265 25932 1769 1 10 . 1 1 439 439 VAL CB C 439 30.698 30.698 31.441 -0.743 25932 1770 1 10 . 1 1 439 439 VAL H H 439 7.908 7.908 7.421 0.487 25932 1771 1 10 . 1 1 440 440 LEU N N 440 120.077 120.077 120.958 -0.881 25932 1772 1 10 . 1 1 440 440 LEU C C 440 178.466 178.466 178.198 0.268 25932 1773 1 10 . 1 1 440 440 LEU CA C 440 57.953 57.953 58.172 -0.219 25932 1774 1 10 . 1 1 440 440 LEU CB C 440 40.378 40.378 41.755 -1.377 25932 1775 1 10 . 1 1 440 440 LEU H H 440 8.171 8.171 8.448 -0.277 25932 1776 1 10 . 1 1 441 441 ALA N N 441 119.465 119.465 121.035 -1.570 25932 1777 1 10 . 1 1 441 441 ALA C C 441 178.986 178.986 179.435 -0.449 25932 1778 1 10 . 1 1 441 441 ALA CA C 441 55.122 55.122 54.689 0.433 25932 1779 1 10 . 1 1 441 441 ALA CB C 441 17.367 17.367 18.192 -0.825 25932 1780 1 10 . 1 1 441 441 ALA H H 441 8.090 8.090 7.786 0.304 25932 1781 1 10 . 1 1 442 442 MET N N 442 116.111 116.111 117.184 -1.073 25932 1782 1 10 . 1 1 442 442 MET C C 442 178.073 178.073 178.064 0.009 25932 1783 1 10 . 1 1 442 442 MET CA C 442 58.217 58.217 59.137 -0.920 25932 1784 1 10 . 1 1 442 442 MET CB C 442 31.597 31.597 32.541 -0.944 25932 1785 1 10 . 1 1 442 442 MET H H 442 7.875 7.875 7.491 0.384 25932 1786 1 10 . 1 1 443 443 TRP N N 443 119.802 119.802 118.817 0.985 25932 1787 1 10 . 1 1 443 443 TRP C C 443 178.445 178.445 177.442 1.003 25932 1788 1 10 . 1 1 443 443 TRP CA C 443 60.624 60.624 59.885 0.739 25932 1789 1 10 . 1 1 443 443 TRP CB C 443 28.899 28.899 27.991 0.908 25932 1790 1 10 . 1 1 443 443 TRP H H 443 8.196 8.196 7.602 0.594 25932 1791 1 10 . 1 1 444 444 VAL N N 444 118.509 118.509 122.153 -3.644 25932 1792 1 10 . 1 1 444 444 VAL C C 444 177.563 177.563 177.958 -0.395 25932 1793 1 10 . 1 1 444 444 VAL CA C 444 66.866 66.866 65.862 1.004 25932 1794 1 10 . 1 1 444 444 VAL CB C 444 30.221 30.221 30.788 -0.567 25932 1795 1 10 . 1 1 444 444 VAL H H 444 8.353 8.353 6.377 1.976 25932 1796 1 10 . 1 1 445 445 LEU N N 445 119.328 119.328 119.738 -0.410 25932 1797 1 10 . 1 1 445 445 LEU C C 445 178.168 178.168 179.023 -0.855 25932 1798 1 10 . 1 1 445 445 LEU CA C 445 57.979 57.979 57.738 0.241 25932 1799 1 10 . 1 1 445 445 LEU CB C 445 40.431 40.431 40.291 0.140 25932 1800 1 10 . 1 1 445 445 LEU H H 445 8.233 8.233 7.324 0.909 25932 1801 1 10 . 1 1 446 446 ALA N N 446 120.009 120.009 122.742 -2.733 25932 1802 1 10 . 1 1 446 446 ALA C C 446 179.071 179.071 180.118 -1.047 25932 1803 1 10 . 1 1 446 446 ALA CA C 446 55.096 55.096 55.291 -0.195 25932 1804 1 10 . 1 1 446 446 ALA CB C 446 16.996 16.996 18.291 -1.295 25932 1805 1 10 . 1 1 446 446 ALA H H 446 8.402 8.402 7.833 0.569 25932 1806 1 10 . 1 1 447 447 LEU N N 447 117.136 117.136 119.604 -2.468 25932 1807 1 10 . 1 1 447 447 LEU C C 447 178.678 178.678 179.347 -0.669 25932 1808 1 10 . 1 1 447 447 LEU CA C 447 57.767 57.767 58.105 -0.338 25932 1809 1 10 . 1 1 447 447 LEU CB C 447 40.378 40.378 41.343 -0.965 25932 1810 1 10 . 1 1 447 447 LEU H H 447 8.244 8.244 8.258 -0.014 25932 1811 1 10 . 1 1 448 448 ILE N N 448 119.121 119.121 120.021 -0.900 25932 1812 1 10 . 1 1 448 448 ILE C C 448 177.574 177.574 178.715 -1.141 25932 1813 1 10 . 1 1 448 448 ILE CA C 448 65.702 65.702 64.436 1.266 25932 1814 1 10 . 1 1 448 448 ILE CB C 448 36.464 36.464 36.681 -0.217 25932 1815 1 10 . 1 1 448 448 ILE H H 448 8.286 8.286 7.865 0.421 25932 1816 1 10 . 1 1 449 449 VAL N N 449 119.052 119.052 120.243 -1.191 25932 1817 1 10 . 1 1 449 449 VAL C C 449 179.135 179.135 178.487 0.648 25932 1818 1 10 . 1 1 449 449 VAL CA C 449 67.051 67.051 67.188 -0.137 25932 1819 1 10 . 1 1 449 449 VAL CB C 449 30.175 30.175 31.209 -1.034 25932 1820 1 10 . 1 1 449 449 VAL H H 449 8.327 8.327 7.803 0.524 25932 1821 1 10 . 1 1 450 450 ILE N N 450 123.014 123.014 120.819 2.195 25932 1822 1 10 . 1 1 450 450 ILE C C 450 177.074 177.074 177.951 -0.877 25932 1823 1 10 . 1 1 450 450 ILE CA C 450 65.594 65.594 65.561 0.033 25932 1824 1 10 . 1 1 450 450 ILE CB C 450 36.594 36.594 37.608 -1.014 25932 1825 1 10 . 1 1 450 450 ILE H H 450 8.670 8.670 7.805 0.865 25932 1826 1 10 . 1 1 451 451 PHE N N 451 119.392 119.392 118.717 0.675 25932 1827 1 10 . 1 1 451 451 PHE C C 451 177.297 177.297 177.955 -0.658 25932 1828 1 10 . 1 1 451 451 PHE CA C 451 61.389 61.389 62.522 -1.133 25932 1829 1 10 . 1 1 451 451 PHE CB C 451 37.970 37.970 38.259 -0.289 25932 1830 1 10 . 1 1 451 451 PHE H H 451 8.651 8.651 7.787 0.864 25932 1831 1 10 . 1 1 452 452 LEU N N 452 118.367 118.367 119.780 -1.413 25932 1832 1 10 . 1 1 452 452 LEU C C 452 177.967 177.967 179.243 -1.276 25932 1833 1 10 . 1 1 452 452 LEU CA C 452 57.606 57.606 58.409 -0.803 25932 1834 1 10 . 1 1 452 452 LEU CB C 452 40.924 40.924 41.492 -0.569 25932 1835 1 10 . 1 1 452 452 LEU H H 452 8.731 8.731 8.230 0.501 25932 1836 1 10 . 1 1 453 453 THR N N 453 116.173 116.173 116.633 -0.460 25932 1837 1 10 . 1 1 453 453 THR C C 453 176.220 176.220 176.963 -0.743 25932 1838 1 10 . 1 1 453 453 THR CA C 453 67.919 67.919 67.171 0.748 25932 1839 1 10 . 1 1 453 453 THR CB C 453 67.006 67.006 68.692 -1.686 25932 1840 1 10 . 1 1 453 453 THR H H 453 8.104 8.104 8.289 -0.185 25932 1841 1 10 . 1 1 454 454 ILE N N 454 120.077 120.077 121.466 -1.389 25932 1842 1 10 . 1 1 454 454 ILE C C 454 176.915 176.915 177.538 -0.623 25932 1843 1 10 . 1 1 454 454 ILE CA C 454 65.041 65.041 65.234 -0.193 25932 1844 1 10 . 1 1 454 454 ILE CB C 454 36.464 36.464 37.583 -1.119 25932 1845 1 10 . 1 1 454 454 ILE H H 454 8.043 8.043 8.379 -0.336 25932 1846 1 10 . 1 1 455 455 ALA N N 455 121.174 121.174 122.712 -1.538 25932 1847 1 10 . 1 1 455 455 ALA C C 455 178.806 178.806 179.616 -0.810 25932 1848 1 10 . 1 1 455 455 ALA CA C 455 55.346 55.346 55.494 -0.148 25932 1849 1 10 . 1 1 455 455 ALA CB C 455 16.890 16.890 18.080 -1.190 25932 1850 1 10 . 1 1 455 455 ALA H H 455 8.265 8.265 8.537 -0.272 25932 1851 1 10 . 1 1 456 456 VAL N N 456 116.661 116.661 119.045 -2.384 25932 1852 1 10 . 1 1 456 456 VAL C C 456 177.489 177.489 178.030 -0.541 25932 1853 1 10 . 1 1 456 456 VAL CA C 456 66.494 66.494 66.793 -0.299 25932 1854 1 10 . 1 1 456 456 VAL CB C 456 30.226 30.226 31.799 -1.573 25932 1855 1 10 . 1 1 456 456 VAL H H 456 8.211 8.211 7.848 0.363 25932 1856 1 10 . 1 1 457 457 LEU N N 457 119.465 119.465 119.974 -0.509 25932 1857 1 10 . 1 1 457 457 LEU C C 457 179.517 179.517 179.140 0.377 25932 1858 1 10 . 1 1 457 457 LEU CA C 457 58.056 58.056 58.044 0.012 25932 1859 1 10 . 1 1 457 457 LEU CB C 457 40.414 40.414 41.564 -1.150 25932 1860 1 10 . 1 1 457 457 LEU H H 457 8.150 8.150 7.517 0.633 25932 1861 1 10 . 1 1 458 458 LEU N N 458 118.436 118.436 119.232 -0.796 25932 1862 1 10 . 1 1 458 458 LEU C C 458 178.891 178.891 179.034 -0.143 25932 1863 1 10 . 1 1 458 458 LEU CA C 458 57.395 57.395 58.008 -0.613 25932 1864 1 10 . 1 1 458 458 LEU CB C 458 40.484 40.484 41.450 -0.966 25932 1865 1 10 . 1 1 458 458 LEU H H 458 8.542 8.542 8.010 0.532 25932 1866 1 10 . 1 1 459 459 ALA N N 459 122.337 122.337 121.586 0.751 25932 1867 1 10 . 1 1 459 459 ALA C C 459 179.793 179.793 179.417 0.376 25932 1868 1 10 . 1 1 459 459 ALA CA C 459 55.122 55.122 55.020 0.103 25932 1869 1 10 . 1 1 459 459 ALA CB C 459 17.208 17.208 18.621 -1.413 25932 1870 1 10 . 1 1 459 459 ALA H H 459 8.401 8.401 8.033 0.368 25932 1871 1 10 . 1 1 460 460 LEU N N 460 117.961 117.961 120.527 -2.566 25932 1872 1 10 . 1 1 460 460 LEU C C 460 179.262 179.262 178.622 0.640 25932 1873 1 10 . 1 1 460 460 LEU CA C 460 57.673 57.673 57.949 -0.276 25932 1874 1 10 . 1 1 460 460 LEU CB C 460 40.414 40.414 41.520 -1.106 25932 1875 1 10 . 1 1 460 460 LEU H H 460 8.518 8.518 8.435 0.083 25932 1876 1 10 . 1 1 461 461 ARG N N 461 119.534 119.534 119.243 0.291 25932 1877 1 10 . 1 1 461 461 ARG C C 461 178.625 178.625 178.133 0.492 25932 1878 1 10 . 1 1 461 461 ARG CA C 461 57.818 57.818 59.318 -1.500 25932 1879 1 10 . 1 1 461 461 ARG CB C 461 28.443 28.443 29.798 -1.355 25932 1880 1 10 . 1 1 461 461 ARG H H 461 8.029 8.029 8.046 -0.017 25932 1881 1 10 . 1 1 462 462 PHE N N 462 118.777 118.777 121.157 -2.380 25932 1882 1 10 . 1 1 462 462 PHE C C 462 177.127 177.127 177.536 -0.409 25932 1883 1 10 . 1 1 462 462 PHE CA C 462 60.624 60.624 61.567 -0.943 25932 1884 1 10 . 1 1 462 462 PHE CB C 462 38.633 38.633 38.956 -0.323 25932 1885 1 10 . 1 1 462 462 PHE H H 462 8.460 8.460 7.840 0.620 25932 1886 1 10 . 1 1 463 463 CYS N N 463 116.386 116.386 116.778 -0.392 25932 1887 1 10 . 1 1 463 463 CYS C C 463 175.980 175.980 176.608 -0.628 25932 1888 1 10 . 1 1 463 463 CYS CA C 463 61.999 61.999 63.493 -1.494 25932 1889 1 10 . 1 1 463 463 CYS CB C 463 26.966 26.966 27.175 -0.209 25932 1890 1 10 . 1 1 463 463 CYS H H 463 8.278 8.278 8.313 -0.035 25932 1891 1 10 . 1 1 464 464 GLY N N 464 107.774 107.774 108.607 -0.833 25932 1892 1 10 . 1 1 464 464 GLY C C 464 174.990 174.990 175.343 -0.353 25932 1893 1 10 . 1 1 464 464 GLY CA C 464 45.944 45.944 46.465 -0.521 25932 1894 1 10 . 1 1 464 464 GLY H H 464 8.050 8.050 7.853 0.197 25932 1895 1 10 . 1 1 465 465 ILE N N 465 119.940 119.940 119.283 0.657 25932 1896 1 10 . 1 1 465 465 ILE C C 465 176.458 176.458 175.520 0.938 25932 1897 1 10 . 1 1 465 465 ILE CA C 465 62.423 62.423 61.978 0.445 25932 1898 1 10 . 1 1 465 465 ILE CB C 465 37.409 37.409 38.490 -1.081 25932 1899 1 10 . 1 1 465 465 ILE H H 465 7.745 7.745 8.022 -0.277 25932 1900 1 10 . 1 1 466 466 TYR N N 466 118.846 118.846 118.127 0.719 25932 1901 1 10 . 1 1 466 466 TYR C C 466 176.150 176.150 175.355 0.795 25932 1902 1 10 . 1 1 466 466 TYR CA C 466 58.429 58.429 56.987 1.442 25932 1903 1 10 . 1 1 466 466 TYR CB C 466 37.917 37.917 38.528 -0.611 25932 1904 1 10 . 1 1 466 466 TYR H H 466 7.807 7.807 7.189 0.618 25932 1905 1 10 . 1 1 467 467 GLY N N 467 107.987 107.987 107.006 0.981 25932 1906 1 10 . 1 1 467 467 GLY C C 467 174.143 174.143 174.253 -0.110 25932 1907 1 10 . 1 1 467 467 GLY CA C 467 45.547 45.547 45.310 0.237 25932 1908 1 10 . 1 1 467 467 GLY H H 467 7.887 7.887 7.394 0.493 25932 1909 1 10 . 1 1 468 468 TYR N N 468 119.878 119.878 117.366 2.512 25932 1910 1 10 . 1 1 468 468 TYR C C 468 175.524 175.524 176.315 -0.791 25932 1911 1 10 . 1 1 468 468 TYR CA C 468 58.164 58.164 58.441 -0.277 25932 1912 1 10 . 1 1 468 468 TYR CB C 468 37.786 37.786 37.913 -0.127 25932 1913 1 10 . 1 1 468 468 TYR H H 468 7.867 7.867 8.050 -0.183 25932 1914 1 10 . 1 1 469 469 ARG N N 469 121.174 121.174 122.647 -1.473 25932 1915 1 10 . 1 1 469 469 ARG C C 469 175.800 175.800 176.505 -0.705 25932 1916 1 10 . 1 1 469 469 ARG CA C 469 55.334 55.334 58.068 -2.734 25932 1917 1 10 . 1 1 469 469 ARG CB C 469 30.035 30.035 30.640 -0.605 25932 1918 1 10 . 1 1 469 469 ARG H H 469 7.873 7.873 8.701 -0.828 25932 1919 1 10 . 1 1 470 470 LEU N N 470 121.718 121.718 120.640 1.078 25932 1920 1 10 . 1 1 470 470 LEU C C 470 176.618 176.618 176.121 0.497 25932 1921 1 10 . 1 1 470 470 LEU CA C 470 54.858 54.858 53.433 1.425 25932 1922 1 10 . 1 1 470 470 LEU CB C 470 41.331 41.331 42.829 -1.498 25932 1923 1 10 . 1 1 470 470 LEU H H 470 7.940 7.940 7.758 0.181 25932 1924 1 10 . 1 1 471 471 ARG N N 471 120.624 120.624 124.530 -3.906 25932 1925 1 10 . 1 1 471 471 ARG CA C 471 55.308 55.308 56.500 -1.192 25932 1926 1 10 . 1 1 471 471 ARG CB C 471 30.010 30.010 30.773 -0.763 25932 1927 1 10 . 1 1 471 471 ARG H H 471 7.922 7.922 8.422 -0.500 25932 1928 1 10 . 1 1 472 472 ARG C C 472 175.258 175.258 175.727 -0.469 25932 1929 1 10 . 1 1 472 472 ARG CA C 472 55.704 55.704 55.270 0.434 25932 1930 1 10 . 1 1 472 472 ARG CB C 472 29.851 29.851 32.211 -2.360 25932 1931 1 11 . 1 1 433 433 SER C C 433 174.143 174.143 173.755 0.388 25932 1932 1 11 . 1 1 433 433 SER CA C 433 57.715 57.715 57.407 0.308 25932 1933 1 11 . 1 1 433 433 SER CB C 433 63.602 63.602 64.669 -1.067 25932 1934 1 11 . 1 1 434 434 TRP N N 434 122.746 122.746 122.424 0.322 25932 1935 1 11 . 1 1 434 434 TRP C C 434 175.587 175.587 176.088 -0.501 25932 1936 1 11 . 1 1 434 434 TRP CA C 434 56.604 56.604 55.807 0.797 25932 1937 1 11 . 1 1 434 434 TRP CB C 434 29.269 29.269 30.246 -0.977 25932 1938 1 11 . 1 1 434 434 TRP H H 434 8.283 8.283 8.056 0.227 25932 1939 1 11 . 1 1 435 435 ASP N N 435 121.374 121.374 122.975 -1.601 25932 1940 1 11 . 1 1 435 435 ASP C C 435 176.543 176.543 177.193 -0.650 25932 1941 1 11 . 1 1 435 435 ASP CA C 435 53.562 53.562 53.311 0.251 25932 1942 1 11 . 1 1 435 435 ASP CB C 435 40.854 40.854 41.975 -1.121 25932 1943 1 11 . 1 1 435 435 ASP H H 435 8.219 8.219 8.638 -0.419 25932 1944 1 11 . 1 1 436 436 THR N N 436 116.111 116.111 117.498 -1.387 25932 1945 1 11 . 1 1 436 436 THR C C 436 175.651 175.651 176.266 -0.615 25932 1946 1 11 . 1 1 436 436 THR CA C 436 65.015 65.015 64.222 0.794 25932 1947 1 11 . 1 1 436 436 THR CB C 436 68.416 68.416 69.224 -0.808 25932 1948 1 11 . 1 1 436 436 THR H H 436 8.251 8.251 8.636 -0.386 25932 1949 1 11 . 1 1 437 437 GLU N N 437 121.374 121.374 121.825 -0.451 25932 1950 1 11 . 1 1 437 437 GLU C C 437 177.988 177.988 178.582 -0.594 25932 1951 1 11 . 1 1 437 437 GLU CA C 437 59.513 59.513 59.644 -0.131 25932 1952 1 11 . 1 1 437 437 GLU CB C 437 28.370 28.370 29.619 -1.249 25932 1953 1 11 . 1 1 437 437 GLU H H 437 8.897 8.897 9.496 -0.599 25932 1954 1 11 . 1 1 438 438 SER N N 438 115.658 115.658 115.414 0.244 25932 1955 1 11 . 1 1 438 438 SER C C 438 175.832 175.832 176.910 -1.078 25932 1956 1 11 . 1 1 438 438 SER CA C 438 60.889 60.889 61.827 -0.938 25932 1957 1 11 . 1 1 438 438 SER CB C 438 62.491 62.491 63.121 -0.630 25932 1958 1 11 . 1 1 438 438 SER H H 438 8.018 8.018 7.831 0.187 25932 1959 1 11 . 1 1 439 439 VAL N N 439 122.608 122.608 122.273 0.335 25932 1960 1 11 . 1 1 439 439 VAL C C 439 177.743 177.743 177.585 0.158 25932 1961 1 11 . 1 1 439 439 VAL CA C 439 65.861 65.861 66.318 -0.457 25932 1962 1 11 . 1 1 439 439 VAL CB C 439 30.698 30.698 31.907 -1.210 25932 1963 1 11 . 1 1 439 439 VAL H H 439 7.908 7.908 7.174 0.734 25932 1964 1 11 . 1 1 440 440 LEU N N 440 120.077 120.077 120.325 -0.248 25932 1965 1 11 . 1 1 440 440 LEU C C 440 178.466 178.466 178.009 0.457 25932 1966 1 11 . 1 1 440 440 LEU CA C 440 57.953 57.953 58.074 -0.121 25932 1967 1 11 . 1 1 440 440 LEU CB C 440 40.378 40.378 41.941 -1.562 25932 1968 1 11 . 1 1 440 440 LEU H H 440 8.171 8.171 8.208 -0.037 25932 1969 1 11 . 1 1 441 441 ALA N N 441 119.465 119.465 121.102 -1.637 25932 1970 1 11 . 1 1 441 441 ALA C C 441 178.986 178.986 179.525 -0.539 25932 1971 1 11 . 1 1 441 441 ALA CA C 441 55.122 55.122 54.779 0.343 25932 1972 1 11 . 1 1 441 441 ALA CB C 441 17.367 17.367 18.206 -0.839 25932 1973 1 11 . 1 1 441 441 ALA H H 441 8.090 8.090 7.791 0.299 25932 1974 1 11 . 1 1 442 442 MET N N 442 116.111 116.111 117.097 -0.986 25932 1975 1 11 . 1 1 442 442 MET C C 442 178.073 178.073 178.127 -0.054 25932 1976 1 11 . 1 1 442 442 MET CA C 442 58.217 58.217 57.725 0.492 25932 1977 1 11 . 1 1 442 442 MET CB C 442 31.597 31.597 31.696 -0.099 25932 1978 1 11 . 1 1 442 442 MET H H 442 7.875 7.875 7.457 0.418 25932 1979 1 11 . 1 1 443 443 TRP N N 443 119.802 119.802 118.782 1.020 25932 1980 1 11 . 1 1 443 443 TRP C C 443 178.445 178.445 177.934 0.511 25932 1981 1 11 . 1 1 443 443 TRP CA C 443 60.624 60.624 59.377 1.247 25932 1982 1 11 . 1 1 443 443 TRP CB C 443 28.899 28.899 28.045 0.854 25932 1983 1 11 . 1 1 443 443 TRP H H 443 8.196 8.196 7.493 0.703 25932 1984 1 11 . 1 1 444 444 VAL N N 444 118.509 118.509 121.817 -3.308 25932 1985 1 11 . 1 1 444 444 VAL C C 444 177.563 177.563 178.084 -0.521 25932 1986 1 11 . 1 1 444 444 VAL CA C 444 66.866 66.866 66.085 0.780 25932 1987 1 11 . 1 1 444 444 VAL CB C 444 30.221 30.221 30.598 -0.377 25932 1988 1 11 . 1 1 444 444 VAL H H 444 8.353 8.353 6.462 1.891 25932 1989 1 11 . 1 1 445 445 LEU N N 445 119.328 119.328 119.622 -0.294 25932 1990 1 11 . 1 1 445 445 LEU C C 445 178.168 178.168 178.777 -0.609 25932 1991 1 11 . 1 1 445 445 LEU CA C 445 57.979 57.979 58.105 -0.126 25932 1992 1 11 . 1 1 445 445 LEU CB C 445 40.431 40.431 41.093 -0.662 25932 1993 1 11 . 1 1 445 445 LEU H H 445 8.233 8.233 7.338 0.895 25932 1994 1 11 . 1 1 446 446 ALA N N 446 120.009 120.009 122.213 -2.204 25932 1995 1 11 . 1 1 446 446 ALA C C 446 179.071 179.071 179.779 -0.708 25932 1996 1 11 . 1 1 446 446 ALA CA C 446 55.096 55.096 55.172 -0.076 25932 1997 1 11 . 1 1 446 446 ALA CB C 446 16.996 16.996 18.200 -1.204 25932 1998 1 11 . 1 1 446 446 ALA H H 446 8.402 8.402 7.798 0.604 25932 1999 1 11 . 1 1 447 447 LEU N N 447 117.136 117.136 119.161 -2.025 25932 2000 1 11 . 1 1 447 447 LEU C C 447 178.678 178.678 179.137 -0.459 25932 2001 1 11 . 1 1 447 447 LEU CA C 447 57.767 57.767 57.834 -0.067 25932 2002 1 11 . 1 1 447 447 LEU CB C 447 40.378 40.378 41.950 -1.572 25932 2003 1 11 . 1 1 447 447 LEU H H 447 8.244 8.244 8.123 0.121 25932 2004 1 11 . 1 1 448 448 ILE N N 448 119.121 119.121 119.725 -0.604 25932 2005 1 11 . 1 1 448 448 ILE C C 448 177.574 177.574 178.129 -0.555 25932 2006 1 11 . 1 1 448 448 ILE CA C 448 65.702 65.702 65.900 -0.198 25932 2007 1 11 . 1 1 448 448 ILE CB C 448 36.464 36.464 37.866 -1.402 25932 2008 1 11 . 1 1 448 448 ILE H H 448 8.286 8.286 7.738 0.548 25932 2009 1 11 . 1 1 449 449 VAL N N 449 119.052 119.052 120.044 -0.992 25932 2010 1 11 . 1 1 449 449 VAL C C 449 179.135 179.135 177.813 1.322 25932 2011 1 11 . 1 1 449 449 VAL CA C 449 67.051 67.051 67.085 -0.034 25932 2012 1 11 . 1 1 449 449 VAL CB C 449 30.175 30.175 31.753 -1.578 25932 2013 1 11 . 1 1 449 449 VAL H H 449 8.327 8.327 7.699 0.628 25932 2014 1 11 . 1 1 450 450 ILE N N 450 123.014 123.014 120.191 2.823 25932 2015 1 11 . 1 1 450 450 ILE C C 450 177.074 177.074 177.832 -0.758 25932 2016 1 11 . 1 1 450 450 ILE CA C 450 65.594 65.594 65.344 0.251 25932 2017 1 11 . 1 1 450 450 ILE CB C 450 36.594 36.594 37.628 -1.034 25932 2018 1 11 . 1 1 450 450 ILE H H 450 8.670 8.670 7.493 1.177 25932 2019 1 11 . 1 1 451 451 PHE N N 451 119.392 119.392 118.778 0.614 25932 2020 1 11 . 1 1 451 451 PHE C C 451 177.297 177.297 178.064 -0.767 25932 2021 1 11 . 1 1 451 451 PHE CA C 451 61.389 61.389 62.530 -1.141 25932 2022 1 11 . 1 1 451 451 PHE CB C 451 37.970 37.970 38.288 -0.318 25932 2023 1 11 . 1 1 451 451 PHE H H 451 8.651 8.651 7.721 0.930 25932 2024 1 11 . 1 1 452 452 LEU N N 452 118.367 118.367 119.477 -1.110 25932 2025 1 11 . 1 1 452 452 LEU C C 452 177.967 177.967 179.157 -1.190 25932 2026 1 11 . 1 1 452 452 LEU CA C 452 57.606 57.606 58.200 -0.594 25932 2027 1 11 . 1 1 452 452 LEU CB C 452 40.924 40.924 41.513 -0.589 25932 2028 1 11 . 1 1 452 452 LEU H H 452 8.731 8.731 7.906 0.825 25932 2029 1 11 . 1 1 453 453 THR N N 453 116.173 116.173 116.027 0.146 25932 2030 1 11 . 1 1 453 453 THR C C 453 176.220 176.220 176.745 -0.525 25932 2031 1 11 . 1 1 453 453 THR CA C 453 67.919 67.919 66.409 1.510 25932 2032 1 11 . 1 1 453 453 THR CB C 453 67.006 67.006 68.428 -1.422 25932 2033 1 11 . 1 1 453 453 THR H H 453 8.104 8.104 8.293 -0.189 25932 2034 1 11 . 1 1 454 454 ILE N N 454 120.077 120.077 121.256 -1.179 25932 2035 1 11 . 1 1 454 454 ILE C C 454 176.915 176.915 176.759 0.156 25932 2036 1 11 . 1 1 454 454 ILE CA C 454 65.041 65.041 64.146 0.895 25932 2037 1 11 . 1 1 454 454 ILE CB C 454 36.464 36.464 37.701 -1.237 25932 2038 1 11 . 1 1 454 454 ILE H H 454 8.043 8.043 8.234 -0.191 25932 2039 1 11 . 1 1 455 455 ALA N N 455 121.174 121.174 123.073 -1.899 25932 2040 1 11 . 1 1 455 455 ALA C C 455 178.806 178.806 179.555 -0.749 25932 2041 1 11 . 1 1 455 455 ALA CA C 455 55.346 55.346 55.563 -0.217 25932 2042 1 11 . 1 1 455 455 ALA CB C 455 16.890 16.890 18.035 -1.145 25932 2043 1 11 . 1 1 455 455 ALA H H 455 8.265 8.265 8.257 0.008 25932 2044 1 11 . 1 1 456 456 VAL N N 456 116.661 116.661 119.176 -2.515 25932 2045 1 11 . 1 1 456 456 VAL C C 456 177.489 177.489 177.926 -0.437 25932 2046 1 11 . 1 1 456 456 VAL CA C 456 66.494 66.494 66.299 0.195 25932 2047 1 11 . 1 1 456 456 VAL CB C 456 30.226 30.226 31.446 -1.220 25932 2048 1 11 . 1 1 456 456 VAL H H 456 8.211 8.211 7.769 0.442 25932 2049 1 11 . 1 1 457 457 LEU N N 457 119.465 119.465 119.818 -0.353 25932 2050 1 11 . 1 1 457 457 LEU C C 457 179.517 179.517 179.217 0.300 25932 2051 1 11 . 1 1 457 457 LEU CA C 457 58.056 58.056 58.143 -0.087 25932 2052 1 11 . 1 1 457 457 LEU CB C 457 40.414 40.414 41.520 -1.106 25932 2053 1 11 . 1 1 457 457 LEU H H 457 8.150 8.150 7.467 0.683 25932 2054 1 11 . 1 1 458 458 LEU N N 458 118.436 118.436 119.150 -0.714 25932 2055 1 11 . 1 1 458 458 LEU C C 458 178.891 178.891 179.059 -0.168 25932 2056 1 11 . 1 1 458 458 LEU CA C 458 57.395 57.395 57.932 -0.537 25932 2057 1 11 . 1 1 458 458 LEU CB C 458 40.484 40.484 41.489 -1.005 25932 2058 1 11 . 1 1 458 458 LEU H H 458 8.542 8.542 8.032 0.510 25932 2059 1 11 . 1 1 459 459 ALA N N 459 122.337 122.337 121.559 0.778 25932 2060 1 11 . 1 1 459 459 ALA C C 459 179.793 179.793 179.483 0.310 25932 2061 1 11 . 1 1 459 459 ALA CA C 459 55.122 55.122 55.173 -0.051 25932 2062 1 11 . 1 1 459 459 ALA CB C 459 17.208 17.208 18.614 -1.406 25932 2063 1 11 . 1 1 459 459 ALA H H 459 8.401 8.401 8.124 0.277 25932 2064 1 11 . 1 1 460 460 LEU N N 460 117.961 117.961 120.442 -2.481 25932 2065 1 11 . 1 1 460 460 LEU C C 460 179.262 179.262 178.658 0.604 25932 2066 1 11 . 1 1 460 460 LEU CA C 460 57.673 57.673 58.091 -0.418 25932 2067 1 11 . 1 1 460 460 LEU CB C 460 40.414 40.414 40.894 -0.480 25932 2068 1 11 . 1 1 460 460 LEU H H 460 8.518 8.518 8.749 -0.231 25932 2069 1 11 . 1 1 461 461 ARG N N 461 119.534 119.534 119.592 -0.058 25932 2070 1 11 . 1 1 461 461 ARG C C 461 178.625 178.625 178.284 0.341 25932 2071 1 11 . 1 1 461 461 ARG CA C 461 57.818 57.818 59.342 -1.524 25932 2072 1 11 . 1 1 461 461 ARG CB C 461 28.443 28.443 29.668 -1.225 25932 2073 1 11 . 1 1 461 461 ARG H H 461 8.029 8.029 7.824 0.205 25932 2074 1 11 . 1 1 462 462 PHE N N 462 118.777 118.777 120.757 -1.980 25932 2075 1 11 . 1 1 462 462 PHE C C 462 177.127 177.127 176.623 0.504 25932 2076 1 11 . 1 1 462 462 PHE CA C 462 60.624 60.624 61.089 -0.465 25932 2077 1 11 . 1 1 462 462 PHE CB C 462 38.633 38.633 38.935 -0.302 25932 2078 1 11 . 1 1 462 462 PHE H H 462 8.460 8.460 7.781 0.679 25932 2079 1 11 . 1 1 463 463 CYS N N 463 116.386 116.386 116.065 0.321 25932 2080 1 11 . 1 1 463 463 CYS C C 463 175.980 175.980 176.634 -0.654 25932 2081 1 11 . 1 1 463 463 CYS CA C 463 61.999 61.999 62.898 -0.899 25932 2082 1 11 . 1 1 463 463 CYS CB C 463 26.966 26.966 28.195 -1.228 25932 2083 1 11 . 1 1 463 463 CYS H H 463 8.278 8.278 8.320 -0.042 25932 2084 1 11 . 1 1 464 464 GLY N N 464 107.774 107.774 108.761 -0.987 25932 2085 1 11 . 1 1 464 464 GLY C C 464 174.990 174.990 175.301 -0.311 25932 2086 1 11 . 1 1 464 464 GLY CA C 464 45.944 45.944 46.516 -0.572 25932 2087 1 11 . 1 1 464 464 GLY H H 464 8.050 8.050 8.013 0.037 25932 2088 1 11 . 1 1 465 465 ILE N N 465 119.940 119.940 118.686 1.254 25932 2089 1 11 . 1 1 465 465 ILE C C 465 176.458 176.458 175.473 0.985 25932 2090 1 11 . 1 1 465 465 ILE CA C 465 62.423 62.423 61.376 1.047 25932 2091 1 11 . 1 1 465 465 ILE CB C 465 37.409 37.409 38.332 -0.923 25932 2092 1 11 . 1 1 465 465 ILE H H 465 7.745 7.745 7.711 0.034 25932 2093 1 11 . 1 1 466 466 TYR N N 466 118.846 118.846 120.130 -1.284 25932 2094 1 11 . 1 1 466 466 TYR C C 466 176.150 176.150 175.937 0.213 25932 2095 1 11 . 1 1 466 466 TYR CA C 466 58.429 58.429 57.602 0.827 25932 2096 1 11 . 1 1 466 466 TYR CB C 466 37.917 37.917 39.026 -1.109 25932 2097 1 11 . 1 1 466 466 TYR H H 466 7.807 7.807 7.020 0.787 25932 2098 1 11 . 1 1 467 467 GLY N N 467 107.987 107.987 106.991 0.996 25932 2099 1 11 . 1 1 467 467 GLY C C 467 174.143 174.143 173.897 0.246 25932 2100 1 11 . 1 1 467 467 GLY CA C 467 45.547 45.547 45.238 0.309 25932 2101 1 11 . 1 1 467 467 GLY H H 467 7.887 7.887 7.426 0.461 25932 2102 1 11 . 1 1 468 468 TYR N N 468 119.878 119.878 116.839 3.039 25932 2103 1 11 . 1 1 468 468 TYR C C 468 175.524 175.524 175.670 -0.146 25932 2104 1 11 . 1 1 468 468 TYR CA C 468 58.164 58.164 59.165 -1.001 25932 2105 1 11 . 1 1 468 468 TYR CB C 468 37.786 37.786 38.141 -0.355 25932 2106 1 11 . 1 1 468 468 TYR H H 468 7.867 7.867 7.931 -0.064 25932 2107 1 11 . 1 1 469 469 ARG N N 469 121.174 121.174 120.156 1.018 25932 2108 1 11 . 1 1 469 469 ARG C C 469 175.800 175.800 176.672 -0.872 25932 2109 1 11 . 1 1 469 469 ARG CA C 469 55.334 55.334 57.783 -2.449 25932 2110 1 11 . 1 1 469 469 ARG CB C 469 30.035 30.035 30.530 -0.495 25932 2111 1 11 . 1 1 469 469 ARG H H 469 7.873 7.873 8.519 -0.646 25932 2112 1 11 . 1 1 470 470 LEU N N 470 121.718 121.718 118.887 2.831 25932 2113 1 11 . 1 1 470 470 LEU C C 470 176.618 176.618 177.530 -0.912 25932 2114 1 11 . 1 1 470 470 LEU CA C 470 54.858 54.858 54.430 0.428 25932 2115 1 11 . 1 1 470 470 LEU CB C 470 41.331 41.331 42.430 -1.099 25932 2116 1 11 . 1 1 470 470 LEU H H 470 7.940 7.940 7.937 0.003 25932 2117 1 11 . 1 1 471 471 ARG N N 471 120.624 120.624 121.898 -1.274 25932 2118 1 11 . 1 1 471 471 ARG CA C 471 55.308 55.308 57.412 -2.104 25932 2119 1 11 . 1 1 471 471 ARG CB C 471 30.010 30.010 30.363 -0.353 25932 2120 1 11 . 1 1 471 471 ARG H H 471 7.922 7.922 8.514 -0.592 25932 2121 1 11 . 1 1 472 472 ARG C C 472 175.258 175.258 176.508 -1.250 25932 2122 1 11 . 1 1 472 472 ARG CA C 472 55.704 55.704 55.873 -0.169 25932 2123 1 11 . 1 1 472 472 ARG CB C 472 29.851 29.851 30.625 -0.774 25932 2124 1 12 . 1 1 433 433 SER C C 433 174.143 174.143 174.001 0.142 25932 2125 1 12 . 1 1 433 433 SER CA C 433 57.715 57.715 57.501 0.214 25932 2126 1 12 . 1 1 433 433 SER CB C 433 63.602 63.602 64.357 -0.755 25932 2127 1 12 . 1 1 434 434 TRP N N 434 122.746 122.746 120.887 1.859 25932 2128 1 12 . 1 1 434 434 TRP C C 434 175.587 175.587 177.099 -1.512 25932 2129 1 12 . 1 1 434 434 TRP CA C 434 56.604 56.604 58.211 -1.607 25932 2130 1 12 . 1 1 434 434 TRP CB C 434 29.269 29.269 29.716 -0.448 25932 2131 1 12 . 1 1 434 434 TRP H H 434 8.283 8.283 8.734 -0.451 25932 2132 1 12 . 1 1 435 435 ASP N N 435 121.374 121.374 119.898 1.476 25932 2133 1 12 . 1 1 435 435 ASP C C 435 176.543 176.543 178.184 -1.641 25932 2134 1 12 . 1 1 435 435 ASP CA C 435 53.562 53.562 57.511 -3.949 25932 2135 1 12 . 1 1 435 435 ASP CB C 435 40.854 40.854 40.413 0.441 25932 2136 1 12 . 1 1 435 435 ASP H H 435 8.219 8.219 8.306 -0.087 25932 2137 1 12 . 1 1 436 436 THR N N 436 116.111 116.111 112.282 3.829 25932 2138 1 12 . 1 1 436 436 THR C C 436 175.651 175.651 176.351 -0.700 25932 2139 1 12 . 1 1 436 436 THR CA C 436 65.015 65.015 66.189 -1.174 25932 2140 1 12 . 1 1 436 436 THR CB C 436 68.416 68.416 68.582 -0.166 25932 2141 1 12 . 1 1 436 436 THR H H 436 8.251 8.251 7.723 0.528 25932 2142 1 12 . 1 1 437 437 GLU N N 437 121.374 121.374 120.906 0.468 25932 2143 1 12 . 1 1 437 437 GLU C C 437 177.988 177.988 178.379 -0.391 25932 2144 1 12 . 1 1 437 437 GLU CA C 437 59.513 59.513 59.715 -0.202 25932 2145 1 12 . 1 1 437 437 GLU CB C 437 28.370 28.370 29.473 -1.103 25932 2146 1 12 . 1 1 437 437 GLU H H 437 8.897 8.897 7.833 1.064 25932 2147 1 12 . 1 1 438 438 SER N N 438 115.658 115.658 115.372 0.286 25932 2148 1 12 . 1 1 438 438 SER C C 438 175.832 175.832 176.740 -0.908 25932 2149 1 12 . 1 1 438 438 SER CA C 438 60.889 60.889 61.520 -0.631 25932 2150 1 12 . 1 1 438 438 SER CB C 438 62.491 62.491 62.313 0.178 25932 2151 1 12 . 1 1 438 438 SER H H 438 8.018 8.018 7.813 0.205 25932 2152 1 12 . 1 1 439 439 VAL N N 439 122.608 122.608 123.298 -0.690 25932 2153 1 12 . 1 1 439 439 VAL C C 439 177.743 177.743 178.020 -0.277 25932 2154 1 12 . 1 1 439 439 VAL CA C 439 65.861 65.861 66.390 -0.529 25932 2155 1 12 . 1 1 439 439 VAL CB C 439 30.698 30.698 31.125 -0.427 25932 2156 1 12 . 1 1 439 439 VAL H H 439 7.908 7.908 7.236 0.672 25932 2157 1 12 . 1 1 440 440 LEU N N 440 120.077 120.077 121.332 -1.255 25932 2158 1 12 . 1 1 440 440 LEU C C 440 178.466 178.466 178.192 0.274 25932 2159 1 12 . 1 1 440 440 LEU CA C 440 57.953 57.953 58.191 -0.238 25932 2160 1 12 . 1 1 440 440 LEU CB C 440 40.378 40.378 41.411 -1.033 25932 2161 1 12 . 1 1 440 440 LEU H H 440 8.171 8.171 8.426 -0.255 25932 2162 1 12 . 1 1 441 441 ALA N N 441 119.465 119.465 121.396 -1.931 25932 2163 1 12 . 1 1 441 441 ALA C C 441 178.986 178.986 179.619 -0.633 25932 2164 1 12 . 1 1 441 441 ALA CA C 441 55.122 55.122 54.888 0.234 25932 2165 1 12 . 1 1 441 441 ALA CB C 441 17.367 17.367 18.283 -0.916 25932 2166 1 12 . 1 1 441 441 ALA H H 441 8.090 8.090 7.775 0.315 25932 2167 1 12 . 1 1 442 442 MET N N 442 116.111 116.111 117.295 -1.184 25932 2168 1 12 . 1 1 442 442 MET C C 442 178.073 178.073 178.225 -0.152 25932 2169 1 12 . 1 1 442 442 MET CA C 442 58.217 58.217 59.289 -1.072 25932 2170 1 12 . 1 1 442 442 MET CB C 442 31.597 31.597 32.662 -1.065 25932 2171 1 12 . 1 1 442 442 MET H H 442 7.875 7.875 7.940 -0.065 25932 2172 1 12 . 1 1 443 443 TRP N N 443 119.802 119.802 119.280 0.522 25932 2173 1 12 . 1 1 443 443 TRP C C 443 178.445 178.445 177.739 0.706 25932 2174 1 12 . 1 1 443 443 TRP CA C 443 60.624 60.624 59.550 1.074 25932 2175 1 12 . 1 1 443 443 TRP CB C 443 28.899 28.899 28.648 0.251 25932 2176 1 12 . 1 1 443 443 TRP H H 443 8.196 8.196 7.854 0.342 25932 2177 1 12 . 1 1 444 444 VAL N N 444 118.509 118.509 121.801 -3.292 25932 2178 1 12 . 1 1 444 444 VAL C C 444 177.563 177.563 178.013 -0.450 25932 2179 1 12 . 1 1 444 444 VAL CA C 444 66.866 66.866 65.929 0.937 25932 2180 1 12 . 1 1 444 444 VAL CB C 444 30.221 30.221 30.556 -0.335 25932 2181 1 12 . 1 1 444 444 VAL H H 444 8.353 8.353 6.715 1.638 25932 2182 1 12 . 1 1 445 445 LEU N N 445 119.328 119.328 119.683 -0.355 25932 2183 1 12 . 1 1 445 445 LEU C C 445 178.168 178.168 178.796 -0.628 25932 2184 1 12 . 1 1 445 445 LEU CA C 445 57.979 57.979 58.141 -0.162 25932 2185 1 12 . 1 1 445 445 LEU CB C 445 40.431 40.431 41.092 -0.661 25932 2186 1 12 . 1 1 445 445 LEU H H 445 8.233 8.233 7.535 0.698 25932 2187 1 12 . 1 1 446 446 ALA N N 446 120.009 120.009 122.535 -2.526 25932 2188 1 12 . 1 1 446 446 ALA C C 446 179.071 179.071 179.840 -0.769 25932 2189 1 12 . 1 1 446 446 ALA CA C 446 55.096 55.096 55.256 -0.160 25932 2190 1 12 . 1 1 446 446 ALA CB C 446 16.996 16.996 18.263 -1.267 25932 2191 1 12 . 1 1 446 446 ALA H H 446 8.402 8.402 7.894 0.508 25932 2192 1 12 . 1 1 447 447 LEU N N 447 117.136 117.136 119.404 -2.268 25932 2193 1 12 . 1 1 447 447 LEU C C 447 178.678 178.678 179.283 -0.605 25932 2194 1 12 . 1 1 447 447 LEU CA C 447 57.767 57.767 58.259 -0.492 25932 2195 1 12 . 1 1 447 447 LEU CB C 447 40.378 40.378 41.470 -1.092 25932 2196 1 12 . 1 1 447 447 LEU H H 447 8.244 8.244 8.220 0.024 25932 2197 1 12 . 1 1 448 448 ILE N N 448 119.121 119.121 119.847 -0.726 25932 2198 1 12 . 1 1 448 448 ILE C C 448 177.574 177.574 178.355 -0.781 25932 2199 1 12 . 1 1 448 448 ILE CA C 448 65.702 65.702 65.828 -0.126 25932 2200 1 12 . 1 1 448 448 ILE CB C 448 36.464 36.464 37.827 -1.363 25932 2201 1 12 . 1 1 448 448 ILE H H 448 8.286 8.286 7.966 0.320 25932 2202 1 12 . 1 1 449 449 VAL N N 449 119.052 119.052 120.211 -1.159 25932 2203 1 12 . 1 1 449 449 VAL C C 449 179.135 179.135 178.390 0.745 25932 2204 1 12 . 1 1 449 449 VAL CA C 449 67.051 67.051 66.872 0.179 25932 2205 1 12 . 1 1 449 449 VAL CB C 449 30.175 30.175 31.138 -0.963 25932 2206 1 12 . 1 1 449 449 VAL H H 449 8.327 8.327 7.841 0.486 25932 2207 1 12 . 1 1 450 450 ILE N N 450 123.014 123.014 120.688 2.326 25932 2208 1 12 . 1 1 450 450 ILE C C 450 177.074 177.074 178.318 -1.244 25932 2209 1 12 . 1 1 450 450 ILE CA C 450 65.594 65.594 64.144 1.450 25932 2210 1 12 . 1 1 450 450 ILE CB C 450 36.594 36.594 36.476 0.118 25932 2211 1 12 . 1 1 450 450 ILE H H 450 8.670 8.670 7.946 0.724 25932 2212 1 12 . 1 1 451 451 PHE N N 451 119.392 119.392 119.268 0.124 25932 2213 1 12 . 1 1 451 451 PHE C C 451 177.297 177.297 178.297 -1.000 25932 2214 1 12 . 1 1 451 451 PHE CA C 451 61.389 61.389 62.726 -1.337 25932 2215 1 12 . 1 1 451 451 PHE CB C 451 37.970 37.970 38.044 -0.074 25932 2216 1 12 . 1 1 451 451 PHE H H 451 8.651 8.651 7.875 0.776 25932 2217 1 12 . 1 1 452 452 LEU N N 452 118.367 118.367 119.526 -1.159 25932 2218 1 12 . 1 1 452 452 LEU C C 452 177.967 177.967 179.028 -1.061 25932 2219 1 12 . 1 1 452 452 LEU CA C 452 57.606 57.606 58.265 -0.659 25932 2220 1 12 . 1 1 452 452 LEU CB C 452 40.924 40.924 41.467 -0.543 25932 2221 1 12 . 1 1 452 452 LEU H H 452 8.731 8.731 8.179 0.552 25932 2222 1 12 . 1 1 453 453 THR N N 453 116.173 116.173 116.562 -0.389 25932 2223 1 12 . 1 1 453 453 THR C C 453 176.220 176.220 176.828 -0.608 25932 2224 1 12 . 1 1 453 453 THR CA C 453 67.919 67.919 67.248 0.672 25932 2225 1 12 . 1 1 453 453 THR CB C 453 67.006 67.006 68.797 -1.791 25932 2226 1 12 . 1 1 453 453 THR H H 453 8.104 8.104 8.254 -0.150 25932 2227 1 12 . 1 1 454 454 ILE N N 454 120.077 120.077 120.985 -0.908 25932 2228 1 12 . 1 1 454 454 ILE C C 454 176.915 176.915 177.796 -0.881 25932 2229 1 12 . 1 1 454 454 ILE CA C 454 65.041 65.041 63.309 1.732 25932 2230 1 12 . 1 1 454 454 ILE CB C 454 36.464 36.464 36.775 -0.311 25932 2231 1 12 . 1 1 454 454 ILE H H 454 8.043 8.043 8.432 -0.389 25932 2232 1 12 . 1 1 455 455 ALA N N 455 121.174 121.174 122.987 -1.813 25932 2233 1 12 . 1 1 455 455 ALA C C 455 178.806 178.806 179.935 -1.129 25932 2234 1 12 . 1 1 455 455 ALA CA C 455 55.346 55.346 55.595 -0.249 25932 2235 1 12 . 1 1 455 455 ALA CB C 455 16.890 16.890 18.133 -1.243 25932 2236 1 12 . 1 1 455 455 ALA H H 455 8.265 8.265 8.583 -0.318 25932 2237 1 12 . 1 1 456 456 VAL N N 456 116.661 116.661 119.227 -2.566 25932 2238 1 12 . 1 1 456 456 VAL C C 456 177.489 177.489 178.112 -0.623 25932 2239 1 12 . 1 1 456 456 VAL CA C 456 66.494 66.494 66.351 0.143 25932 2240 1 12 . 1 1 456 456 VAL CB C 456 30.226 30.226 31.439 -1.213 25932 2241 1 12 . 1 1 456 456 VAL H H 456 8.211 8.211 7.838 0.373 25932 2242 1 12 . 1 1 457 457 LEU N N 457 119.465 119.465 120.203 -0.738 25932 2243 1 12 . 1 1 457 457 LEU C C 457 179.517 179.517 179.110 0.407 25932 2244 1 12 . 1 1 457 457 LEU CA C 457 58.056 58.056 58.690 -0.634 25932 2245 1 12 . 1 1 457 457 LEU CB C 457 40.414 40.414 41.543 -1.129 25932 2246 1 12 . 1 1 457 457 LEU H H 457 8.150 8.150 7.530 0.620 25932 2247 1 12 . 1 1 458 458 LEU N N 458 118.436 118.436 119.343 -0.907 25932 2248 1 12 . 1 1 458 458 LEU C C 458 178.891 178.891 179.055 -0.164 25932 2249 1 12 . 1 1 458 458 LEU CA C 458 57.395 57.395 58.230 -0.834 25932 2250 1 12 . 1 1 458 458 LEU CB C 458 40.484 40.484 41.340 -0.856 25932 2251 1 12 . 1 1 458 458 LEU H H 458 8.542 8.542 8.036 0.506 25932 2252 1 12 . 1 1 459 459 ALA N N 459 122.337 122.337 121.789 0.548 25932 2253 1 12 . 1 1 459 459 ALA C C 459 179.793 179.793 179.478 0.315 25932 2254 1 12 . 1 1 459 459 ALA CA C 459 55.122 55.122 55.089 0.033 25932 2255 1 12 . 1 1 459 459 ALA CB C 459 17.208 17.208 18.627 -1.419 25932 2256 1 12 . 1 1 459 459 ALA H H 459 8.401 8.401 8.150 0.251 25932 2257 1 12 . 1 1 460 460 LEU N N 460 117.961 117.961 120.603 -2.642 25932 2258 1 12 . 1 1 460 460 LEU C C 460 179.262 179.262 178.554 0.708 25932 2259 1 12 . 1 1 460 460 LEU CA C 460 57.673 57.673 58.167 -0.494 25932 2260 1 12 . 1 1 460 460 LEU CB C 460 40.414 40.414 41.378 -0.964 25932 2261 1 12 . 1 1 460 460 LEU H H 460 8.518 8.518 8.568 -0.050 25932 2262 1 12 . 1 1 461 461 ARG N N 461 119.534 119.534 119.523 0.011 25932 2263 1 12 . 1 1 461 461 ARG C C 461 178.625 178.625 178.447 0.178 25932 2264 1 12 . 1 1 461 461 ARG CA C 461 57.818 57.818 59.086 -1.268 25932 2265 1 12 . 1 1 461 461 ARG CB C 461 28.443 28.443 29.843 -1.400 25932 2266 1 12 . 1 1 461 461 ARG H H 461 8.029 8.029 8.005 0.024 25932 2267 1 12 . 1 1 462 462 PHE N N 462 118.777 118.777 121.198 -2.421 25932 2268 1 12 . 1 1 462 462 PHE C C 462 177.127 177.127 177.604 -0.477 25932 2269 1 12 . 1 1 462 462 PHE CA C 462 60.624 60.624 61.282 -0.658 25932 2270 1 12 . 1 1 462 462 PHE CB C 462 38.633 38.633 39.138 -0.505 25932 2271 1 12 . 1 1 462 462 PHE H H 462 8.460 8.460 8.098 0.362 25932 2272 1 12 . 1 1 463 463 CYS N N 463 116.386 116.386 117.366 -0.980 25932 2273 1 12 . 1 1 463 463 CYS C C 463 175.980 175.980 177.043 -1.063 25932 2274 1 12 . 1 1 463 463 CYS CA C 463 61.999 61.999 63.251 -1.252 25932 2275 1 12 . 1 1 463 463 CYS CB C 463 26.966 26.966 28.858 -1.892 25932 2276 1 12 . 1 1 463 463 CYS H H 463 8.278 8.278 8.709 -0.431 25932 2277 1 12 . 1 1 464 464 GLY N N 464 107.774 107.774 109.344 -1.570 25932 2278 1 12 . 1 1 464 464 GLY C C 464 174.990 174.990 176.056 -1.066 25932 2279 1 12 . 1 1 464 464 GLY CA C 464 45.944 45.944 46.948 -1.004 25932 2280 1 12 . 1 1 464 464 GLY H H 464 8.050 8.050 8.312 -0.262 25932 2281 1 12 . 1 1 465 465 ILE N N 465 119.940 119.940 120.606 -0.666 25932 2282 1 12 . 1 1 465 465 ILE C C 465 176.458 176.458 175.324 1.134 25932 2283 1 12 . 1 1 465 465 ILE CA C 465 62.423 62.423 62.600 -0.177 25932 2284 1 12 . 1 1 465 465 ILE CB C 465 37.409 37.409 37.963 -0.554 25932 2285 1 12 . 1 1 465 465 ILE H H 465 7.745 7.745 8.035 -0.290 25932 2286 1 12 . 1 1 466 466 TYR N N 466 118.846 118.846 118.349 0.497 25932 2287 1 12 . 1 1 466 466 TYR C C 466 176.150 176.150 175.558 0.592 25932 2288 1 12 . 1 1 466 466 TYR CA C 466 58.429 58.429 57.269 1.160 25932 2289 1 12 . 1 1 466 466 TYR CB C 466 37.917 37.917 38.846 -0.929 25932 2290 1 12 . 1 1 466 466 TYR H H 466 7.807 7.807 7.383 0.424 25932 2291 1 12 . 1 1 467 467 GLY N N 467 107.987 107.987 106.729 1.258 25932 2292 1 12 . 1 1 467 467 GLY C C 467 174.143 174.143 174.016 0.127 25932 2293 1 12 . 1 1 467 467 GLY CA C 467 45.547 45.547 45.272 0.276 25932 2294 1 12 . 1 1 467 467 GLY H H 467 7.887 7.887 7.720 0.167 25932 2295 1 12 . 1 1 468 468 TYR N N 468 119.878 119.878 120.264 -0.386 25932 2296 1 12 . 1 1 468 468 TYR C C 468 175.524 175.524 174.244 1.280 25932 2297 1 12 . 1 1 468 468 TYR CA C 468 58.164 58.164 56.978 1.186 25932 2298 1 12 . 1 1 468 468 TYR CB C 468 37.786 37.786 40.594 -2.808 25932 2299 1 12 . 1 1 468 468 TYR H H 468 7.867 7.867 8.074 -0.207 25932 2300 1 12 . 1 1 469 469 ARG N N 469 121.174 121.174 123.218 -2.044 25932 2301 1 12 . 1 1 469 469 ARG C C 469 175.800 175.800 174.720 1.080 25932 2302 1 12 . 1 1 469 469 ARG CA C 469 55.334 55.334 55.241 0.093 25932 2303 1 12 . 1 1 469 469 ARG CB C 469 30.035 30.035 32.651 -2.616 25932 2304 1 12 . 1 1 469 469 ARG H H 469 7.873 7.873 8.622 -0.749 25932 2305 1 12 . 1 1 470 470 LEU N N 470 121.718 121.718 125.398 -3.680 25932 2306 1 12 . 1 1 470 470 LEU C C 470 176.618 176.618 176.729 -0.111 25932 2307 1 12 . 1 1 470 470 LEU CA C 470 54.858 54.858 54.115 0.743 25932 2308 1 12 . 1 1 470 470 LEU CB C 470 41.331 41.331 43.158 -1.827 25932 2309 1 12 . 1 1 470 470 LEU H H 470 7.940 7.940 8.583 -0.643 25932 2310 1 12 . 1 1 471 471 ARG N N 471 120.624 120.624 121.972 -1.348 25932 2311 1 12 . 1 1 471 471 ARG CA C 471 55.308 55.308 55.175 0.133 25932 2312 1 12 . 1 1 471 471 ARG CB C 471 30.010 30.010 32.244 -2.234 25932 2313 1 12 . 1 1 471 471 ARG H H 471 7.922 7.922 8.471 -0.549 25932 2314 1 12 . 1 1 472 472 ARG C C 472 175.258 175.258 176.239 -0.981 25932 2315 1 12 . 1 1 472 472 ARG CA C 472 55.704 55.704 56.296 -0.592 25932 2316 1 12 . 1 1 472 472 ARG CB C 472 29.851 29.851 30.961 -1.110 25932 2317 1 13 . 1 1 433 433 SER C C 433 174.143 174.143 172.935 1.208 25932 2318 1 13 . 1 1 433 433 SER CA C 433 57.715 57.715 58.152 -0.437 25932 2319 1 13 . 1 1 433 433 SER CB C 433 63.602 63.602 64.072 -0.470 25932 2320 1 13 . 1 1 434 434 TRP N N 434 122.746 122.746 121.022 1.724 25932 2321 1 13 . 1 1 434 434 TRP C C 434 175.587 175.587 176.003 -0.416 25932 2322 1 13 . 1 1 434 434 TRP CA C 434 56.604 56.604 57.027 -0.423 25932 2323 1 13 . 1 1 434 434 TRP CB C 434 29.269 29.269 30.942 -1.673 25932 2324 1 13 . 1 1 434 434 TRP H H 434 8.283 8.283 8.237 0.046 25932 2325 1 13 . 1 1 435 435 ASP N N 435 121.374 121.374 124.533 -3.159 25932 2326 1 13 . 1 1 435 435 ASP C C 435 176.543 176.543 177.232 -0.689 25932 2327 1 13 . 1 1 435 435 ASP CA C 435 53.562 53.562 53.533 0.029 25932 2328 1 13 . 1 1 435 435 ASP CB C 435 40.854 40.854 42.059 -1.205 25932 2329 1 13 . 1 1 435 435 ASP H H 435 8.219 8.219 8.740 -0.521 25932 2330 1 13 . 1 1 436 436 THR N N 436 116.111 116.111 117.105 -0.994 25932 2331 1 13 . 1 1 436 436 THR C C 436 175.651 175.651 176.323 -0.672 25932 2332 1 13 . 1 1 436 436 THR CA C 436 65.015 65.015 64.697 0.318 25932 2333 1 13 . 1 1 436 436 THR CB C 436 68.416 68.416 69.056 -0.640 25932 2334 1 13 . 1 1 436 436 THR H H 436 8.251 8.251 8.671 -0.420 25932 2335 1 13 . 1 1 437 437 GLU N N 437 121.374 121.374 121.183 0.191 25932 2336 1 13 . 1 1 437 437 GLU C C 437 177.988 177.988 178.879 -0.891 25932 2337 1 13 . 1 1 437 437 GLU CA C 437 59.513 59.513 59.629 -0.116 25932 2338 1 13 . 1 1 437 437 GLU CB C 437 28.370 28.370 28.624 -0.254 25932 2339 1 13 . 1 1 437 437 GLU H H 437 8.897 8.897 8.866 0.031 25932 2340 1 13 . 1 1 438 438 SER N N 438 115.658 115.658 115.475 0.183 25932 2341 1 13 . 1 1 438 438 SER C C 438 175.832 175.832 176.818 -0.986 25932 2342 1 13 . 1 1 438 438 SER CA C 438 60.889 60.889 61.458 -0.569 25932 2343 1 13 . 1 1 438 438 SER CB C 438 62.491 62.491 62.796 -0.305 25932 2344 1 13 . 1 1 438 438 SER H H 438 8.018 8.018 7.631 0.387 25932 2345 1 13 . 1 1 439 439 VAL N N 439 122.608 122.608 122.521 0.087 25932 2346 1 13 . 1 1 439 439 VAL C C 439 177.743 177.743 178.097 -0.354 25932 2347 1 13 . 1 1 439 439 VAL CA C 439 65.861 65.861 65.756 0.105 25932 2348 1 13 . 1 1 439 439 VAL CB C 439 30.698 30.698 31.349 -0.651 25932 2349 1 13 . 1 1 439 439 VAL H H 439 7.908 7.908 7.424 0.484 25932 2350 1 13 . 1 1 440 440 LEU N N 440 120.077 120.077 120.751 -0.674 25932 2351 1 13 . 1 1 440 440 LEU C C 440 178.466 178.466 178.078 0.388 25932 2352 1 13 . 1 1 440 440 LEU CA C 440 57.953 57.953 58.184 -0.231 25932 2353 1 13 . 1 1 440 440 LEU CB C 440 40.378 40.378 41.755 -1.377 25932 2354 1 13 . 1 1 440 440 LEU H H 440 8.171 8.171 8.319 -0.148 25932 2355 1 13 . 1 1 441 441 ALA N N 441 119.465 119.465 120.975 -1.510 25932 2356 1 13 . 1 1 441 441 ALA C C 441 178.986 178.986 179.410 -0.424 25932 2357 1 13 . 1 1 441 441 ALA CA C 441 55.122 55.122 54.683 0.439 25932 2358 1 13 . 1 1 441 441 ALA CB C 441 17.367 17.367 18.126 -0.759 25932 2359 1 13 . 1 1 441 441 ALA H H 441 8.090 8.090 7.821 0.269 25932 2360 1 13 . 1 1 442 442 MET N N 442 116.111 116.111 116.740 -0.629 25932 2361 1 13 . 1 1 442 442 MET C C 442 178.073 178.073 177.716 0.357 25932 2362 1 13 . 1 1 442 442 MET CA C 442 58.217 58.217 59.178 -0.961 25932 2363 1 13 . 1 1 442 442 MET CB C 442 31.597 31.597 32.447 -0.850 25932 2364 1 13 . 1 1 442 442 MET H H 442 7.875 7.875 7.486 0.389 25932 2365 1 13 . 1 1 443 443 TRP N N 443 119.802 119.802 118.295 1.507 25932 2366 1 13 . 1 1 443 443 TRP C C 443 178.445 178.445 177.743 0.702 25932 2367 1 13 . 1 1 443 443 TRP CA C 443 60.624 60.624 59.098 1.526 25932 2368 1 13 . 1 1 443 443 TRP CB C 443 28.899 28.899 28.212 0.687 25932 2369 1 13 . 1 1 443 443 TRP H H 443 8.196 8.196 7.335 0.861 25932 2370 1 13 . 1 1 444 444 VAL N N 444 118.509 118.509 121.802 -3.293 25932 2371 1 13 . 1 1 444 444 VAL C C 444 177.563 177.563 178.014 -0.451 25932 2372 1 13 . 1 1 444 444 VAL CA C 444 66.866 66.866 66.078 0.788 25932 2373 1 13 . 1 1 444 444 VAL CB C 444 30.221 30.221 30.430 -0.208 25932 2374 1 13 . 1 1 444 444 VAL H H 444 8.353 8.353 6.405 1.948 25932 2375 1 13 . 1 1 445 445 LEU N N 445 119.328 119.328 120.802 -1.474 25932 2376 1 13 . 1 1 445 445 LEU C C 445 178.168 178.168 178.302 -0.134 25932 2377 1 13 . 1 1 445 445 LEU CA C 445 57.979 57.979 57.835 0.144 25932 2378 1 13 . 1 1 445 445 LEU CB C 445 40.431 40.431 41.172 -0.741 25932 2379 1 13 . 1 1 445 445 LEU H H 445 8.233 8.233 7.371 0.862 25932 2380 1 13 . 1 1 446 446 ALA N N 446 120.009 120.009 121.940 -1.931 25932 2381 1 13 . 1 1 446 446 ALA C C 446 179.071 179.071 179.789 -0.718 25932 2382 1 13 . 1 1 446 446 ALA CA C 446 55.096 55.096 55.181 -0.085 25932 2383 1 13 . 1 1 446 446 ALA CB C 446 16.996 16.996 18.203 -1.208 25932 2384 1 13 . 1 1 446 446 ALA H H 446 8.402 8.402 7.829 0.573 25932 2385 1 13 . 1 1 447 447 LEU N N 447 117.136 117.136 119.364 -2.228 25932 2386 1 13 . 1 1 447 447 LEU C C 447 178.678 178.678 179.164 -0.486 25932 2387 1 13 . 1 1 447 447 LEU CA C 447 57.767 57.767 57.925 -0.158 25932 2388 1 13 . 1 1 447 447 LEU CB C 447 40.378 40.378 41.911 -1.533 25932 2389 1 13 . 1 1 447 447 LEU H H 447 8.244 8.244 8.179 0.065 25932 2390 1 13 . 1 1 448 448 ILE N N 448 119.121 119.121 119.820 -0.699 25932 2391 1 13 . 1 1 448 448 ILE C C 448 177.574 177.574 178.227 -0.653 25932 2392 1 13 . 1 1 448 448 ILE CA C 448 65.702 65.702 65.702 0.000 25932 2393 1 13 . 1 1 448 448 ILE CB C 448 36.464 36.464 37.734 -1.270 25932 2394 1 13 . 1 1 448 448 ILE H H 448 8.286 8.286 7.845 0.441 25932 2395 1 13 . 1 1 449 449 VAL N N 449 119.052 119.052 119.959 -0.907 25932 2396 1 13 . 1 1 449 449 VAL C C 449 179.135 179.135 178.281 0.854 25932 2397 1 13 . 1 1 449 449 VAL CA C 449 67.051 67.051 66.860 0.191 25932 2398 1 13 . 1 1 449 449 VAL CB C 449 30.175 30.175 31.166 -0.991 25932 2399 1 13 . 1 1 449 449 VAL H H 449 8.327 8.327 7.792 0.535 25932 2400 1 13 . 1 1 450 450 ILE N N 450 123.014 123.014 120.719 2.295 25932 2401 1 13 . 1 1 450 450 ILE C C 450 177.074 177.074 177.952 -0.878 25932 2402 1 13 . 1 1 450 450 ILE CA C 450 65.594 65.594 65.505 0.089 25932 2403 1 13 . 1 1 450 450 ILE CB C 450 36.594 36.594 37.626 -1.032 25932 2404 1 13 . 1 1 450 450 ILE H H 450 8.670 8.670 7.906 0.764 25932 2405 1 13 . 1 1 451 451 PHE N N 451 119.392 119.392 118.780 0.612 25932 2406 1 13 . 1 1 451 451 PHE C C 451 177.297 177.297 177.976 -0.679 25932 2407 1 13 . 1 1 451 451 PHE CA C 451 61.389 61.389 62.534 -1.145 25932 2408 1 13 . 1 1 451 451 PHE CB C 451 37.970 37.970 38.312 -0.342 25932 2409 1 13 . 1 1 451 451 PHE H H 451 8.651 8.651 8.034 0.617 25932 2410 1 13 . 1 1 452 452 LEU N N 452 118.367 118.367 119.376 -1.009 25932 2411 1 13 . 1 1 452 452 LEU C C 452 177.967 177.967 179.049 -1.082 25932 2412 1 13 . 1 1 452 452 LEU CA C 452 57.606 57.606 58.179 -0.573 25932 2413 1 13 . 1 1 452 452 LEU CB C 452 40.924 40.924 41.458 -0.534 25932 2414 1 13 . 1 1 452 452 LEU H H 452 8.731 8.731 8.017 0.714 25932 2415 1 13 . 1 1 453 453 THR N N 453 116.173 116.173 116.255 -0.082 25932 2416 1 13 . 1 1 453 453 THR C C 453 176.220 176.220 176.680 -0.460 25932 2417 1 13 . 1 1 453 453 THR CA C 453 67.919 67.919 67.044 0.875 25932 2418 1 13 . 1 1 453 453 THR CB C 453 67.006 67.006 68.532 -1.526 25932 2419 1 13 . 1 1 453 453 THR H H 453 8.104 8.104 8.153 -0.049 25932 2420 1 13 . 1 1 454 454 ILE N N 454 120.077 120.077 118.433 1.644 25932 2421 1 13 . 1 1 454 454 ILE C C 454 176.915 176.915 177.278 -0.363 25932 2422 1 13 . 1 1 454 454 ILE CA C 454 65.041 65.041 64.781 0.260 25932 2423 1 13 . 1 1 454 454 ILE CB C 454 36.464 36.464 37.206 -0.742 25932 2424 1 13 . 1 1 454 454 ILE H H 454 8.043 8.043 7.906 0.137 25932 2425 1 13 . 1 1 455 455 ALA N N 455 121.174 121.174 123.593 -2.419 25932 2426 1 13 . 1 1 455 455 ALA C C 455 178.806 178.806 179.617 -0.811 25932 2427 1 13 . 1 1 455 455 ALA CA C 455 55.346 55.346 55.386 -0.040 25932 2428 1 13 . 1 1 455 455 ALA CB C 455 16.890 16.890 18.091 -1.201 25932 2429 1 13 . 1 1 455 455 ALA H H 455 8.265 8.265 8.251 0.014 25932 2430 1 13 . 1 1 456 456 VAL N N 456 116.661 116.661 118.877 -2.216 25932 2431 1 13 . 1 1 456 456 VAL C C 456 177.489 177.489 178.281 -0.792 25932 2432 1 13 . 1 1 456 456 VAL CA C 456 66.494 66.494 66.862 -0.368 25932 2433 1 13 . 1 1 456 456 VAL CB C 456 30.226 30.226 31.845 -1.619 25932 2434 1 13 . 1 1 456 456 VAL H H 456 8.211 8.211 7.768 0.443 25932 2435 1 13 . 1 1 457 457 LEU N N 457 119.465 119.465 120.050 -0.585 25932 2436 1 13 . 1 1 457 457 LEU C C 457 179.517 179.517 179.136 0.381 25932 2437 1 13 . 1 1 457 457 LEU CA C 457 58.056 58.056 58.034 0.022 25932 2438 1 13 . 1 1 457 457 LEU CB C 457 40.414 40.414 41.558 -1.144 25932 2439 1 13 . 1 1 457 457 LEU H H 457 8.150 8.150 7.457 0.693 25932 2440 1 13 . 1 1 458 458 LEU N N 458 118.436 118.436 119.202 -0.766 25932 2441 1 13 . 1 1 458 458 LEU C C 458 178.891 178.891 179.072 -0.181 25932 2442 1 13 . 1 1 458 458 LEU CA C 458 57.395 57.395 57.993 -0.598 25932 2443 1 13 . 1 1 458 458 LEU CB C 458 40.484 40.484 41.470 -0.986 25932 2444 1 13 . 1 1 458 458 LEU H H 458 8.542 8.542 8.143 0.399 25932 2445 1 13 . 1 1 459 459 ALA N N 459 122.337 122.337 121.658 0.679 25932 2446 1 13 . 1 1 459 459 ALA C C 459 179.793 179.793 179.420 0.373 25932 2447 1 13 . 1 1 459 459 ALA CA C 459 55.122 55.122 55.036 0.086 25932 2448 1 13 . 1 1 459 459 ALA CB C 459 17.208 17.208 18.619 -1.411 25932 2449 1 13 . 1 1 459 459 ALA H H 459 8.401 8.401 8.159 0.242 25932 2450 1 13 . 1 1 460 460 LEU N N 460 117.961 117.961 120.734 -2.773 25932 2451 1 13 . 1 1 460 460 LEU C C 460 179.262 179.262 178.471 0.791 25932 2452 1 13 . 1 1 460 460 LEU CA C 460 57.673 57.673 57.845 -0.172 25932 2453 1 13 . 1 1 460 460 LEU CB C 460 40.414 40.414 41.416 -1.002 25932 2454 1 13 . 1 1 460 460 LEU H H 460 8.518 8.518 8.512 0.006 25932 2455 1 13 . 1 1 461 461 ARG N N 461 119.534 119.534 119.599 -0.065 25932 2456 1 13 . 1 1 461 461 ARG C C 461 178.625 178.625 178.463 0.162 25932 2457 1 13 . 1 1 461 461 ARG CA C 461 57.818 57.818 59.122 -1.304 25932 2458 1 13 . 1 1 461 461 ARG CB C 461 28.443 28.443 29.806 -1.363 25932 2459 1 13 . 1 1 461 461 ARG H H 461 8.029 8.029 7.921 0.108 25932 2460 1 13 . 1 1 462 462 PHE N N 462 118.777 118.777 120.930 -2.153 25932 2461 1 13 . 1 1 462 462 PHE C C 462 177.127 177.127 176.670 0.457 25932 2462 1 13 . 1 1 462 462 PHE CA C 462 60.624 60.624 61.102 -0.478 25932 2463 1 13 . 1 1 462 462 PHE CB C 462 38.633 38.633 38.975 -0.342 25932 2464 1 13 . 1 1 462 462 PHE H H 462 8.460 8.460 7.890 0.570 25932 2465 1 13 . 1 1 463 463 CYS N N 463 116.386 116.386 116.050 0.336 25932 2466 1 13 . 1 1 463 463 CYS C C 463 175.980 175.980 177.156 -1.176 25932 2467 1 13 . 1 1 463 463 CYS CA C 463 61.999 61.999 62.152 -0.153 25932 2468 1 13 . 1 1 463 463 CYS CB C 463 26.966 26.966 28.313 -1.347 25932 2469 1 13 . 1 1 463 463 CYS H H 463 8.278 8.278 8.470 -0.192 25932 2470 1 13 . 1 1 464 464 GLY N N 464 107.774 107.774 109.009 -1.235 25932 2471 1 13 . 1 1 464 464 GLY C C 464 174.990 174.990 175.557 -0.567 25932 2472 1 13 . 1 1 464 464 GLY CA C 464 45.944 45.944 46.877 -0.933 25932 2473 1 13 . 1 1 464 464 GLY H H 464 8.050 8.050 8.216 -0.166 25932 2474 1 13 . 1 1 465 465 ILE N N 465 119.940 119.940 118.675 1.265 25932 2475 1 13 . 1 1 465 465 ILE C C 465 176.458 176.458 175.659 0.799 25932 2476 1 13 . 1 1 465 465 ILE CA C 465 62.423 62.423 61.427 0.996 25932 2477 1 13 . 1 1 465 465 ILE CB C 465 37.409 37.409 38.424 -1.015 25932 2478 1 13 . 1 1 465 465 ILE H H 465 7.745 7.745 7.783 -0.038 25932 2479 1 13 . 1 1 466 466 TYR N N 466 118.846 118.846 120.303 -1.457 25932 2480 1 13 . 1 1 466 466 TYR C C 466 176.150 176.150 176.197 -0.047 25932 2481 1 13 . 1 1 466 466 TYR CA C 466 58.429 58.429 58.269 0.161 25932 2482 1 13 . 1 1 466 466 TYR CB C 466 37.917 37.917 38.912 -0.995 25932 2483 1 13 . 1 1 466 466 TYR H H 466 7.807 7.807 7.268 0.539 25932 2484 1 13 . 1 1 467 467 GLY N N 467 107.987 107.987 107.027 0.960 25932 2485 1 13 . 1 1 467 467 GLY C C 467 174.143 174.143 173.719 0.424 25932 2486 1 13 . 1 1 467 467 GLY CA C 467 45.547 45.547 45.324 0.223 25932 2487 1 13 . 1 1 467 467 GLY H H 467 7.887 7.887 7.792 0.095 25932 2488 1 13 . 1 1 468 468 TYR N N 468 119.878 119.878 120.187 -0.309 25932 2489 1 13 . 1 1 468 468 TYR C C 468 175.524 175.524 175.549 -0.025 25932 2490 1 13 . 1 1 468 468 TYR CA C 468 58.164 58.164 56.899 1.265 25932 2491 1 13 . 1 1 468 468 TYR CB C 468 37.786 37.786 39.704 -1.918 25932 2492 1 13 . 1 1 468 468 TYR H H 468 7.867 7.867 8.007 -0.140 25932 2493 1 13 . 1 1 469 469 ARG N N 469 121.174 121.174 122.888 -1.714 25932 2494 1 13 . 1 1 469 469 ARG C C 469 175.800 175.800 176.363 -0.563 25932 2495 1 13 . 1 1 469 469 ARG CA C 469 55.334 55.334 57.696 -2.362 25932 2496 1 13 . 1 1 469 469 ARG CB C 469 30.035 30.035 30.377 -0.342 25932 2497 1 13 . 1 1 469 469 ARG H H 469 7.873 7.873 8.660 -0.787 25932 2498 1 13 . 1 1 470 470 LEU N N 470 121.718 121.718 121.638 0.080 25932 2499 1 13 . 1 1 470 470 LEU C C 470 176.618 176.618 177.580 -0.962 25932 2500 1 13 . 1 1 470 470 LEU CA C 470 54.858 54.858 55.294 -0.436 25932 2501 1 13 . 1 1 470 470 LEU CB C 470 41.331 41.331 41.986 -0.655 25932 2502 1 13 . 1 1 470 470 LEU H H 470 7.940 7.940 7.911 0.029 25932 2503 1 13 . 1 1 471 471 ARG N N 471 120.624 120.624 123.412 -2.788 25932 2504 1 13 . 1 1 471 471 ARG CA C 471 55.308 55.308 58.006 -2.698 25932 2505 1 13 . 1 1 471 471 ARG CB C 471 30.010 30.010 30.766 -0.756 25932 2506 1 13 . 1 1 471 471 ARG H H 471 7.922 7.922 8.570 -0.648 25932 2507 1 13 . 1 1 472 472 ARG C C 472 175.258 175.258 175.836 -0.578 25932 2508 1 13 . 1 1 472 472 ARG CA C 472 55.704 55.704 55.593 0.112 25932 2509 1 13 . 1 1 472 472 ARG CB C 472 29.851 29.851 30.813 -0.962 25932 2510 1 14 . 1 1 433 433 SER C C 433 174.143 174.143 174.237 -0.094 25932 2511 1 14 . 1 1 433 433 SER CA C 433 57.715 57.715 59.868 -2.153 25932 2512 1 14 . 1 1 433 433 SER CB C 433 63.602 63.602 63.313 0.289 25932 2513 1 14 . 1 1 434 434 TRP N N 434 122.746 122.746 120.822 1.924 25932 2514 1 14 . 1 1 434 434 TRP C C 434 175.587 175.587 175.229 0.358 25932 2515 1 14 . 1 1 434 434 TRP CA C 434 56.604 56.604 56.498 0.106 25932 2516 1 14 . 1 1 434 434 TRP CB C 434 29.269 29.269 30.642 -1.373 25932 2517 1 14 . 1 1 434 434 TRP H H 434 8.283 8.283 7.692 0.591 25932 2518 1 14 . 1 1 435 435 ASP N N 435 121.374 121.374 124.534 -3.160 25932 2519 1 14 . 1 1 435 435 ASP C C 435 176.543 176.543 177.464 -0.921 25932 2520 1 14 . 1 1 435 435 ASP CA C 435 53.562 53.562 52.695 0.867 25932 2521 1 14 . 1 1 435 435 ASP CB C 435 40.854 40.854 42.046 -1.192 25932 2522 1 14 . 1 1 435 435 ASP H H 435 8.219 8.219 8.754 -0.535 25932 2523 1 14 . 1 1 436 436 THR N N 436 116.111 116.111 118.734 -2.623 25932 2524 1 14 . 1 1 436 436 THR C C 436 175.651 175.651 176.161 -0.510 25932 2525 1 14 . 1 1 436 436 THR CA C 436 65.015 65.015 65.200 -0.185 25932 2526 1 14 . 1 1 436 436 THR CB C 436 68.416 68.416 68.976 -0.560 25932 2527 1 14 . 1 1 436 436 THR H H 436 8.251 8.251 8.779 -0.528 25932 2528 1 14 . 1 1 437 437 GLU N N 437 121.374 121.374 121.824 -0.450 25932 2529 1 14 . 1 1 437 437 GLU C C 437 177.988 177.988 178.258 -0.270 25932 2530 1 14 . 1 1 437 437 GLU CA C 437 59.513 59.513 59.532 -0.019 25932 2531 1 14 . 1 1 437 437 GLU CB C 437 28.370 28.370 29.224 -0.854 25932 2532 1 14 . 1 1 437 437 GLU H H 437 8.897 8.897 8.023 0.874 25932 2533 1 14 . 1 1 438 438 SER N N 438 115.658 115.658 115.120 0.538 25932 2534 1 14 . 1 1 438 438 SER C C 438 175.832 175.832 176.721 -0.889 25932 2535 1 14 . 1 1 438 438 SER CA C 438 60.889 60.889 61.068 -0.179 25932 2536 1 14 . 1 1 438 438 SER CB C 438 62.491 62.491 62.933 -0.442 25932 2537 1 14 . 1 1 438 438 SER H H 438 8.018 8.018 7.593 0.425 25932 2538 1 14 . 1 1 439 439 VAL N N 439 122.608 122.608 121.973 0.635 25932 2539 1 14 . 1 1 439 439 VAL C C 439 177.743 177.743 178.097 -0.354 25932 2540 1 14 . 1 1 439 439 VAL CA C 439 65.861 65.861 66.266 -0.405 25932 2541 1 14 . 1 1 439 439 VAL CB C 439 30.698 30.698 31.498 -0.800 25932 2542 1 14 . 1 1 439 439 VAL H H 439 7.908 7.908 7.479 0.429 25932 2543 1 14 . 1 1 440 440 LEU N N 440 120.077 120.077 120.945 -0.868 25932 2544 1 14 . 1 1 440 440 LEU C C 440 178.466 178.466 178.171 0.295 25932 2545 1 14 . 1 1 440 440 LEU CA C 440 57.953 57.953 58.181 -0.228 25932 2546 1 14 . 1 1 440 440 LEU CB C 440 40.378 40.378 41.772 -1.394 25932 2547 1 14 . 1 1 440 440 LEU H H 440 8.171 8.171 8.460 -0.289 25932 2548 1 14 . 1 1 441 441 ALA N N 441 119.465 119.465 120.964 -1.499 25932 2549 1 14 . 1 1 441 441 ALA C C 441 178.986 178.986 179.424 -0.438 25932 2550 1 14 . 1 1 441 441 ALA CA C 441 55.122 55.122 54.675 0.447 25932 2551 1 14 . 1 1 441 441 ALA CB C 441 17.367 17.367 18.154 -0.787 25932 2552 1 14 . 1 1 441 441 ALA H H 441 8.090 8.090 7.757 0.333 25932 2553 1 14 . 1 1 442 442 MET N N 442 116.111 116.111 117.237 -1.126 25932 2554 1 14 . 1 1 442 442 MET C C 442 178.073 178.073 178.056 0.017 25932 2555 1 14 . 1 1 442 442 MET CA C 442 58.217 58.217 59.134 -0.917 25932 2556 1 14 . 1 1 442 442 MET CB C 442 31.597 31.597 32.511 -0.914 25932 2557 1 14 . 1 1 442 442 MET H H 442 7.875 7.875 7.441 0.434 25932 2558 1 14 . 1 1 443 443 TRP N N 443 119.802 119.802 118.210 1.592 25932 2559 1 14 . 1 1 443 443 TRP C C 443 178.445 178.445 177.797 0.648 25932 2560 1 14 . 1 1 443 443 TRP CA C 443 60.624 60.624 59.273 1.351 25932 2561 1 14 . 1 1 443 443 TRP CB C 443 28.899 28.899 28.378 0.521 25932 2562 1 14 . 1 1 443 443 TRP H H 443 8.196 8.196 7.469 0.727 25932 2563 1 14 . 1 1 444 444 VAL N N 444 118.509 118.509 121.558 -3.049 25932 2564 1 14 . 1 1 444 444 VAL C C 444 177.563 177.563 178.273 -0.710 25932 2565 1 14 . 1 1 444 444 VAL CA C 444 66.866 66.866 66.370 0.496 25932 2566 1 14 . 1 1 444 444 VAL CB C 444 30.221 30.221 30.509 -0.288 25932 2567 1 14 . 1 1 444 444 VAL H H 444 8.353 8.353 6.363 1.990 25932 2568 1 14 . 1 1 445 445 LEU N N 445 119.328 119.328 121.045 -1.717 25932 2569 1 14 . 1 1 445 445 LEU C C 445 178.168 178.168 178.362 -0.194 25932 2570 1 14 . 1 1 445 445 LEU CA C 445 57.979 57.979 57.874 0.105 25932 2571 1 14 . 1 1 445 445 LEU CB C 445 40.431 40.431 41.128 -0.697 25932 2572 1 14 . 1 1 445 445 LEU H H 445 8.233 8.233 7.444 0.789 25932 2573 1 14 . 1 1 446 446 ALA N N 446 120.009 120.009 121.908 -1.899 25932 2574 1 14 . 1 1 446 446 ALA C C 446 179.071 179.071 179.836 -0.765 25932 2575 1 14 . 1 1 446 446 ALA CA C 446 55.096 55.096 55.176 -0.080 25932 2576 1 14 . 1 1 446 446 ALA CB C 446 16.996 16.996 18.211 -1.215 25932 2577 1 14 . 1 1 446 446 ALA H H 446 8.402 8.402 7.814 0.588 25932 2578 1 14 . 1 1 447 447 LEU N N 447 117.136 117.136 119.216 -2.080 25932 2579 1 14 . 1 1 447 447 LEU C C 447 178.678 178.678 179.145 -0.467 25932 2580 1 14 . 1 1 447 447 LEU CA C 447 57.767 57.767 57.878 -0.111 25932 2581 1 14 . 1 1 447 447 LEU CB C 447 40.378 40.378 41.957 -1.579 25932 2582 1 14 . 1 1 447 447 LEU H H 447 8.244 8.244 8.153 0.091 25932 2583 1 14 . 1 1 448 448 ILE N N 448 119.121 119.121 119.897 -0.776 25932 2584 1 14 . 1 1 448 448 ILE C C 448 177.574 177.574 178.169 -0.595 25932 2585 1 14 . 1 1 448 448 ILE CA C 448 65.702 65.702 65.660 0.042 25932 2586 1 14 . 1 1 448 448 ILE CB C 448 36.464 36.464 37.728 -1.264 25932 2587 1 14 . 1 1 448 448 ILE H H 448 8.286 8.286 7.770 0.516 25932 2588 1 14 . 1 1 449 449 VAL N N 449 119.052 119.052 119.510 -0.458 25932 2589 1 14 . 1 1 449 449 VAL C C 449 179.135 179.135 178.297 0.838 25932 2590 1 14 . 1 1 449 449 VAL CA C 449 67.051 67.051 66.644 0.407 25932 2591 1 14 . 1 1 449 449 VAL CB C 449 30.175 30.175 31.025 -0.850 25932 2592 1 14 . 1 1 449 449 VAL H H 449 8.327 8.327 7.801 0.526 25932 2593 1 14 . 1 1 450 450 ILE N N 450 123.014 123.014 120.563 2.451 25932 2594 1 14 . 1 1 450 450 ILE C C 450 177.074 177.074 178.027 -0.953 25932 2595 1 14 . 1 1 450 450 ILE CA C 450 65.594 65.594 63.904 1.690 25932 2596 1 14 . 1 1 450 450 ILE CB C 450 36.594 36.594 36.460 0.134 25932 2597 1 14 . 1 1 450 450 ILE H H 450 8.670 8.670 7.654 1.016 25932 2598 1 14 . 1 1 451 451 PHE N N 451 119.392 119.392 119.264 0.128 25932 2599 1 14 . 1 1 451 451 PHE C C 451 177.297 177.297 178.388 -1.091 25932 2600 1 14 . 1 1 451 451 PHE CA C 451 61.389 61.389 62.728 -1.339 25932 2601 1 14 . 1 1 451 451 PHE CB C 451 37.970 37.970 38.115 -0.145 25932 2602 1 14 . 1 1 451 451 PHE H H 451 8.651 8.651 7.856 0.795 25932 2603 1 14 . 1 1 452 452 LEU N N 452 118.367 118.367 119.505 -1.138 25932 2604 1 14 . 1 1 452 452 LEU C C 452 177.967 177.967 179.165 -1.198 25932 2605 1 14 . 1 1 452 452 LEU CA C 452 57.606 57.606 58.228 -0.622 25932 2606 1 14 . 1 1 452 452 LEU CB C 452 40.924 40.924 41.510 -0.585 25932 2607 1 14 . 1 1 452 452 LEU H H 452 8.731 8.731 8.049 0.682 25932 2608 1 14 . 1 1 453 453 THR N N 453 116.173 116.173 116.005 0.168 25932 2609 1 14 . 1 1 453 453 THR C C 453 176.220 176.220 176.772 -0.552 25932 2610 1 14 . 1 1 453 453 THR CA C 453 67.919 67.919 66.401 1.518 25932 2611 1 14 . 1 1 453 453 THR CB C 453 67.006 67.006 68.442 -1.436 25932 2612 1 14 . 1 1 453 453 THR H H 453 8.104 8.104 8.384 -0.280 25932 2613 1 14 . 1 1 454 454 ILE N N 454 120.077 120.077 121.266 -1.189 25932 2614 1 14 . 1 1 454 454 ILE C C 454 176.915 176.915 176.768 0.147 25932 2615 1 14 . 1 1 454 454 ILE CA C 454 65.041 65.041 64.176 0.865 25932 2616 1 14 . 1 1 454 454 ILE CB C 454 36.464 36.464 37.702 -1.238 25932 2617 1 14 . 1 1 454 454 ILE H H 454 8.043 8.043 8.370 -0.327 25932 2618 1 14 . 1 1 455 455 ALA N N 455 121.174 121.174 123.019 -1.845 25932 2619 1 14 . 1 1 455 455 ALA C C 455 178.806 178.806 179.689 -0.883 25932 2620 1 14 . 1 1 455 455 ALA CA C 455 55.346 55.346 55.515 -0.169 25932 2621 1 14 . 1 1 455 455 ALA CB C 455 16.890 16.890 18.050 -1.160 25932 2622 1 14 . 1 1 455 455 ALA H H 455 8.265 8.265 8.275 -0.010 25932 2623 1 14 . 1 1 456 456 VAL N N 456 116.661 116.661 118.719 -2.058 25932 2624 1 14 . 1 1 456 456 VAL C C 456 177.489 177.489 178.130 -0.641 25932 2625 1 14 . 1 1 456 456 VAL CA C 456 66.494 66.494 67.083 -0.589 25932 2626 1 14 . 1 1 456 456 VAL CB C 456 30.226 30.226 31.390 -1.164 25932 2627 1 14 . 1 1 456 456 VAL H H 456 8.211 8.211 7.805 0.406 25932 2628 1 14 . 1 1 457 457 LEU N N 457 119.465 119.465 120.042 -0.577 25932 2629 1 14 . 1 1 457 457 LEU C C 457 179.517 179.517 179.325 0.192 25932 2630 1 14 . 1 1 457 457 LEU CA C 457 58.056 58.056 58.134 -0.078 25932 2631 1 14 . 1 1 457 457 LEU CB C 457 40.414 40.414 41.565 -1.151 25932 2632 1 14 . 1 1 457 457 LEU H H 457 8.150 8.150 7.481 0.669 25932 2633 1 14 . 1 1 458 458 LEU N N 458 118.436 118.436 119.273 -0.837 25932 2634 1 14 . 1 1 458 458 LEU C C 458 178.891 178.891 179.061 -0.170 25932 2635 1 14 . 1 1 458 458 LEU CA C 458 57.395 57.395 58.024 -0.629 25932 2636 1 14 . 1 1 458 458 LEU CB C 458 40.484 40.484 41.454 -0.970 25932 2637 1 14 . 1 1 458 458 LEU H H 458 8.542 8.542 8.065 0.477 25932 2638 1 14 . 1 1 459 459 ALA N N 459 122.337 122.337 121.683 0.654 25932 2639 1 14 . 1 1 459 459 ALA C C 459 179.793 179.793 179.452 0.341 25932 2640 1 14 . 1 1 459 459 ALA CA C 459 55.122 55.122 55.071 0.052 25932 2641 1 14 . 1 1 459 459 ALA CB C 459 17.208 17.208 18.616 -1.408 25932 2642 1 14 . 1 1 459 459 ALA H H 459 8.401 8.401 8.107 0.294 25932 2643 1 14 . 1 1 460 460 LEU N N 460 117.961 117.961 120.547 -2.586 25932 2644 1 14 . 1 1 460 460 LEU C C 460 179.262 179.262 178.553 0.709 25932 2645 1 14 . 1 1 460 460 LEU CA C 460 57.673 57.673 58.059 -0.386 25932 2646 1 14 . 1 1 460 460 LEU CB C 460 40.414 40.414 41.407 -0.994 25932 2647 1 14 . 1 1 460 460 LEU H H 460 8.518 8.518 8.542 -0.024 25932 2648 1 14 . 1 1 461 461 ARG N N 461 119.534 119.534 119.488 0.046 25932 2649 1 14 . 1 1 461 461 ARG C C 461 178.625 178.625 178.565 0.060 25932 2650 1 14 . 1 1 461 461 ARG CA C 461 57.818 57.818 59.138 -1.320 25932 2651 1 14 . 1 1 461 461 ARG CB C 461 28.443 28.443 29.855 -1.411 25932 2652 1 14 . 1 1 461 461 ARG H H 461 8.029 8.029 7.995 0.034 25932 2653 1 14 . 1 1 462 462 PHE N N 462 118.777 118.777 120.640 -1.863 25932 2654 1 14 . 1 1 462 462 PHE C C 462 177.127 177.127 178.422 -1.295 25932 2655 1 14 . 1 1 462 462 PHE CA C 462 60.624 60.624 61.576 -0.952 25932 2656 1 14 . 1 1 462 462 PHE CB C 462 38.633 38.633 39.109 -0.477 25932 2657 1 14 . 1 1 462 462 PHE H H 462 8.460 8.460 7.999 0.461 25932 2658 1 14 . 1 1 463 463 CYS N N 463 116.386 116.386 118.209 -1.823 25932 2659 1 14 . 1 1 463 463 CYS C C 463 175.980 175.980 177.092 -1.112 25932 2660 1 14 . 1 1 463 463 CYS CA C 463 61.999 61.999 63.127 -1.128 25932 2661 1 14 . 1 1 463 463 CYS CB C 463 26.966 26.966 27.135 -0.169 25932 2662 1 14 . 1 1 463 463 CYS H H 463 8.278 8.278 8.753 -0.475 25932 2663 1 14 . 1 1 464 464 GLY N N 464 107.774 107.774 109.115 -1.341 25932 2664 1 14 . 1 1 464 464 GLY C C 464 174.990 174.990 175.487 -0.497 25932 2665 1 14 . 1 1 464 464 GLY CA C 464 45.944 45.944 46.875 -0.931 25932 2666 1 14 . 1 1 464 464 GLY H H 464 8.050 8.050 8.215 -0.165 25932 2667 1 14 . 1 1 465 465 ILE N N 465 119.940 119.940 118.755 1.185 25932 2668 1 14 . 1 1 465 465 ILE C C 465 176.458 176.458 175.278 1.180 25932 2669 1 14 . 1 1 465 465 ILE CA C 465 62.423 62.423 61.506 0.917 25932 2670 1 14 . 1 1 465 465 ILE CB C 465 37.409 37.409 38.183 -0.774 25932 2671 1 14 . 1 1 465 465 ILE H H 465 7.745 7.745 7.497 0.248 25932 2672 1 14 . 1 1 466 466 TYR N N 466 118.846 118.846 119.002 -0.156 25932 2673 1 14 . 1 1 466 466 TYR C C 466 176.150 176.150 176.112 0.038 25932 2674 1 14 . 1 1 466 466 TYR CA C 466 58.429 58.429 58.239 0.190 25932 2675 1 14 . 1 1 466 466 TYR CB C 466 37.917 37.917 39.252 -1.335 25932 2676 1 14 . 1 1 466 466 TYR H H 466 7.807 7.807 7.479 0.328 25932 2677 1 14 . 1 1 467 467 GLY N N 467 107.987 107.987 107.169 0.818 25932 2678 1 14 . 1 1 467 467 GLY C C 467 174.143 174.143 173.677 0.466 25932 2679 1 14 . 1 1 467 467 GLY CA C 467 45.547 45.547 45.446 0.102 25932 2680 1 14 . 1 1 467 467 GLY H H 467 7.887 7.887 7.823 0.064 25932 2681 1 14 . 1 1 468 468 TYR N N 468 119.878 119.878 120.043 -0.165 25932 2682 1 14 . 1 1 468 468 TYR C C 468 175.524 175.524 175.459 0.065 25932 2683 1 14 . 1 1 468 468 TYR CA C 468 58.164 58.164 57.061 1.103 25932 2684 1 14 . 1 1 468 468 TYR CB C 468 37.786 37.786 39.853 -2.067 25932 2685 1 14 . 1 1 468 468 TYR H H 468 7.867 7.867 8.242 -0.375 25932 2686 1 14 . 1 1 469 469 ARG N N 469 121.174 121.174 121.960 -0.786 25932 2687 1 14 . 1 1 469 469 ARG C C 469 175.800 175.800 174.940 0.860 25932 2688 1 14 . 1 1 469 469 ARG CA C 469 55.334 55.334 56.729 -1.395 25932 2689 1 14 . 1 1 469 469 ARG CB C 469 30.035 30.035 28.226 1.809 25932 2690 1 14 . 1 1 469 469 ARG H H 469 7.873 7.873 8.779 -0.906 25932 2691 1 14 . 1 1 470 470 LEU N N 470 121.718 121.718 118.184 3.534 25932 2692 1 14 . 1 1 470 470 LEU C C 470 176.618 176.618 177.597 -0.979 25932 2693 1 14 . 1 1 470 470 LEU CA C 470 54.858 54.858 56.759 -1.901 25932 2694 1 14 . 1 1 470 470 LEU CB C 470 41.331 41.331 41.723 -0.392 25932 2695 1 14 . 1 1 470 470 LEU H H 470 7.940 7.940 8.413 -0.473 25932 2696 1 14 . 1 1 471 471 ARG N N 471 120.624 120.624 119.830 0.794 25932 2697 1 14 . 1 1 471 471 ARG CA C 471 55.308 55.308 55.498 -0.190 25932 2698 1 14 . 1 1 471 471 ARG CB C 471 30.010 30.010 30.581 -0.571 25932 2699 1 14 . 1 1 471 471 ARG H H 471 7.922 7.922 7.986 -0.064 25932 2700 1 14 . 1 1 472 472 ARG C C 472 175.258 175.258 175.322 -0.064 25932 2701 1 14 . 1 1 472 472 ARG CA C 472 55.704 55.704 55.280 0.424 25932 2702 1 14 . 1 1 472 472 ARG CB C 472 29.851 29.851 32.136 -2.285 25932 2703 1 15 . 1 1 433 433 SER C C 433 174.143 174.143 173.655 0.488 25932 2704 1 15 . 1 1 433 433 SER CA C 433 57.715 57.715 57.085 0.630 25932 2705 1 15 . 1 1 433 433 SER CB C 433 63.602 63.602 64.283 -0.681 25932 2706 1 15 . 1 1 434 434 TRP N N 434 122.746 122.746 121.265 1.481 25932 2707 1 15 . 1 1 434 434 TRP C C 434 175.587 175.587 177.000 -1.413 25932 2708 1 15 . 1 1 434 434 TRP CA C 434 56.604 56.604 58.856 -2.252 25932 2709 1 15 . 1 1 434 434 TRP CB C 434 29.269 29.269 30.112 -0.843 25932 2710 1 15 . 1 1 434 434 TRP H H 434 8.283 8.283 8.792 -0.509 25932 2711 1 15 . 1 1 435 435 ASP N N 435 121.374 121.374 117.497 3.877 25932 2712 1 15 . 1 1 435 435 ASP C C 435 176.543 176.543 177.210 -0.667 25932 2713 1 15 . 1 1 435 435 ASP CA C 435 53.562 53.562 55.430 -1.868 25932 2714 1 15 . 1 1 435 435 ASP CB C 435 40.854 40.854 38.993 1.861 25932 2715 1 15 . 1 1 435 435 ASP H H 435 8.219 8.219 8.544 -0.325 25932 2716 1 15 . 1 1 436 436 THR N N 436 116.111 116.111 112.175 3.936 25932 2717 1 15 . 1 1 436 436 THR C C 436 175.651 175.651 176.421 -0.770 25932 2718 1 15 . 1 1 436 436 THR CA C 436 65.015 65.015 65.118 -0.103 25932 2719 1 15 . 1 1 436 436 THR CB C 436 68.416 68.416 68.395 0.021 25932 2720 1 15 . 1 1 436 436 THR H H 436 8.251 8.251 7.554 0.697 25932 2721 1 15 . 1 1 437 437 GLU N N 437 121.374 121.374 121.583 -0.209 25932 2722 1 15 . 1 1 437 437 GLU C C 437 177.988 177.988 178.827 -0.839 25932 2723 1 15 . 1 1 437 437 GLU CA C 437 59.513 59.513 59.387 0.126 25932 2724 1 15 . 1 1 437 437 GLU CB C 437 28.370 28.370 29.257 -0.887 25932 2725 1 15 . 1 1 437 437 GLU H H 437 8.897 8.897 7.825 1.072 25932 2726 1 15 . 1 1 438 438 SER N N 438 115.658 115.658 114.904 0.754 25932 2727 1 15 . 1 1 438 438 SER C C 438 175.832 175.832 176.686 -0.854 25932 2728 1 15 . 1 1 438 438 SER CA C 438 60.889 60.889 61.304 -0.415 25932 2729 1 15 . 1 1 438 438 SER CB C 438 62.491 62.491 62.688 -0.197 25932 2730 1 15 . 1 1 438 438 SER H H 438 8.018 8.018 7.782 0.236 25932 2731 1 15 . 1 1 439 439 VAL N N 439 122.608 122.608 119.921 2.687 25932 2732 1 15 . 1 1 439 439 VAL C C 439 177.743 177.743 177.386 0.357 25932 2733 1 15 . 1 1 439 439 VAL CA C 439 65.861 65.861 64.588 1.272 25932 2734 1 15 . 1 1 439 439 VAL CB C 439 30.698 30.698 30.855 -0.157 25932 2735 1 15 . 1 1 439 439 VAL H H 439 7.908 7.908 7.342 0.566 25932 2736 1 15 . 1 1 440 440 LEU N N 440 120.077 120.077 120.816 -0.739 25932 2737 1 15 . 1 1 440 440 LEU C C 440 178.466 178.466 178.609 -0.143 25932 2738 1 15 . 1 1 440 440 LEU CA C 440 57.953 57.953 57.931 0.022 25932 2739 1 15 . 1 1 440 440 LEU CB C 440 40.378 40.378 41.288 -0.909 25932 2740 1 15 . 1 1 440 440 LEU H H 440 8.171 8.171 7.813 0.358 25932 2741 1 15 . 1 1 441 441 ALA N N 441 119.465 119.465 121.058 -1.593 25932 2742 1 15 . 1 1 441 441 ALA C C 441 178.986 178.986 179.219 -0.233 25932 2743 1 15 . 1 1 441 441 ALA CA C 441 55.122 55.122 55.055 0.067 25932 2744 1 15 . 1 1 441 441 ALA CB C 441 17.367 17.367 18.076 -0.709 25932 2745 1 15 . 1 1 441 441 ALA H H 441 8.090 8.090 7.509 0.581 25932 2746 1 15 . 1 1 442 442 MET N N 442 116.111 116.111 117.022 -0.911 25932 2747 1 15 . 1 1 442 442 MET C C 442 178.073 178.073 177.884 0.189 25932 2748 1 15 . 1 1 442 442 MET CA C 442 58.217 58.217 58.910 -0.693 25932 2749 1 15 . 1 1 442 442 MET CB C 442 31.597 31.597 32.164 -0.568 25932 2750 1 15 . 1 1 442 442 MET H H 442 7.875 7.875 7.422 0.453 25932 2751 1 15 . 1 1 443 443 TRP N N 443 119.802 119.802 117.920 1.882 25932 2752 1 15 . 1 1 443 443 TRP C C 443 178.445 178.445 177.805 0.640 25932 2753 1 15 . 1 1 443 443 TRP CA C 443 60.624 60.624 58.938 1.686 25932 2754 1 15 . 1 1 443 443 TRP CB C 443 28.899 28.899 28.482 0.417 25932 2755 1 15 . 1 1 443 443 TRP H H 443 8.196 8.196 7.327 0.869 25932 2756 1 15 . 1 1 444 444 VAL N N 444 118.509 118.509 122.036 -3.527 25932 2757 1 15 . 1 1 444 444 VAL C C 444 177.563 177.563 177.475 0.088 25932 2758 1 15 . 1 1 444 444 VAL CA C 444 66.866 66.866 65.519 1.347 25932 2759 1 15 . 1 1 444 444 VAL CB C 444 30.221 30.221 31.035 -0.814 25932 2760 1 15 . 1 1 444 444 VAL H H 444 8.353 8.353 6.153 2.200 25932 2761 1 15 . 1 1 445 445 LEU N N 445 119.328 119.328 120.416 -1.088 25932 2762 1 15 . 1 1 445 445 LEU C C 445 178.168 178.168 178.179 -0.011 25932 2763 1 15 . 1 1 445 445 LEU CA C 445 57.979 57.979 57.724 0.255 25932 2764 1 15 . 1 1 445 445 LEU CB C 445 40.431 40.431 41.215 -0.784 25932 2765 1 15 . 1 1 445 445 LEU H H 445 8.233 8.233 7.333 0.900 25932 2766 1 15 . 1 1 446 446 ALA N N 446 120.009 120.009 121.852 -1.843 25932 2767 1 15 . 1 1 446 446 ALA C C 446 179.071 179.071 179.800 -0.729 25932 2768 1 15 . 1 1 446 446 ALA CA C 446 55.096 55.096 55.133 -0.037 25932 2769 1 15 . 1 1 446 446 ALA CB C 446 16.996 16.996 18.160 -1.164 25932 2770 1 15 . 1 1 446 446 ALA H H 446 8.402 8.402 7.678 0.724 25932 2771 1 15 . 1 1 447 447 LEU N N 447 117.136 117.136 119.536 -2.400 25932 2772 1 15 . 1 1 447 447 LEU C C 447 178.678 178.678 179.237 -0.559 25932 2773 1 15 . 1 1 447 447 LEU CA C 447 57.767 57.767 57.796 -0.029 25932 2774 1 15 . 1 1 447 447 LEU CB C 447 40.378 40.378 41.852 -1.474 25932 2775 1 15 . 1 1 447 447 LEU H H 447 8.244 8.244 8.004 0.240 25932 2776 1 15 . 1 1 448 448 ILE N N 448 119.121 119.121 119.626 -0.505 25932 2777 1 15 . 1 1 448 448 ILE C C 448 177.574 177.574 178.523 -0.949 25932 2778 1 15 . 1 1 448 448 ILE CA C 448 65.702 65.702 64.248 1.454 25932 2779 1 15 . 1 1 448 448 ILE CB C 448 36.464 36.464 36.490 -0.026 25932 2780 1 15 . 1 1 448 448 ILE H H 448 8.286 8.286 7.797 0.489 25932 2781 1 15 . 1 1 449 449 VAL N N 449 119.052 119.052 120.206 -1.154 25932 2782 1 15 . 1 1 449 449 VAL C C 449 179.135 179.135 178.335 0.800 25932 2783 1 15 . 1 1 449 449 VAL CA C 449 67.051 67.051 66.852 0.199 25932 2784 1 15 . 1 1 449 449 VAL CB C 449 30.175 30.175 31.211 -1.036 25932 2785 1 15 . 1 1 449 449 VAL H H 449 8.327 8.327 7.784 0.543 25932 2786 1 15 . 1 1 450 450 ILE N N 450 123.014 123.014 120.502 2.512 25932 2787 1 15 . 1 1 450 450 ILE C C 450 177.074 177.074 177.813 -0.739 25932 2788 1 15 . 1 1 450 450 ILE CA C 450 65.594 65.594 65.424 0.170 25932 2789 1 15 . 1 1 450 450 ILE CB C 450 36.594 36.594 37.576 -0.982 25932 2790 1 15 . 1 1 450 450 ILE H H 450 8.670 8.670 7.752 0.918 25932 2791 1 15 . 1 1 451 451 PHE N N 451 119.392 119.392 118.903 0.489 25932 2792 1 15 . 1 1 451 451 PHE C C 451 177.297 177.297 178.008 -0.711 25932 2793 1 15 . 1 1 451 451 PHE CA C 451 61.389 61.389 62.491 -1.102 25932 2794 1 15 . 1 1 451 451 PHE CB C 451 37.970 37.970 38.340 -0.370 25932 2795 1 15 . 1 1 451 451 PHE H H 451 8.651 8.651 7.807 0.844 25932 2796 1 15 . 1 1 452 452 LEU N N 452 118.367 118.367 119.775 -1.408 25932 2797 1 15 . 1 1 452 452 LEU C C 452 177.967 177.967 179.316 -1.349 25932 2798 1 15 . 1 1 452 452 LEU CA C 452 57.606 57.606 58.313 -0.707 25932 2799 1 15 . 1 1 452 452 LEU CB C 452 40.924 40.924 40.663 0.261 25932 2800 1 15 . 1 1 452 452 LEU H H 452 8.731 8.731 7.938 0.793 25932 2801 1 15 . 1 1 453 453 THR N N 453 116.173 116.173 116.614 -0.441 25932 2802 1 15 . 1 1 453 453 THR C C 453 176.220 176.220 176.890 -0.670 25932 2803 1 15 . 1 1 453 453 THR CA C 453 67.919 67.919 67.297 0.622 25932 2804 1 15 . 1 1 453 453 THR CB C 453 67.006 67.006 68.543 -1.537 25932 2805 1 15 . 1 1 453 453 THR H H 453 8.104 8.104 8.180 -0.076 25932 2806 1 15 . 1 1 454 454 ILE N N 454 120.077 120.077 121.157 -1.080 25932 2807 1 15 . 1 1 454 454 ILE C C 454 176.915 176.915 177.455 -0.540 25932 2808 1 15 . 1 1 454 454 ILE CA C 454 65.041 65.041 65.278 -0.237 25932 2809 1 15 . 1 1 454 454 ILE CB C 454 36.464 36.464 37.622 -1.158 25932 2810 1 15 . 1 1 454 454 ILE H H 454 8.043 8.043 8.310 -0.267 25932 2811 1 15 . 1 1 455 455 ALA N N 455 121.174 121.174 122.721 -1.547 25932 2812 1 15 . 1 1 455 455 ALA C C 455 178.806 178.806 179.763 -0.957 25932 2813 1 15 . 1 1 455 455 ALA CA C 455 55.346 55.346 55.493 -0.147 25932 2814 1 15 . 1 1 455 455 ALA CB C 455 16.890 16.890 18.088 -1.198 25932 2815 1 15 . 1 1 455 455 ALA H H 455 8.265 8.265 8.563 -0.298 25932 2816 1 15 . 1 1 456 456 VAL N N 456 116.661 116.661 118.947 -2.286 25932 2817 1 15 . 1 1 456 456 VAL C C 456 177.489 177.489 178.225 -0.736 25932 2818 1 15 . 1 1 456 456 VAL CA C 456 66.494 66.494 66.945 -0.451 25932 2819 1 15 . 1 1 456 456 VAL CB C 456 30.226 30.226 31.333 -1.107 25932 2820 1 15 . 1 1 456 456 VAL H H 456 8.211 8.211 7.917 0.294 25932 2821 1 15 . 1 1 457 457 LEU N N 457 119.465 119.465 120.489 -1.024 25932 2822 1 15 . 1 1 457 457 LEU C C 457 179.517 179.517 179.304 0.213 25932 2823 1 15 . 1 1 457 457 LEU CA C 457 58.056 58.056 58.571 -0.515 25932 2824 1 15 . 1 1 457 457 LEU CB C 457 40.414 40.414 41.438 -1.024 25932 2825 1 15 . 1 1 457 457 LEU H H 457 8.150 8.150 7.492 0.658 25932 2826 1 15 . 1 1 458 458 LEU N N 458 118.436 118.436 119.306 -0.870 25932 2827 1 15 . 1 1 458 458 LEU C C 458 178.891 178.891 179.013 -0.122 25932 2828 1 15 . 1 1 458 458 LEU CA C 458 57.395 57.395 58.214 -0.819 25932 2829 1 15 . 1 1 458 458 LEU CB C 458 40.484 40.484 41.331 -0.848 25932 2830 1 15 . 1 1 458 458 LEU H H 458 8.542 8.542 7.901 0.641 25932 2831 1 15 . 1 1 459 459 ALA N N 459 122.337 122.337 121.659 0.678 25932 2832 1 15 . 1 1 459 459 ALA C C 459 179.793 179.793 179.432 0.361 25932 2833 1 15 . 1 1 459 459 ALA CA C 459 55.122 55.122 55.030 0.092 25932 2834 1 15 . 1 1 459 459 ALA CB C 459 17.208 17.208 18.607 -1.399 25932 2835 1 15 . 1 1 459 459 ALA H H 459 8.401 8.401 8.096 0.305 25932 2836 1 15 . 1 1 460 460 LEU N N 460 117.961 117.961 120.632 -2.671 25932 2837 1 15 . 1 1 460 460 LEU C C 460 179.262 179.262 178.630 0.632 25932 2838 1 15 . 1 1 460 460 LEU CA C 460 57.673 57.673 58.015 -0.342 25932 2839 1 15 . 1 1 460 460 LEU CB C 460 40.414 40.414 41.514 -1.100 25932 2840 1 15 . 1 1 460 460 LEU H H 460 8.518 8.518 8.472 0.046 25932 2841 1 15 . 1 1 461 461 ARG N N 461 119.534 119.534 119.338 0.196 25932 2842 1 15 . 1 1 461 461 ARG C C 461 178.625 178.625 178.251 0.374 25932 2843 1 15 . 1 1 461 461 ARG CA C 461 57.818 57.818 59.314 -1.496 25932 2844 1 15 . 1 1 461 461 ARG CB C 461 28.443 28.443 29.774 -1.331 25932 2845 1 15 . 1 1 461 461 ARG H H 461 8.029 8.029 8.005 0.024 25932 2846 1 15 . 1 1 462 462 PHE N N 462 118.777 118.777 120.809 -2.032 25932 2847 1 15 . 1 1 462 462 PHE C C 462 177.127 177.127 176.806 0.321 25932 2848 1 15 . 1 1 462 462 PHE CA C 462 60.624 60.624 61.136 -0.512 25932 2849 1 15 . 1 1 462 462 PHE CB C 462 38.633 38.633 38.957 -0.324 25932 2850 1 15 . 1 1 462 462 PHE H H 462 8.460 8.460 7.852 0.608 25932 2851 1 15 . 1 1 463 463 CYS N N 463 116.386 116.386 116.292 0.094 25932 2852 1 15 . 1 1 463 463 CYS C C 463 175.980 175.980 176.450 -0.470 25932 2853 1 15 . 1 1 463 463 CYS CA C 463 61.999 61.999 62.764 -0.765 25932 2854 1 15 . 1 1 463 463 CYS CB C 463 26.966 26.966 27.846 -0.880 25932 2855 1 15 . 1 1 463 463 CYS H H 463 8.278 8.278 8.386 -0.108 25932 2856 1 15 . 1 1 464 464 GLY N N 464 107.774 107.774 108.787 -1.013 25932 2857 1 15 . 1 1 464 464 GLY C C 464 174.990 174.990 175.329 -0.339 25932 2858 1 15 . 1 1 464 464 GLY CA C 464 45.944 45.944 46.675 -0.731 25932 2859 1 15 . 1 1 464 464 GLY H H 464 8.050 8.050 8.057 -0.007 25932 2860 1 15 . 1 1 465 465 ILE N N 465 119.940 119.940 118.656 1.284 25932 2861 1 15 . 1 1 465 465 ILE C C 465 176.458 176.458 175.502 0.956 25932 2862 1 15 . 1 1 465 465 ILE CA C 465 62.423 62.423 61.414 1.009 25932 2863 1 15 . 1 1 465 465 ILE CB C 465 37.409 37.409 38.413 -1.004 25932 2864 1 15 . 1 1 465 465 ILE H H 465 7.745 7.745 7.697 0.048 25932 2865 1 15 . 1 1 466 466 TYR N N 466 118.846 118.846 120.405 -1.559 25932 2866 1 15 . 1 1 466 466 TYR C C 466 176.150 176.150 175.800 0.350 25932 2867 1 15 . 1 1 466 466 TYR CA C 466 58.429 58.429 57.671 0.758 25932 2868 1 15 . 1 1 466 466 TYR CB C 466 37.917 37.917 39.270 -1.353 25932 2869 1 15 . 1 1 466 466 TYR H H 466 7.807 7.807 7.037 0.770 25932 2870 1 15 . 1 1 467 467 GLY N N 467 107.987 107.987 106.832 1.155 25932 2871 1 15 . 1 1 467 467 GLY C C 467 174.143 174.143 174.546 -0.403 25932 2872 1 15 . 1 1 467 467 GLY CA C 467 45.547 45.547 45.454 0.093 25932 2873 1 15 . 1 1 467 467 GLY H H 467 7.887 7.887 7.561 0.326 25932 2874 1 15 . 1 1 468 468 TYR N N 468 119.878 119.878 117.920 1.958 25932 2875 1 15 . 1 1 468 468 TYR C C 468 175.524 175.524 175.823 -0.299 25932 2876 1 15 . 1 1 468 468 TYR CA C 468 58.164 58.164 61.092 -2.928 25932 2877 1 15 . 1 1 468 468 TYR CB C 468 37.786 37.786 37.017 0.769 25932 2878 1 15 . 1 1 468 468 TYR H H 468 7.867 7.867 7.978 -0.111 25932 2879 1 15 . 1 1 469 469 ARG N N 469 121.174 121.174 120.905 0.269 25932 2880 1 15 . 1 1 469 469 ARG C C 469 175.800 175.800 176.807 -1.007 25932 2881 1 15 . 1 1 469 469 ARG CA C 469 55.334 55.334 55.550 -0.216 25932 2882 1 15 . 1 1 469 469 ARG CB C 469 30.035 30.035 30.885 -0.850 25932 2883 1 15 . 1 1 469 469 ARG H H 469 7.873 7.873 8.441 -0.568 25932 2884 1 15 . 1 1 470 470 LEU N N 470 121.718 121.718 123.103 -1.385 25932 2885 1 15 . 1 1 470 470 LEU C C 470 176.618 176.618 177.997 -1.379 25932 2886 1 15 . 1 1 470 470 LEU CA C 470 54.858 54.858 56.324 -1.466 25932 2887 1 15 . 1 1 470 470 LEU CB C 470 41.331 41.331 42.361 -1.030 25932 2888 1 15 . 1 1 470 470 LEU H H 470 7.940 7.940 8.501 -0.561 25932 2889 1 15 . 1 1 471 471 ARG N N 471 120.624 120.624 120.885 -0.261 25932 2890 1 15 . 1 1 471 471 ARG CA C 471 55.308 55.308 56.007 -0.699 25932 2891 1 15 . 1 1 471 471 ARG CB C 471 30.010 30.010 30.766 -0.756 25932 2892 1 15 . 1 1 471 471 ARG H H 471 7.922 7.922 7.854 0.068 25932 2893 1 15 . 1 1 472 472 ARG C C 472 175.258 175.258 176.122 -0.864 25932 2894 1 15 . 1 1 472 472 ARG CA C 472 55.704 55.704 56.282 -0.578 25932 2895 1 15 . 1 1 472 472 ARG CB C 472 29.851 29.851 30.893 -1.042 25932 2896 1 16 . 1 1 433 433 SER C C 433 174.143 174.143 174.373 -0.230 25932 2897 1 16 . 1 1 433 433 SER CA C 433 57.715 57.715 57.331 0.384 25932 2898 1 16 . 1 1 433 433 SER CB C 433 63.602 63.602 65.500 -1.898 25932 2899 1 16 . 1 1 434 434 TRP N N 434 122.746 122.746 123.061 -0.315 25932 2900 1 16 . 1 1 434 434 TRP C C 434 175.587 175.587 176.454 -0.867 25932 2901 1 16 . 1 1 434 434 TRP CA C 434 56.604 56.604 58.401 -1.797 25932 2902 1 16 . 1 1 434 434 TRP CB C 434 29.269 29.269 29.695 -0.426 25932 2903 1 16 . 1 1 434 434 TRP H H 434 8.283 8.283 8.370 -0.087 25932 2904 1 16 . 1 1 435 435 ASP N N 435 121.374 121.374 119.312 2.062 25932 2905 1 16 . 1 1 435 435 ASP C C 435 176.543 176.543 176.931 -0.388 25932 2906 1 16 . 1 1 435 435 ASP CA C 435 53.562 53.562 53.242 0.320 25932 2907 1 16 . 1 1 435 435 ASP CB C 435 40.854 40.854 40.914 -0.060 25932 2908 1 16 . 1 1 435 435 ASP H H 435 8.219 8.219 8.131 0.088 25932 2909 1 16 . 1 1 436 436 THR N N 436 116.111 116.111 117.989 -1.878 25932 2910 1 16 . 1 1 436 436 THR C C 436 175.651 175.651 175.999 -0.348 25932 2911 1 16 . 1 1 436 436 THR CA C 436 65.015 65.015 64.424 0.591 25932 2912 1 16 . 1 1 436 436 THR CB C 436 68.416 68.416 69.114 -0.698 25932 2913 1 16 . 1 1 436 436 THR H H 436 8.251 8.251 8.659 -0.408 25932 2914 1 16 . 1 1 437 437 GLU N N 437 121.374 121.374 121.670 -0.296 25932 2915 1 16 . 1 1 437 437 GLU C C 437 177.988 177.988 178.520 -0.532 25932 2916 1 16 . 1 1 437 437 GLU CA C 437 59.513 59.513 59.601 -0.088 25932 2917 1 16 . 1 1 437 437 GLU CB C 437 28.370 28.370 29.519 -1.149 25932 2918 1 16 . 1 1 437 437 GLU H H 437 8.897 8.897 7.971 0.926 25932 2919 1 16 . 1 1 438 438 SER N N 438 115.658 115.658 115.341 0.317 25932 2920 1 16 . 1 1 438 438 SER C C 438 175.832 175.832 176.696 -0.864 25932 2921 1 16 . 1 1 438 438 SER CA C 438 60.889 60.889 61.480 -0.591 25932 2922 1 16 . 1 1 438 438 SER CB C 438 62.491 62.491 62.822 -0.331 25932 2923 1 16 . 1 1 438 438 SER H H 438 8.018 8.018 7.688 0.330 25932 2924 1 16 . 1 1 439 439 VAL N N 439 122.608 122.608 122.665 -0.057 25932 2925 1 16 . 1 1 439 439 VAL C C 439 177.743 177.743 177.856 -0.113 25932 2926 1 16 . 1 1 439 439 VAL CA C 439 65.861 65.861 66.450 -0.589 25932 2927 1 16 . 1 1 439 439 VAL CB C 439 30.698 30.698 31.810 -1.112 25932 2928 1 16 . 1 1 439 439 VAL H H 439 7.908 7.908 7.207 0.701 25932 2929 1 16 . 1 1 440 440 LEU N N 440 120.077 120.077 119.408 0.669 25932 2930 1 16 . 1 1 440 440 LEU C C 440 178.466 178.466 178.577 -0.111 25932 2931 1 16 . 1 1 440 440 LEU CA C 440 57.953 57.953 57.978 -0.026 25932 2932 1 16 . 1 1 440 440 LEU CB C 440 40.378 40.378 41.671 -1.293 25932 2933 1 16 . 1 1 440 440 LEU H H 440 8.171 8.171 8.157 0.014 25932 2934 1 16 . 1 1 441 441 ALA N N 441 119.465 119.465 121.168 -1.703 25932 2935 1 16 . 1 1 441 441 ALA C C 441 178.986 178.986 179.337 -0.351 25932 2936 1 16 . 1 1 441 441 ALA CA C 441 55.122 55.122 54.637 0.485 25932 2937 1 16 . 1 1 441 441 ALA CB C 441 17.367 17.367 18.108 -0.740 25932 2938 1 16 . 1 1 441 441 ALA H H 441 8.090 8.090 7.687 0.403 25932 2939 1 16 . 1 1 442 442 MET N N 442 116.111 116.111 117.227 -1.116 25932 2940 1 16 . 1 1 442 442 MET C C 442 178.073 178.073 178.065 0.008 25932 2941 1 16 . 1 1 442 442 MET CA C 442 58.217 58.217 59.144 -0.927 25932 2942 1 16 . 1 1 442 442 MET CB C 442 31.597 31.597 32.520 -0.923 25932 2943 1 16 . 1 1 442 442 MET H H 442 7.875 7.875 7.434 0.441 25932 2944 1 16 . 1 1 443 443 TRP N N 443 119.802 119.802 118.159 1.643 25932 2945 1 16 . 1 1 443 443 TRP C C 443 178.445 178.445 177.674 0.771 25932 2946 1 16 . 1 1 443 443 TRP CA C 443 60.624 60.624 59.373 1.251 25932 2947 1 16 . 1 1 443 443 TRP CB C 443 28.899 28.899 28.223 0.676 25932 2948 1 16 . 1 1 443 443 TRP H H 443 8.196 8.196 7.462 0.734 25932 2949 1 16 . 1 1 444 444 VAL N N 444 118.509 118.509 121.979 -3.470 25932 2950 1 16 . 1 1 444 444 VAL C C 444 177.563 177.563 177.918 -0.355 25932 2951 1 16 . 1 1 444 444 VAL CA C 444 66.866 66.866 65.791 1.075 25932 2952 1 16 . 1 1 444 444 VAL CB C 444 30.221 30.221 30.894 -0.673 25932 2953 1 16 . 1 1 444 444 VAL H H 444 8.353 8.353 6.319 2.034 25932 2954 1 16 . 1 1 445 445 LEU N N 445 119.328 119.328 120.306 -0.978 25932 2955 1 16 . 1 1 445 445 LEU C C 445 178.168 178.168 178.235 -0.067 25932 2956 1 16 . 1 1 445 445 LEU CA C 445 57.979 57.979 57.776 0.203 25932 2957 1 16 . 1 1 445 445 LEU CB C 445 40.431 40.431 41.241 -0.810 25932 2958 1 16 . 1 1 445 445 LEU H H 445 8.233 8.233 7.358 0.875 25932 2959 1 16 . 1 1 446 446 ALA N N 446 120.009 120.009 122.197 -2.188 25932 2960 1 16 . 1 1 446 446 ALA C C 446 179.071 179.071 179.746 -0.675 25932 2961 1 16 . 1 1 446 446 ALA CA C 446 55.096 55.096 55.297 -0.201 25932 2962 1 16 . 1 1 446 446 ALA CB C 446 16.996 16.996 18.251 -1.255 25932 2963 1 16 . 1 1 446 446 ALA H H 446 8.402 8.402 7.823 0.579 25932 2964 1 16 . 1 1 447 447 LEU N N 447 117.136 117.136 120.078 -2.942 25932 2965 1 16 . 1 1 447 447 LEU C C 447 178.678 178.678 179.248 -0.570 25932 2966 1 16 . 1 1 447 447 LEU CA C 447 57.767 57.767 58.481 -0.714 25932 2967 1 16 . 1 1 447 447 LEU CB C 447 40.378 40.378 41.752 -1.374 25932 2968 1 16 . 1 1 447 447 LEU H H 447 8.244 8.244 8.475 -0.231 25932 2969 1 16 . 1 1 448 448 ILE N N 448 119.121 119.121 119.436 -0.315 25932 2970 1 16 . 1 1 448 448 ILE C C 448 177.574 177.574 178.484 -0.910 25932 2971 1 16 . 1 1 448 448 ILE CA C 448 65.702 65.702 64.421 1.281 25932 2972 1 16 . 1 1 448 448 ILE CB C 448 36.464 36.464 36.750 -0.286 25932 2973 1 16 . 1 1 448 448 ILE H H 448 8.286 8.286 8.152 0.134 25932 2974 1 16 . 1 1 449 449 VAL N N 449 119.052 119.052 120.297 -1.245 25932 2975 1 16 . 1 1 449 449 VAL C C 449 179.135 179.135 178.464 0.671 25932 2976 1 16 . 1 1 449 449 VAL CA C 449 67.051 67.051 67.196 -0.145 25932 2977 1 16 . 1 1 449 449 VAL CB C 449 30.175 30.175 31.803 -1.628 25932 2978 1 16 . 1 1 449 449 VAL H H 449 8.327 8.327 7.885 0.442 25932 2979 1 16 . 1 1 450 450 ILE N N 450 123.014 123.014 120.659 2.355 25932 2980 1 16 . 1 1 450 450 ILE C C 450 177.074 177.074 177.969 -0.895 25932 2981 1 16 . 1 1 450 450 ILE CA C 450 65.594 65.594 65.488 0.106 25932 2982 1 16 . 1 1 450 450 ILE CB C 450 36.594 36.594 37.982 -1.388 25932 2983 1 16 . 1 1 450 450 ILE H H 450 8.670 8.670 8.055 0.615 25932 2984 1 16 . 1 1 451 451 PHE N N 451 119.392 119.392 119.061 0.331 25932 2985 1 16 . 1 1 451 451 PHE C C 451 177.297 177.297 178.015 -0.718 25932 2986 1 16 . 1 1 451 451 PHE CA C 451 61.389 61.389 62.580 -1.190 25932 2987 1 16 . 1 1 451 451 PHE CB C 451 37.970 37.970 38.616 -0.646 25932 2988 1 16 . 1 1 451 451 PHE H H 451 8.651 8.651 8.265 0.386 25932 2989 1 16 . 1 1 452 452 LEU N N 452 118.367 118.367 119.100 -0.733 25932 2990 1 16 . 1 1 452 452 LEU C C 452 177.967 177.967 178.938 -0.971 25932 2991 1 16 . 1 1 452 452 LEU CA C 452 57.606 57.606 58.216 -0.610 25932 2992 1 16 . 1 1 452 452 LEU CB C 452 40.924 40.924 41.319 -0.395 25932 2993 1 16 . 1 1 452 452 LEU H H 452 8.731 8.731 7.902 0.829 25932 2994 1 16 . 1 1 453 453 THR N N 453 116.173 116.173 116.531 -0.358 25932 2995 1 16 . 1 1 453 453 THR C C 453 176.220 176.220 176.744 -0.524 25932 2996 1 16 . 1 1 453 453 THR CA C 453 67.919 67.919 67.207 0.712 25932 2997 1 16 . 1 1 453 453 THR CB C 453 67.006 67.006 68.636 -1.630 25932 2998 1 16 . 1 1 453 453 THR H H 453 8.104 8.104 7.984 0.120 25932 2999 1 16 . 1 1 454 454 ILE N N 454 120.077 120.077 117.704 2.373 25932 3000 1 16 . 1 1 454 454 ILE C C 454 176.915 176.915 177.158 -0.243 25932 3001 1 16 . 1 1 454 454 ILE CA C 454 65.041 65.041 64.279 0.761 25932 3002 1 16 . 1 1 454 454 ILE CB C 454 36.464 36.464 37.217 -0.753 25932 3003 1 16 . 1 1 454 454 ILE H H 454 8.043 8.043 7.802 0.241 25932 3004 1 16 . 1 1 455 455 ALA N N 455 121.174 121.174 123.797 -2.623 25932 3005 1 16 . 1 1 455 455 ALA C C 455 178.806 178.806 179.463 -0.657 25932 3006 1 16 . 1 1 455 455 ALA CA C 455 55.346 55.346 55.300 0.046 25932 3007 1 16 . 1 1 455 455 ALA CB C 455 16.890 16.890 18.075 -1.185 25932 3008 1 16 . 1 1 455 455 ALA H H 455 8.265 8.265 7.687 0.578 25932 3009 1 16 . 1 1 456 456 VAL N N 456 116.661 116.661 119.235 -2.574 25932 3010 1 16 . 1 1 456 456 VAL C C 456 177.489 177.489 178.036 -0.547 25932 3011 1 16 . 1 1 456 456 VAL CA C 456 66.494 66.494 66.143 0.351 25932 3012 1 16 . 1 1 456 456 VAL CB C 456 30.226 30.226 31.354 -1.128 25932 3013 1 16 . 1 1 456 456 VAL H H 456 8.211 8.211 7.587 0.624 25932 3014 1 16 . 1 1 457 457 LEU N N 457 119.465 119.465 120.041 -0.576 25932 3015 1 16 . 1 1 457 457 LEU C C 457 179.517 179.517 179.080 0.437 25932 3016 1 16 . 1 1 457 457 LEU CA C 457 58.056 58.056 58.505 -0.449 25932 3017 1 16 . 1 1 457 457 LEU CB C 457 40.414 40.414 41.391 -0.976 25932 3018 1 16 . 1 1 457 457 LEU H H 457 8.150 8.150 7.383 0.767 25932 3019 1 16 . 1 1 458 458 LEU N N 458 118.436 118.436 119.272 -0.836 25932 3020 1 16 . 1 1 458 458 LEU C C 458 178.891 178.891 178.993 -0.102 25932 3021 1 16 . 1 1 458 458 LEU CA C 458 57.395 57.395 58.172 -0.777 25932 3022 1 16 . 1 1 458 458 LEU CB C 458 40.484 40.484 41.285 -0.801 25932 3023 1 16 . 1 1 458 458 LEU H H 458 8.542 8.542 7.707 0.835 25932 3024 1 16 . 1 1 459 459 ALA N N 459 122.337 122.337 121.746 0.591 25932 3025 1 16 . 1 1 459 459 ALA C C 459 179.793 179.793 179.427 0.366 25932 3026 1 16 . 1 1 459 459 ALA CA C 459 55.122 55.122 55.000 0.122 25932 3027 1 16 . 1 1 459 459 ALA CB C 459 17.208 17.208 18.564 -1.356 25932 3028 1 16 . 1 1 459 459 ALA H H 459 8.401 8.401 8.001 0.400 25932 3029 1 16 . 1 1 460 460 LEU N N 460 117.961 117.961 120.668 -2.707 25932 3030 1 16 . 1 1 460 460 LEU C C 460 179.262 179.262 178.671 0.591 25932 3031 1 16 . 1 1 460 460 LEU CA C 460 57.673 57.673 58.023 -0.350 25932 3032 1 16 . 1 1 460 460 LEU CB C 460 40.414 40.414 41.466 -1.052 25932 3033 1 16 . 1 1 460 460 LEU H H 460 8.518 8.518 8.462 0.056 25932 3034 1 16 . 1 1 461 461 ARG N N 461 119.534 119.534 119.584 -0.050 25932 3035 1 16 . 1 1 461 461 ARG C C 461 178.625 178.625 178.444 0.181 25932 3036 1 16 . 1 1 461 461 ARG CA C 461 57.818 57.818 59.103 -1.285 25932 3037 1 16 . 1 1 461 461 ARG CB C 461 28.443 28.443 29.818 -1.375 25932 3038 1 16 . 1 1 461 461 ARG H H 461 8.029 8.029 7.970 0.059 25932 3039 1 16 . 1 1 462 462 PHE N N 462 118.777 118.777 121.195 -2.418 25932 3040 1 16 . 1 1 462 462 PHE C C 462 177.127 177.127 177.519 -0.392 25932 3041 1 16 . 1 1 462 462 PHE CA C 462 60.624 60.624 61.230 -0.606 25932 3042 1 16 . 1 1 462 462 PHE CB C 462 38.633 38.633 39.050 -0.417 25932 3043 1 16 . 1 1 462 462 PHE H H 462 8.460 8.460 8.032 0.428 25932 3044 1 16 . 1 1 463 463 CYS N N 463 116.386 116.386 117.505 -1.119 25932 3045 1 16 . 1 1 463 463 CYS C C 463 175.980 175.980 177.042 -1.062 25932 3046 1 16 . 1 1 463 463 CYS CA C 463 61.999 61.999 63.109 -1.110 25932 3047 1 16 . 1 1 463 463 CYS CB C 463 26.966 26.966 28.546 -1.580 25932 3048 1 16 . 1 1 463 463 CYS H H 463 8.278 8.278 8.645 -0.367 25932 3049 1 16 . 1 1 464 464 GLY N N 464 107.774 107.774 109.087 -1.313 25932 3050 1 16 . 1 1 464 464 GLY C C 464 174.990 174.990 176.211 -1.221 25932 3051 1 16 . 1 1 464 464 GLY CA C 464 45.944 45.944 47.000 -1.056 25932 3052 1 16 . 1 1 464 464 GLY H H 464 8.050 8.050 8.438 -0.388 25932 3053 1 16 . 1 1 465 465 ILE N N 465 119.940 119.940 120.574 -0.634 25932 3054 1 16 . 1 1 465 465 ILE C C 465 176.458 176.458 175.484 0.974 25932 3055 1 16 . 1 1 465 465 ILE CA C 465 62.423 62.423 61.265 1.158 25932 3056 1 16 . 1 1 465 465 ILE CB C 465 37.409 37.409 37.955 -0.546 25932 3057 1 16 . 1 1 465 465 ILE H H 465 7.745 7.745 7.875 -0.130 25932 3058 1 16 . 1 1 466 466 TYR N N 466 118.846 118.846 119.812 -0.966 25932 3059 1 16 . 1 1 466 466 TYR C C 466 176.150 176.150 176.040 0.110 25932 3060 1 16 . 1 1 466 466 TYR CA C 466 58.429 58.429 58.161 0.268 25932 3061 1 16 . 1 1 466 466 TYR CB C 466 37.917 37.917 39.896 -1.979 25932 3062 1 16 . 1 1 466 466 TYR H H 466 7.807 7.807 7.527 0.280 25932 3063 1 16 . 1 1 467 467 GLY N N 467 107.987 107.987 106.939 1.048 25932 3064 1 16 . 1 1 467 467 GLY C C 467 174.143 174.143 174.384 -0.241 25932 3065 1 16 . 1 1 467 467 GLY CA C 467 45.547 45.547 45.208 0.339 25932 3066 1 16 . 1 1 467 467 GLY H H 467 7.887 7.887 7.510 0.377 25932 3067 1 16 . 1 1 468 468 TYR N N 468 119.878 119.878 121.706 -1.828 25932 3068 1 16 . 1 1 468 468 TYR C C 468 175.524 175.524 175.576 -0.052 25932 3069 1 16 . 1 1 468 468 TYR CA C 468 58.164 58.164 60.571 -2.407 25932 3070 1 16 . 1 1 468 468 TYR CB C 468 37.786 37.786 38.934 -1.148 25932 3071 1 16 . 1 1 468 468 TYR H H 468 7.867 7.867 8.008 -0.141 25932 3072 1 16 . 1 1 469 469 ARG N N 469 121.174 121.174 120.944 0.230 25932 3073 1 16 . 1 1 469 469 ARG C C 469 175.800 175.800 175.670 0.130 25932 3074 1 16 . 1 1 469 469 ARG CA C 469 55.334 55.334 55.801 -0.467 25932 3075 1 16 . 1 1 469 469 ARG CB C 469 30.035 30.035 30.721 -0.686 25932 3076 1 16 . 1 1 469 469 ARG H H 469 7.873 7.873 8.193 -0.320 25932 3077 1 16 . 1 1 470 470 LEU N N 470 121.718 121.718 124.202 -2.484 25932 3078 1 16 . 1 1 470 470 LEU C C 470 176.618 176.618 177.535 -0.917 25932 3079 1 16 . 1 1 470 470 LEU CA C 470 54.858 54.858 55.091 -0.233 25932 3080 1 16 . 1 1 470 470 LEU CB C 470 41.331 41.331 42.360 -1.029 25932 3081 1 16 . 1 1 470 470 LEU H H 470 7.940 7.940 8.283 -0.343 25932 3082 1 16 . 1 1 471 471 ARG N N 471 120.624 120.624 121.620 -0.996 25932 3083 1 16 . 1 1 471 471 ARG CA C 471 55.308 55.308 56.487 -1.179 25932 3084 1 16 . 1 1 471 471 ARG CB C 471 30.010 30.010 29.180 0.830 25932 3085 1 16 . 1 1 471 471 ARG H H 471 7.922 7.922 8.606 -0.684 25932 3086 1 16 . 1 1 472 472 ARG C C 472 175.258 175.258 176.930 -1.672 25932 3087 1 16 . 1 1 472 472 ARG CA C 472 55.704 55.704 57.819 -2.115 25932 3088 1 16 . 1 1 472 472 ARG CB C 472 29.851 29.851 30.553 -0.702 25932 3089 1 17 . 1 1 433 433 SER C C 433 174.143 174.143 176.403 -2.260 25932 3090 1 17 . 1 1 433 433 SER CA C 433 57.715 57.715 57.552 0.163 25932 3091 1 17 . 1 1 433 433 SER CB C 433 63.602 63.602 64.251 -0.649 25932 3092 1 17 . 1 1 434 434 TRP N N 434 122.746 122.746 127.027 -4.281 25932 3093 1 17 . 1 1 434 434 TRP C C 434 175.587 175.587 177.686 -2.099 25932 3094 1 17 . 1 1 434 434 TRP CA C 434 56.604 56.604 60.084 -3.479 25932 3095 1 17 . 1 1 434 434 TRP CB C 434 29.269 29.269 29.665 -0.396 25932 3096 1 17 . 1 1 434 434 TRP H H 434 8.283 8.283 8.714 -0.431 25932 3097 1 17 . 1 1 435 435 ASP N N 435 121.374 121.374 118.302 3.072 25932 3098 1 17 . 1 1 435 435 ASP C C 435 176.543 176.543 177.961 -1.418 25932 3099 1 17 . 1 1 435 435 ASP CA C 435 53.562 53.562 56.469 -2.907 25932 3100 1 17 . 1 1 435 435 ASP CB C 435 40.854 40.854 39.872 0.982 25932 3101 1 17 . 1 1 435 435 ASP H H 435 8.219 8.219 7.998 0.221 25932 3102 1 17 . 1 1 436 436 THR N N 436 116.111 116.111 116.849 -0.738 25932 3103 1 17 . 1 1 436 436 THR C C 436 175.651 175.651 176.235 -0.584 25932 3104 1 17 . 1 1 436 436 THR CA C 436 65.015 65.015 66.567 -1.552 25932 3105 1 17 . 1 1 436 436 THR CB C 436 68.416 68.416 68.626 -0.210 25932 3106 1 17 . 1 1 436 436 THR H H 436 8.251 8.251 7.944 0.307 25932 3107 1 17 . 1 1 437 437 GLU N N 437 121.374 121.374 121.181 0.193 25932 3108 1 17 . 1 1 437 437 GLU C C 437 177.988 177.988 178.935 -0.947 25932 3109 1 17 . 1 1 437 437 GLU CA C 437 59.513 59.513 60.039 -0.526 25932 3110 1 17 . 1 1 437 437 GLU CB C 437 28.370 28.370 29.281 -0.911 25932 3111 1 17 . 1 1 437 437 GLU H H 437 8.897 8.897 7.845 1.052 25932 3112 1 17 . 1 1 438 438 SER N N 438 115.658 115.658 114.967 0.691 25932 3113 1 17 . 1 1 438 438 SER C C 438 175.832 175.832 176.685 -0.853 25932 3114 1 17 . 1 1 438 438 SER CA C 438 60.889 60.889 61.574 -0.685 25932 3115 1 17 . 1 1 438 438 SER CB C 438 62.491 62.491 62.396 0.095 25932 3116 1 17 . 1 1 438 438 SER H H 438 8.018 8.018 7.869 0.149 25932 3117 1 17 . 1 1 439 439 VAL N N 439 122.608 122.608 122.828 -0.220 25932 3118 1 17 . 1 1 439 439 VAL C C 439 177.743 177.743 177.837 -0.094 25932 3119 1 17 . 1 1 439 439 VAL CA C 439 65.861 65.861 66.579 -0.718 25932 3120 1 17 . 1 1 439 439 VAL CB C 439 30.698 30.698 31.866 -1.168 25932 3121 1 17 . 1 1 439 439 VAL H H 439 7.908 7.908 7.357 0.551 25932 3122 1 17 . 1 1 440 440 LEU N N 440 120.077 120.077 119.472 0.605 25932 3123 1 17 . 1 1 440 440 LEU C C 440 178.466 178.466 178.599 -0.133 25932 3124 1 17 . 1 1 440 440 LEU CA C 440 57.953 57.953 57.986 -0.033 25932 3125 1 17 . 1 1 440 440 LEU CB C 440 40.378 40.378 41.684 -1.306 25932 3126 1 17 . 1 1 440 440 LEU H H 440 8.171 8.171 8.462 -0.291 25932 3127 1 17 . 1 1 441 441 ALA N N 441 119.465 119.465 121.153 -1.688 25932 3128 1 17 . 1 1 441 441 ALA C C 441 178.986 178.986 179.318 -0.332 25932 3129 1 17 . 1 1 441 441 ALA CA C 441 55.122 55.122 54.644 0.478 25932 3130 1 17 . 1 1 441 441 ALA CB C 441 17.367 17.367 18.118 -0.751 25932 3131 1 17 . 1 1 441 441 ALA H H 441 8.090 8.090 7.811 0.279 25932 3132 1 17 . 1 1 442 442 MET N N 442 116.111 116.111 116.729 -0.618 25932 3133 1 17 . 1 1 442 442 MET C C 442 178.073 178.073 177.769 0.304 25932 3134 1 17 . 1 1 442 442 MET CA C 442 58.217 58.217 59.191 -0.974 25932 3135 1 17 . 1 1 442 442 MET CB C 442 31.597 31.597 32.454 -0.857 25932 3136 1 17 . 1 1 442 442 MET H H 442 7.875 7.875 7.433 0.442 25932 3137 1 17 . 1 1 443 443 TRP N N 443 119.802 119.802 117.906 1.896 25932 3138 1 17 . 1 1 443 443 TRP C C 443 178.445 178.445 177.755 0.690 25932 3139 1 17 . 1 1 443 443 TRP CA C 443 60.624 60.624 59.037 1.587 25932 3140 1 17 . 1 1 443 443 TRP CB C 443 28.899 28.899 28.332 0.567 25932 3141 1 17 . 1 1 443 443 TRP H H 443 8.196 8.196 7.352 0.844 25932 3142 1 17 . 1 1 444 444 VAL N N 444 118.509 118.509 121.704 -3.195 25932 3143 1 17 . 1 1 444 444 VAL C C 444 177.563 177.563 178.337 -0.774 25932 3144 1 17 . 1 1 444 444 VAL CA C 444 66.866 66.866 66.516 0.350 25932 3145 1 17 . 1 1 444 444 VAL CB C 444 30.221 30.221 30.747 -0.526 25932 3146 1 17 . 1 1 444 444 VAL H H 444 8.353 8.353 6.443 1.910 25932 3147 1 17 . 1 1 445 445 LEU N N 445 119.328 119.328 119.897 -0.569 25932 3148 1 17 . 1 1 445 445 LEU C C 445 178.168 178.168 179.054 -0.886 25932 3149 1 17 . 1 1 445 445 LEU CA C 445 57.979 57.979 57.793 0.186 25932 3150 1 17 . 1 1 445 445 LEU CB C 445 40.431 40.431 40.321 0.110 25932 3151 1 17 . 1 1 445 445 LEU H H 445 8.233 8.233 7.423 0.810 25932 3152 1 17 . 1 1 446 446 ALA N N 446 120.009 120.009 122.360 -2.351 25932 3153 1 17 . 1 1 446 446 ALA C C 446 179.071 179.071 179.994 -0.923 25932 3154 1 17 . 1 1 446 446 ALA CA C 446 55.096 55.096 55.225 -0.129 25932 3155 1 17 . 1 1 446 446 ALA CB C 446 16.996 16.996 18.240 -1.244 25932 3156 1 17 . 1 1 446 446 ALA H H 446 8.402 8.402 7.749 0.653 25932 3157 1 17 . 1 1 447 447 LEU N N 447 117.136 117.136 119.560 -2.424 25932 3158 1 17 . 1 1 447 447 LEU C C 447 178.678 178.678 179.208 -0.530 25932 3159 1 17 . 1 1 447 447 LEU CA C 447 57.767 57.767 57.817 -0.050 25932 3160 1 17 . 1 1 447 447 LEU CB C 447 40.378 40.378 41.861 -1.483 25932 3161 1 17 . 1 1 447 447 LEU H H 447 8.244 8.244 8.101 0.143 25932 3162 1 17 . 1 1 448 448 ILE N N 448 119.121 119.121 119.533 -0.412 25932 3163 1 17 . 1 1 448 448 ILE C C 448 177.574 177.574 178.540 -0.966 25932 3164 1 17 . 1 1 448 448 ILE CA C 448 65.702 65.702 64.279 1.423 25932 3165 1 17 . 1 1 448 448 ILE CB C 448 36.464 36.464 36.372 0.092 25932 3166 1 17 . 1 1 448 448 ILE H H 448 8.286 8.286 7.716 0.570 25932 3167 1 17 . 1 1 449 449 VAL N N 449 119.052 119.052 120.167 -1.115 25932 3168 1 17 . 1 1 449 449 VAL C C 449 179.135 179.135 178.236 0.899 25932 3169 1 17 . 1 1 449 449 VAL CA C 449 67.051 67.051 66.792 0.259 25932 3170 1 17 . 1 1 449 449 VAL CB C 449 30.175 30.175 30.985 -0.810 25932 3171 1 17 . 1 1 449 449 VAL H H 449 8.327 8.327 7.805 0.522 25932 3172 1 17 . 1 1 450 450 ILE N N 450 123.014 123.014 120.581 2.433 25932 3173 1 17 . 1 1 450 450 ILE C C 450 177.074 177.074 178.146 -1.072 25932 3174 1 17 . 1 1 450 450 ILE CA C 450 65.594 65.594 64.139 1.455 25932 3175 1 17 . 1 1 450 450 ILE CB C 450 36.594 36.594 36.553 0.041 25932 3176 1 17 . 1 1 450 450 ILE H H 450 8.670 8.670 7.716 0.954 25932 3177 1 17 . 1 1 451 451 PHE N N 451 119.392 119.392 119.207 0.185 25932 3178 1 17 . 1 1 451 451 PHE C C 451 177.297 177.297 178.309 -1.012 25932 3179 1 17 . 1 1 451 451 PHE CA C 451 61.389 61.389 62.694 -1.305 25932 3180 1 17 . 1 1 451 451 PHE CB C 451 37.970 37.970 38.064 -0.094 25932 3181 1 17 . 1 1 451 451 PHE H H 451 8.651 8.651 7.942 0.709 25932 3182 1 17 . 1 1 452 452 LEU N N 452 118.367 118.367 119.705 -1.338 25932 3183 1 17 . 1 1 452 452 LEU C C 452 177.967 177.967 179.231 -1.264 25932 3184 1 17 . 1 1 452 452 LEU CA C 452 57.606 57.606 58.357 -0.751 25932 3185 1 17 . 1 1 452 452 LEU CB C 452 40.924 40.924 41.510 -0.586 25932 3186 1 17 . 1 1 452 452 LEU H H 452 8.731 8.731 8.257 0.474 25932 3187 1 17 . 1 1 453 453 THR N N 453 116.173 116.173 116.654 -0.481 25932 3188 1 17 . 1 1 453 453 THR C C 453 176.220 176.220 176.966 -0.746 25932 3189 1 17 . 1 1 453 453 THR CA C 453 67.919 67.919 67.221 0.698 25932 3190 1 17 . 1 1 453 453 THR CB C 453 67.006 67.006 68.720 -1.714 25932 3191 1 17 . 1 1 453 453 THR H H 453 8.104 8.104 8.294 -0.190 25932 3192 1 17 . 1 1 454 454 ILE N N 454 120.077 120.077 121.356 -1.279 25932 3193 1 17 . 1 1 454 454 ILE C C 454 176.915 176.915 177.488 -0.573 25932 3194 1 17 . 1 1 454 454 ILE CA C 454 65.041 65.041 65.133 -0.092 25932 3195 1 17 . 1 1 454 454 ILE CB C 454 36.464 36.464 37.556 -1.092 25932 3196 1 17 . 1 1 454 454 ILE H H 454 8.043 8.043 8.464 -0.421 25932 3197 1 17 . 1 1 455 455 ALA N N 455 121.174 121.174 123.049 -1.875 25932 3198 1 17 . 1 1 455 455 ALA C C 455 178.806 178.806 179.625 -0.819 25932 3199 1 17 . 1 1 455 455 ALA CA C 455 55.346 55.346 55.540 -0.194 25932 3200 1 17 . 1 1 455 455 ALA CB C 455 16.890 16.890 18.082 -1.192 25932 3201 1 17 . 1 1 455 455 ALA H H 455 8.265 8.265 8.500 -0.235 25932 3202 1 17 . 1 1 456 456 VAL N N 456 116.661 116.661 119.126 -2.465 25932 3203 1 17 . 1 1 456 456 VAL C C 456 177.489 177.489 177.970 -0.481 25932 3204 1 17 . 1 1 456 456 VAL CA C 456 66.494 66.494 66.299 0.195 25932 3205 1 17 . 1 1 456 456 VAL CB C 456 30.226 30.226 31.417 -1.191 25932 3206 1 17 . 1 1 456 456 VAL H H 456 8.211 8.211 7.798 0.413 25932 3207 1 17 . 1 1 457 457 LEU N N 457 119.465 119.465 119.818 -0.353 25932 3208 1 17 . 1 1 457 457 LEU C C 457 179.517 179.517 179.138 0.379 25932 3209 1 17 . 1 1 457 457 LEU CA C 457 58.056 58.056 58.145 -0.089 25932 3210 1 17 . 1 1 457 457 LEU CB C 457 40.414 40.414 41.502 -1.088 25932 3211 1 17 . 1 1 457 457 LEU H H 457 8.150 8.150 7.453 0.697 25932 3212 1 17 . 1 1 458 458 LEU N N 458 118.436 118.436 119.195 -0.759 25932 3213 1 17 . 1 1 458 458 LEU C C 458 178.891 178.891 179.006 -0.115 25932 3214 1 17 . 1 1 458 458 LEU CA C 458 57.395 57.395 57.964 -0.569 25932 3215 1 17 . 1 1 458 458 LEU CB C 458 40.484 40.484 41.429 -0.945 25932 3216 1 17 . 1 1 458 458 LEU H H 458 8.542 8.542 8.032 0.510 25932 3217 1 17 . 1 1 459 459 ALA N N 459 122.337 122.337 121.724 0.613 25932 3218 1 17 . 1 1 459 459 ALA C C 459 179.793 179.793 179.387 0.406 25932 3219 1 17 . 1 1 459 459 ALA CA C 459 55.122 55.122 54.971 0.151 25932 3220 1 17 . 1 1 459 459 ALA CB C 459 17.208 17.208 18.533 -1.325 25932 3221 1 17 . 1 1 459 459 ALA H H 459 8.401 8.401 8.045 0.356 25932 3222 1 17 . 1 1 460 460 LEU N N 460 117.961 117.961 120.590 -2.629 25932 3223 1 17 . 1 1 460 460 LEU C C 460 179.262 179.262 178.622 0.640 25932 3224 1 17 . 1 1 460 460 LEU CA C 460 57.673 57.673 57.990 -0.317 25932 3225 1 17 . 1 1 460 460 LEU CB C 460 40.414 40.414 41.444 -1.030 25932 3226 1 17 . 1 1 460 460 LEU H H 460 8.518 8.518 8.432 0.086 25932 3227 1 17 . 1 1 461 461 ARG N N 461 119.534 119.534 119.590 -0.056 25932 3228 1 17 . 1 1 461 461 ARG C C 461 178.625 178.625 178.375 0.250 25932 3229 1 17 . 1 1 461 461 ARG CA C 461 57.818 57.818 59.076 -1.258 25932 3230 1 17 . 1 1 461 461 ARG CB C 461 28.443 28.443 29.791 -1.348 25932 3231 1 17 . 1 1 461 461 ARG H H 461 8.029 8.029 7.897 0.132 25932 3232 1 17 . 1 1 462 462 PHE N N 462 118.777 118.777 120.286 -1.509 25932 3233 1 17 . 1 1 462 462 PHE C C 462 177.127 177.127 176.416 0.711 25932 3234 1 17 . 1 1 462 462 PHE CA C 462 60.624 60.624 60.837 -0.213 25932 3235 1 17 . 1 1 462 462 PHE CB C 462 38.633 38.633 38.712 -0.079 25932 3236 1 17 . 1 1 462 462 PHE H H 462 8.460 8.460 8.018 0.442 25932 3237 1 17 . 1 1 463 463 CYS N N 463 116.386 116.386 116.768 -0.382 25932 3238 1 17 . 1 1 463 463 CYS C C 463 175.980 175.980 176.546 -0.566 25932 3239 1 17 . 1 1 463 463 CYS CA C 463 61.999 61.999 61.639 0.360 25932 3240 1 17 . 1 1 463 463 CYS CB C 463 26.966 26.966 28.279 -1.313 25932 3241 1 17 . 1 1 463 463 CYS H H 463 8.278 8.278 8.469 -0.191 25932 3242 1 17 . 1 1 464 464 GLY N N 464 107.774 107.774 108.882 -1.108 25932 3243 1 17 . 1 1 464 464 GLY C C 464 174.990 174.990 176.341 -1.351 25932 3244 1 17 . 1 1 464 464 GLY CA C 464 45.944 45.944 46.977 -1.033 25932 3245 1 17 . 1 1 464 464 GLY H H 464 8.050 8.050 8.421 -0.371 25932 3246 1 17 . 1 1 465 465 ILE N N 465 119.940 119.940 119.941 -0.001 25932 3247 1 17 . 1 1 465 465 ILE C C 465 176.458 176.458 175.704 0.754 25932 3248 1 17 . 1 1 465 465 ILE CA C 465 62.423 62.423 62.254 0.169 25932 3249 1 17 . 1 1 465 465 ILE CB C 465 37.409 37.409 38.328 -0.919 25932 3250 1 17 . 1 1 465 465 ILE H H 465 7.745 7.745 8.170 -0.425 25932 3251 1 17 . 1 1 466 466 TYR N N 466 118.846 118.846 118.452 0.394 25932 3252 1 17 . 1 1 466 466 TYR C C 466 176.150 176.150 175.957 0.193 25932 3253 1 17 . 1 1 466 466 TYR CA C 466 58.429 58.429 56.805 1.624 25932 3254 1 17 . 1 1 466 466 TYR CB C 466 37.917 37.917 38.346 -0.429 25932 3255 1 17 . 1 1 466 466 TYR H H 466 7.807 7.807 7.295 0.512 25932 3256 1 17 . 1 1 467 467 GLY N N 467 107.987 107.987 107.174 0.813 25932 3257 1 17 . 1 1 467 467 GLY C C 467 174.143 174.143 175.100 -0.957 25932 3258 1 17 . 1 1 467 467 GLY CA C 467 45.547 45.547 45.734 -0.187 25932 3259 1 17 . 1 1 467 467 GLY H H 467 7.887 7.887 7.526 0.361 25932 3260 1 17 . 1 1 468 468 TYR N N 468 119.878 119.878 120.554 -0.676 25932 3261 1 17 . 1 1 468 468 TYR C C 468 175.524 175.524 176.588 -1.064 25932 3262 1 17 . 1 1 468 468 TYR CA C 468 58.164 58.164 61.383 -3.219 25932 3263 1 17 . 1 1 468 468 TYR CB C 468 37.786 37.786 38.664 -0.878 25932 3264 1 17 . 1 1 468 468 TYR H H 468 7.867 7.867 8.282 -0.415 25932 3265 1 17 . 1 1 469 469 ARG N N 469 121.174 121.174 117.578 3.596 25932 3266 1 17 . 1 1 469 469 ARG C C 469 175.800 175.800 176.140 -0.340 25932 3267 1 17 . 1 1 469 469 ARG CA C 469 55.334 55.334 57.700 -2.366 25932 3268 1 17 . 1 1 469 469 ARG CB C 469 30.035 30.035 30.585 -0.551 25932 3269 1 17 . 1 1 469 469 ARG H H 469 7.873 7.873 8.400 -0.527 25932 3270 1 17 . 1 1 470 470 LEU N N 470 121.718 121.718 116.856 4.862 25932 3271 1 17 . 1 1 470 470 LEU C C 470 176.618 176.618 176.828 -0.210 25932 3272 1 17 . 1 1 470 470 LEU CA C 470 54.858 54.858 56.324 -1.466 25932 3273 1 17 . 1 1 470 470 LEU CB C 470 41.331 41.331 40.745 0.587 25932 3274 1 17 . 1 1 470 470 LEU H H 470 7.940 7.940 7.997 -0.057 25932 3275 1 17 . 1 1 471 471 ARG N N 471 120.624 120.624 120.930 -0.306 25932 3276 1 17 . 1 1 471 471 ARG CA C 471 55.308 55.308 55.306 0.002 25932 3277 1 17 . 1 1 471 471 ARG CB C 471 30.010 30.010 31.110 -1.100 25932 3278 1 17 . 1 1 471 471 ARG H H 471 7.922 7.922 8.208 -0.286 25932 3279 1 17 . 1 1 472 472 ARG C C 472 175.258 175.258 175.428 -0.170 25932 3280 1 17 . 1 1 472 472 ARG CA C 472 55.704 55.704 55.806 -0.102 25932 3281 1 17 . 1 1 472 472 ARG CB C 472 29.851 29.851 31.382 -1.531 25932 3282 1 18 . 1 1 433 433 SER C C 433 174.143 174.143 174.691 -0.548 25932 3283 1 18 . 1 1 433 433 SER CA C 433 57.715 57.715 59.714 -1.999 25932 3284 1 18 . 1 1 433 433 SER CB C 433 63.602 63.602 63.345 0.257 25932 3285 1 18 . 1 1 434 434 TRP N N 434 122.746 122.746 122.031 0.715 25932 3286 1 18 . 1 1 434 434 TRP C C 434 175.587 175.587 175.254 0.333 25932 3287 1 18 . 1 1 434 434 TRP CA C 434 56.604 56.604 56.462 0.142 25932 3288 1 18 . 1 1 434 434 TRP CB C 434 29.269 29.269 30.587 -1.318 25932 3289 1 18 . 1 1 434 434 TRP H H 434 8.283 8.283 7.576 0.707 25932 3290 1 18 . 1 1 435 435 ASP N N 435 121.374 121.374 122.144 -0.770 25932 3291 1 18 . 1 1 435 435 ASP C C 435 176.543 176.543 177.405 -0.862 25932 3292 1 18 . 1 1 435 435 ASP CA C 435 53.562 53.562 54.255 -0.693 25932 3293 1 18 . 1 1 435 435 ASP CB C 435 40.854 40.854 42.465 -1.611 25932 3294 1 18 . 1 1 435 435 ASP H H 435 8.219 8.219 8.556 -0.337 25932 3295 1 18 . 1 1 436 436 THR N N 436 116.111 116.111 116.016 0.095 25932 3296 1 18 . 1 1 436 436 THR C C 436 175.651 175.651 176.274 -0.623 25932 3297 1 18 . 1 1 436 436 THR CA C 436 65.015 65.015 64.972 0.043 25932 3298 1 18 . 1 1 436 436 THR CB C 436 68.416 68.416 69.195 -0.779 25932 3299 1 18 . 1 1 436 436 THR H H 436 8.251 8.251 8.421 -0.170 25932 3300 1 18 . 1 1 437 437 GLU N N 437 121.374 121.374 121.201 0.173 25932 3301 1 18 . 1 1 437 437 GLU C C 437 177.988 177.988 178.571 -0.583 25932 3302 1 18 . 1 1 437 437 GLU CA C 437 59.513 59.513 59.671 -0.158 25932 3303 1 18 . 1 1 437 437 GLU CB C 437 28.370 28.370 29.214 -0.844 25932 3304 1 18 . 1 1 437 437 GLU H H 437 8.897 8.897 8.803 0.094 25932 3305 1 18 . 1 1 438 438 SER N N 438 115.658 115.658 115.164 0.494 25932 3306 1 18 . 1 1 438 438 SER C C 438 175.832 175.832 176.846 -1.014 25932 3307 1 18 . 1 1 438 438 SER CA C 438 60.889 60.889 61.359 -0.470 25932 3308 1 18 . 1 1 438 438 SER CB C 438 62.491 62.491 63.037 -0.546 25932 3309 1 18 . 1 1 438 438 SER H H 438 8.018 8.018 7.670 0.348 25932 3310 1 18 . 1 1 439 439 VAL N N 439 122.608 122.608 121.889 0.719 25932 3311 1 18 . 1 1 439 439 VAL C C 439 177.743 177.743 178.214 -0.471 25932 3312 1 18 . 1 1 439 439 VAL CA C 439 65.861 65.861 66.552 -0.691 25932 3313 1 18 . 1 1 439 439 VAL CB C 439 30.698 30.698 31.604 -0.906 25932 3314 1 18 . 1 1 439 439 VAL H H 439 7.908 7.908 7.360 0.548 25932 3315 1 18 . 1 1 440 440 LEU N N 440 120.077 120.077 119.640 0.437 25932 3316 1 18 . 1 1 440 440 LEU C C 440 178.466 178.466 178.631 -0.165 25932 3317 1 18 . 1 1 440 440 LEU CA C 440 57.953 57.953 58.086 -0.133 25932 3318 1 18 . 1 1 440 440 LEU CB C 440 40.378 40.378 41.552 -1.174 25932 3319 1 18 . 1 1 440 440 LEU H H 440 8.171 8.171 8.327 -0.156 25932 3320 1 18 . 1 1 441 441 ALA N N 441 119.465 119.465 121.165 -1.700 25932 3321 1 18 . 1 1 441 441 ALA C C 441 178.986 178.986 179.332 -0.346 25932 3322 1 18 . 1 1 441 441 ALA CA C 441 55.122 55.122 54.637 0.485 25932 3323 1 18 . 1 1 441 441 ALA CB C 441 17.367 17.367 18.105 -0.738 25932 3324 1 18 . 1 1 441 441 ALA H H 441 8.090 8.090 7.709 0.381 25932 3325 1 18 . 1 1 442 442 MET N N 442 116.111 116.111 117.197 -1.086 25932 3326 1 18 . 1 1 442 442 MET C C 442 178.073 178.073 178.061 0.012 25932 3327 1 18 . 1 1 442 442 MET CA C 442 58.217 58.217 59.129 -0.912 25932 3328 1 18 . 1 1 442 442 MET CB C 442 31.597 31.597 32.492 -0.895 25932 3329 1 18 . 1 1 442 442 MET H H 442 7.875 7.875 7.421 0.454 25932 3330 1 18 . 1 1 443 443 TRP N N 443 119.802 119.802 118.169 1.633 25932 3331 1 18 . 1 1 443 443 TRP C C 443 178.445 178.445 177.743 0.702 25932 3332 1 18 . 1 1 443 443 TRP CA C 443 60.624 60.624 59.291 1.333 25932 3333 1 18 . 1 1 443 443 TRP CB C 443 28.899 28.899 28.361 0.538 25932 3334 1 18 . 1 1 443 443 TRP H H 443 8.196 8.196 7.456 0.740 25932 3335 1 18 . 1 1 444 444 VAL N N 444 118.509 118.509 121.539 -3.030 25932 3336 1 18 . 1 1 444 444 VAL C C 444 177.563 177.563 178.238 -0.675 25932 3337 1 18 . 1 1 444 444 VAL CA C 444 66.866 66.866 66.726 0.140 25932 3338 1 18 . 1 1 444 444 VAL CB C 444 30.221 30.221 30.649 -0.428 25932 3339 1 18 . 1 1 444 444 VAL H H 444 8.353 8.353 6.419 1.934 25932 3340 1 18 . 1 1 445 445 LEU N N 445 119.328 119.328 119.678 -0.350 25932 3341 1 18 . 1 1 445 445 LEU C C 445 178.168 178.168 178.810 -0.642 25932 3342 1 18 . 1 1 445 445 LEU CA C 445 57.979 57.979 58.028 -0.049 25932 3343 1 18 . 1 1 445 445 LEU CB C 445 40.431 40.431 41.110 -0.679 25932 3344 1 18 . 1 1 445 445 LEU H H 445 8.233 8.233 7.400 0.833 25932 3345 1 18 . 1 1 446 446 ALA N N 446 120.009 120.009 122.500 -2.491 25932 3346 1 18 . 1 1 446 446 ALA C C 446 179.071 179.071 179.718 -0.647 25932 3347 1 18 . 1 1 446 446 ALA CA C 446 55.096 55.096 55.220 -0.124 25932 3348 1 18 . 1 1 446 446 ALA CB C 446 16.996 16.996 18.273 -1.277 25932 3349 1 18 . 1 1 446 446 ALA H H 446 8.402 8.402 7.732 0.670 25932 3350 1 18 . 1 1 447 447 LEU N N 447 117.136 117.136 119.966 -2.830 25932 3351 1 18 . 1 1 447 447 LEU C C 447 178.678 178.678 179.167 -0.489 25932 3352 1 18 . 1 1 447 447 LEU CA C 447 57.767 57.767 58.329 -0.562 25932 3353 1 18 . 1 1 447 447 LEU CB C 447 40.378 40.378 41.776 -1.398 25932 3354 1 18 . 1 1 447 447 LEU H H 447 8.244 8.244 8.324 -0.080 25932 3355 1 18 . 1 1 448 448 ILE N N 448 119.121 119.121 119.820 -0.699 25932 3356 1 18 . 1 1 448 448 ILE C C 448 177.574 177.574 178.454 -0.880 25932 3357 1 18 . 1 1 448 448 ILE CA C 448 65.702 65.702 64.603 1.099 25932 3358 1 18 . 1 1 448 448 ILE CB C 448 36.464 36.464 36.672 -0.208 25932 3359 1 18 . 1 1 448 448 ILE H H 448 8.286 8.286 8.086 0.200 25932 3360 1 18 . 1 1 449 449 VAL N N 449 119.052 119.052 119.957 -0.905 25932 3361 1 18 . 1 1 449 449 VAL C C 449 179.135 179.135 178.793 0.342 25932 3362 1 18 . 1 1 449 449 VAL CA C 449 67.051 67.051 67.215 -0.164 25932 3363 1 18 . 1 1 449 449 VAL CB C 449 30.175 30.175 31.244 -1.069 25932 3364 1 18 . 1 1 449 449 VAL H H 449 8.327 8.327 7.935 0.392 25932 3365 1 18 . 1 1 450 450 ILE N N 450 123.014 123.014 121.203 1.811 25932 3366 1 18 . 1 1 450 450 ILE C C 450 177.074 177.074 177.749 -0.675 25932 3367 1 18 . 1 1 450 450 ILE CA C 450 65.594 65.594 65.459 0.135 25932 3368 1 18 . 1 1 450 450 ILE CB C 450 36.594 36.594 37.575 -0.981 25932 3369 1 18 . 1 1 450 450 ILE H H 450 8.670 8.670 7.899 0.771 25932 3370 1 18 . 1 1 451 451 PHE N N 451 119.392 119.392 118.931 0.461 25932 3371 1 18 . 1 1 451 451 PHE C C 451 177.297 177.297 178.165 -0.868 25932 3372 1 18 . 1 1 451 451 PHE CA C 451 61.389 61.389 62.379 -0.990 25932 3373 1 18 . 1 1 451 451 PHE CB C 451 37.970 37.970 38.285 -0.315 25932 3374 1 18 . 1 1 451 451 PHE H H 451 8.651 8.651 7.854 0.797 25932 3375 1 18 . 1 1 452 452 LEU N N 452 118.367 118.367 119.194 -0.827 25932 3376 1 18 . 1 1 452 452 LEU C C 452 177.967 177.967 179.504 -1.537 25932 3377 1 18 . 1 1 452 452 LEU CA C 452 57.606 57.606 58.048 -0.442 25932 3378 1 18 . 1 1 452 452 LEU CB C 452 40.924 40.924 40.647 0.277 25932 3379 1 18 . 1 1 452 452 LEU H H 452 8.731 8.731 7.893 0.838 25932 3380 1 18 . 1 1 453 453 THR N N 453 116.173 116.173 116.588 -0.415 25932 3381 1 18 . 1 1 453 453 THR C C 453 176.220 176.220 176.759 -0.539 25932 3382 1 18 . 1 1 453 453 THR CA C 453 67.919 67.919 67.222 0.697 25932 3383 1 18 . 1 1 453 453 THR CB C 453 67.006 67.006 68.799 -1.793 25932 3384 1 18 . 1 1 453 453 THR H H 453 8.104 8.104 8.085 0.019 25932 3385 1 18 . 1 1 454 454 ILE N N 454 120.077 120.077 121.382 -1.305 25932 3386 1 18 . 1 1 454 454 ILE C C 454 176.915 176.915 176.767 0.148 25932 3387 1 18 . 1 1 454 454 ILE CA C 454 65.041 65.041 64.052 0.990 25932 3388 1 18 . 1 1 454 454 ILE CB C 454 36.464 36.464 37.958 -1.494 25932 3389 1 18 . 1 1 454 454 ILE H H 454 8.043 8.043 8.407 -0.364 25932 3390 1 18 . 1 1 455 455 ALA N N 455 121.174 121.174 122.649 -1.475 25932 3391 1 18 . 1 1 455 455 ALA C C 455 178.806 178.806 179.682 -0.876 25932 3392 1 18 . 1 1 455 455 ALA CA C 455 55.346 55.346 55.465 -0.118 25932 3393 1 18 . 1 1 455 455 ALA CB C 455 16.890 16.890 18.023 -1.133 25932 3394 1 18 . 1 1 455 455 ALA H H 455 8.265 8.265 8.334 -0.069 25932 3395 1 18 . 1 1 456 456 VAL N N 456 116.661 116.661 118.706 -2.045 25932 3396 1 18 . 1 1 456 456 VAL C C 456 177.489 177.489 178.046 -0.557 25932 3397 1 18 . 1 1 456 456 VAL CA C 456 66.494 66.494 66.948 -0.454 25932 3398 1 18 . 1 1 456 456 VAL CB C 456 30.226 30.226 31.405 -1.179 25932 3399 1 18 . 1 1 456 456 VAL H H 456 8.211 8.211 7.649 0.562 25932 3400 1 18 . 1 1 457 457 LEU N N 457 119.465 119.465 120.295 -0.830 25932 3401 1 18 . 1 1 457 457 LEU C C 457 179.517 179.517 179.421 0.096 25932 3402 1 18 . 1 1 457 457 LEU CA C 457 58.056 58.056 58.043 0.013 25932 3403 1 18 . 1 1 457 457 LEU CB C 457 40.414 40.414 41.516 -1.102 25932 3404 1 18 . 1 1 457 457 LEU H H 457 8.150 8.150 7.379 0.771 25932 3405 1 18 . 1 1 458 458 LEU N N 458 118.436 118.436 119.636 -1.200 25932 3406 1 18 . 1 1 458 458 LEU C C 458 178.891 178.891 178.995 -0.104 25932 3407 1 18 . 1 1 458 458 LEU CA C 458 57.395 57.395 58.282 -0.887 25932 3408 1 18 . 1 1 458 458 LEU CB C 458 40.484 40.484 41.083 -0.599 25932 3409 1 18 . 1 1 458 458 LEU H H 458 8.542 8.542 7.870 0.672 25932 3410 1 18 . 1 1 459 459 ALA N N 459 122.337 122.337 121.629 0.708 25932 3411 1 18 . 1 1 459 459 ALA C C 459 179.793 179.793 179.508 0.285 25932 3412 1 18 . 1 1 459 459 ALA CA C 459 55.122 55.122 55.141 -0.019 25932 3413 1 18 . 1 1 459 459 ALA CB C 459 17.208 17.208 18.601 -1.393 25932 3414 1 18 . 1 1 459 459 ALA H H 459 8.401 8.401 7.936 0.465 25932 3415 1 18 . 1 1 460 460 LEU N N 460 117.961 117.961 120.618 -2.657 25932 3416 1 18 . 1 1 460 460 LEU C C 460 179.262 179.262 178.676 0.586 25932 3417 1 18 . 1 1 460 460 LEU CA C 460 57.673 57.673 57.973 -0.300 25932 3418 1 18 . 1 1 460 460 LEU CB C 460 40.414 40.414 41.484 -1.070 25932 3419 1 18 . 1 1 460 460 LEU H H 460 8.518 8.518 8.487 0.031 25932 3420 1 18 . 1 1 461 461 ARG N N 461 119.534 119.534 119.657 -0.123 25932 3421 1 18 . 1 1 461 461 ARG C C 461 178.625 178.625 178.417 0.208 25932 3422 1 18 . 1 1 461 461 ARG CA C 461 57.818 57.818 59.150 -1.332 25932 3423 1 18 . 1 1 461 461 ARG CB C 461 28.443 28.443 29.791 -1.348 25932 3424 1 18 . 1 1 461 461 ARG H H 461 8.029 8.029 8.031 -0.002 25932 3425 1 18 . 1 1 462 462 PHE N N 462 118.777 118.777 120.946 -2.169 25932 3426 1 18 . 1 1 462 462 PHE C C 462 177.127 177.127 177.085 0.042 25932 3427 1 18 . 1 1 462 462 PHE CA C 462 60.624 60.624 61.307 -0.683 25932 3428 1 18 . 1 1 462 462 PHE CB C 462 38.633 38.633 38.995 -0.362 25932 3429 1 18 . 1 1 462 462 PHE H H 462 8.460 8.460 7.878 0.582 25932 3430 1 18 . 1 1 463 463 CYS N N 463 116.386 116.386 116.589 -0.203 25932 3431 1 18 . 1 1 463 463 CYS C C 463 175.980 175.980 177.172 -1.192 25932 3432 1 18 . 1 1 463 463 CYS CA C 463 61.999 61.999 63.807 -1.808 25932 3433 1 18 . 1 1 463 463 CYS CB C 463 26.966 26.966 28.352 -1.386 25932 3434 1 18 . 1 1 463 463 CYS H H 463 8.278 8.278 8.418 -0.141 25932 3435 1 18 . 1 1 464 464 GLY N N 464 107.774 107.774 108.771 -0.997 25932 3436 1 18 . 1 1 464 464 GLY C C 464 174.990 174.990 175.487 -0.497 25932 3437 1 18 . 1 1 464 464 GLY CA C 464 45.944 45.944 46.817 -0.873 25932 3438 1 18 . 1 1 464 464 GLY H H 464 8.050 8.050 8.225 -0.175 25932 3439 1 18 . 1 1 465 465 ILE N N 465 119.940 119.940 118.709 1.231 25932 3440 1 18 . 1 1 465 465 ILE C C 465 176.458 176.458 175.608 0.850 25932 3441 1 18 . 1 1 465 465 ILE CA C 465 62.423 62.423 61.508 0.915 25932 3442 1 18 . 1 1 465 465 ILE CB C 465 37.409 37.409 38.432 -1.023 25932 3443 1 18 . 1 1 465 465 ILE H H 465 7.745 7.745 7.928 -0.183 25932 3444 1 18 . 1 1 466 466 TYR N N 466 118.846 118.846 119.878 -1.032 25932 3445 1 18 . 1 1 466 466 TYR C C 466 176.150 176.150 175.840 0.310 25932 3446 1 18 . 1 1 466 466 TYR CA C 466 58.429 58.429 57.560 0.869 25932 3447 1 18 . 1 1 466 466 TYR CB C 466 37.917 37.917 38.819 -0.902 25932 3448 1 18 . 1 1 466 466 TYR H H 466 7.807 7.807 7.193 0.614 25932 3449 1 18 . 1 1 467 467 GLY N N 467 107.987 107.987 107.031 0.956 25932 3450 1 18 . 1 1 467 467 GLY C C 467 174.143 174.143 174.324 -0.181 25932 3451 1 18 . 1 1 467 467 GLY CA C 467 45.547 45.547 44.797 0.750 25932 3452 1 18 . 1 1 467 467 GLY H H 467 7.887 7.887 7.415 0.472 25932 3453 1 18 . 1 1 468 468 TYR N N 468 119.878 119.878 118.860 1.018 25932 3454 1 18 . 1 1 468 468 TYR C C 468 175.524 175.524 174.323 1.201 25932 3455 1 18 . 1 1 468 468 TYR CA C 468 58.164 58.164 59.343 -1.179 25932 3456 1 18 . 1 1 468 468 TYR CB C 468 37.786 37.786 38.966 -1.180 25932 3457 1 18 . 1 1 468 468 TYR H H 468 7.867 7.867 8.099 -0.232 25932 3458 1 18 . 1 1 469 469 ARG N N 469 121.174 121.174 123.217 -2.043 25932 3459 1 18 . 1 1 469 469 ARG C C 469 175.800 175.800 175.069 0.731 25932 3460 1 18 . 1 1 469 469 ARG CA C 469 55.334 55.334 55.278 0.056 25932 3461 1 18 . 1 1 469 469 ARG CB C 469 30.035 30.035 30.530 -0.496 25932 3462 1 18 . 1 1 469 469 ARG H H 469 7.873 7.873 7.358 0.515 25932 3463 1 18 . 1 1 470 470 LEU N N 470 121.718 121.718 123.194 -1.476 25932 3464 1 18 . 1 1 470 470 LEU C C 470 176.618 176.618 177.633 -1.015 25932 3465 1 18 . 1 1 470 470 LEU CA C 470 54.858 54.858 53.752 1.106 25932 3466 1 18 . 1 1 470 470 LEU CB C 470 41.331 41.331 43.029 -1.698 25932 3467 1 18 . 1 1 470 470 LEU H H 470 7.940 7.940 8.400 -0.460 25932 3468 1 18 . 1 1 471 471 ARG N N 471 120.624 120.624 122.911 -2.287 25932 3469 1 18 . 1 1 471 471 ARG CA C 471 55.308 55.308 58.014 -2.706 25932 3470 1 18 . 1 1 471 471 ARG CB C 471 30.010 30.010 30.531 -0.521 25932 3471 1 18 . 1 1 471 471 ARG H H 471 7.922 7.922 8.694 -0.772 25932 3472 1 18 . 1 1 472 472 ARG C C 472 175.258 175.258 175.763 -0.505 25932 3473 1 18 . 1 1 472 472 ARG CA C 472 55.704 55.704 55.480 0.224 25932 3474 1 18 . 1 1 472 472 ARG CB C 472 29.851 29.851 31.277 -1.426 25932 3475 1 19 . 1 1 433 433 SER C C 433 174.143 174.143 173.269 0.874 25932 3476 1 19 . 1 1 433 433 SER CA C 433 57.715 57.715 57.172 0.543 25932 3477 1 19 . 1 1 433 433 SER CB C 433 63.602 63.602 64.134 -0.532 25932 3478 1 19 . 1 1 434 434 TRP N N 434 122.746 122.746 125.284 -2.538 25932 3479 1 19 . 1 1 434 434 TRP C C 434 175.587 175.587 177.271 -1.684 25932 3480 1 19 . 1 1 434 434 TRP CA C 434 56.604 56.604 55.530 1.074 25932 3481 1 19 . 1 1 434 434 TRP CB C 434 29.269 29.269 30.728 -1.459 25932 3482 1 19 . 1 1 434 434 TRP H H 434 8.283 8.283 8.267 0.016 25932 3483 1 19 . 1 1 435 435 ASP N N 435 121.374 121.374 121.215 0.159 25932 3484 1 19 . 1 1 435 435 ASP C C 435 176.543 176.543 176.801 -0.258 25932 3485 1 19 . 1 1 435 435 ASP CA C 435 53.562 53.562 54.350 -0.788 25932 3486 1 19 . 1 1 435 435 ASP CB C 435 40.854 40.854 40.330 0.525 25932 3487 1 19 . 1 1 435 435 ASP H H 435 8.219 8.219 8.857 -0.638 25932 3488 1 19 . 1 1 436 436 THR N N 436 116.111 116.111 116.437 -0.326 25932 3489 1 19 . 1 1 436 436 THR C C 436 175.651 175.651 176.209 -0.558 25932 3490 1 19 . 1 1 436 436 THR CA C 436 65.015 65.015 65.476 -0.461 25932 3491 1 19 . 1 1 436 436 THR CB C 436 68.416 68.416 68.481 -0.065 25932 3492 1 19 . 1 1 436 436 THR H H 436 8.251 8.251 8.442 -0.191 25932 3493 1 19 . 1 1 437 437 GLU N N 437 121.374 121.374 121.304 0.070 25932 3494 1 19 . 1 1 437 437 GLU C C 437 177.988 177.988 178.577 -0.589 25932 3495 1 19 . 1 1 437 437 GLU CA C 437 59.513 59.513 59.595 -0.082 25932 3496 1 19 . 1 1 437 437 GLU CB C 437 28.370 28.370 29.154 -0.783 25932 3497 1 19 . 1 1 437 437 GLU H H 437 8.897 8.897 8.029 0.868 25932 3498 1 19 . 1 1 438 438 SER N N 438 115.658 115.658 115.323 0.335 25932 3499 1 19 . 1 1 438 438 SER C C 438 175.832 175.832 176.697 -0.865 25932 3500 1 19 . 1 1 438 438 SER CA C 438 60.889 60.889 61.493 -0.604 25932 3501 1 19 . 1 1 438 438 SER CB C 438 62.491 62.491 62.872 -0.381 25932 3502 1 19 . 1 1 438 438 SER H H 438 8.018 8.018 7.607 0.411 25932 3503 1 19 . 1 1 439 439 VAL N N 439 122.608 122.608 122.093 0.515 25932 3504 1 19 . 1 1 439 439 VAL C C 439 177.743 177.743 177.801 -0.058 25932 3505 1 19 . 1 1 439 439 VAL CA C 439 65.861 65.861 66.221 -0.360 25932 3506 1 19 . 1 1 439 439 VAL CB C 439 30.698 30.698 31.710 -1.012 25932 3507 1 19 . 1 1 439 439 VAL H H 439 7.908 7.908 7.404 0.504 25932 3508 1 19 . 1 1 440 440 LEU N N 440 120.077 120.077 120.485 -0.408 25932 3509 1 19 . 1 1 440 440 LEU C C 440 178.466 178.466 178.038 0.428 25932 3510 1 19 . 1 1 440 440 LEU CA C 440 57.953 57.953 58.282 -0.329 25932 3511 1 19 . 1 1 440 440 LEU CB C 440 40.378 40.378 41.864 -1.486 25932 3512 1 19 . 1 1 440 440 LEU H H 440 8.171 8.171 8.333 -0.162 25932 3513 1 19 . 1 1 441 441 ALA N N 441 119.465 119.465 121.213 -1.748 25932 3514 1 19 . 1 1 441 441 ALA C C 441 178.986 178.986 179.560 -0.574 25932 3515 1 19 . 1 1 441 441 ALA CA C 441 55.122 55.122 54.805 0.317 25932 3516 1 19 . 1 1 441 441 ALA CB C 441 17.367 17.367 18.270 -0.903 25932 3517 1 19 . 1 1 441 441 ALA H H 441 8.090 8.090 7.832 0.258 25932 3518 1 19 . 1 1 442 442 MET N N 442 116.111 116.111 117.121 -1.010 25932 3519 1 19 . 1 1 442 442 MET C C 442 178.073 178.073 178.190 -0.117 25932 3520 1 19 . 1 1 442 442 MET CA C 442 58.217 58.217 57.730 0.487 25932 3521 1 19 . 1 1 442 442 MET CB C 442 31.597 31.597 31.776 -0.179 25932 3522 1 19 . 1 1 442 442 MET H H 442 7.875 7.875 7.538 0.337 25932 3523 1 19 . 1 1 443 443 TRP N N 443 119.802 119.802 118.926 0.876 25932 3524 1 19 . 1 1 443 443 TRP C C 443 178.445 178.445 177.886 0.559 25932 3525 1 19 . 1 1 443 443 TRP CA C 443 60.624 60.624 59.444 1.180 25932 3526 1 19 . 1 1 443 443 TRP CB C 443 28.899 28.899 28.114 0.785 25932 3527 1 19 . 1 1 443 443 TRP H H 443 8.196 8.196 7.565 0.631 25932 3528 1 19 . 1 1 444 444 VAL N N 444 118.509 118.509 121.827 -3.318 25932 3529 1 19 . 1 1 444 444 VAL C C 444 177.563 177.563 178.073 -0.510 25932 3530 1 19 . 1 1 444 444 VAL CA C 444 66.866 66.866 65.852 1.014 25932 3531 1 19 . 1 1 444 444 VAL CB C 444 30.221 30.221 30.310 -0.089 25932 3532 1 19 . 1 1 444 444 VAL H H 444 8.353 8.353 6.473 1.880 25932 3533 1 19 . 1 1 445 445 LEU N N 445 119.328 119.328 120.819 -1.491 25932 3534 1 19 . 1 1 445 445 LEU C C 445 178.168 178.168 178.286 -0.118 25932 3535 1 19 . 1 1 445 445 LEU CA C 445 57.979 57.979 57.875 0.104 25932 3536 1 19 . 1 1 445 445 LEU CB C 445 40.431 40.431 41.145 -0.714 25932 3537 1 19 . 1 1 445 445 LEU H H 445 8.233 8.233 7.387 0.846 25932 3538 1 19 . 1 1 446 446 ALA N N 446 120.009 120.009 122.105 -2.096 25932 3539 1 19 . 1 1 446 446 ALA C C 446 179.071 179.071 179.753 -0.682 25932 3540 1 19 . 1 1 446 446 ALA CA C 446 55.096 55.096 55.230 -0.134 25932 3541 1 19 . 1 1 446 446 ALA CB C 446 16.996 16.996 18.244 -1.248 25932 3542 1 19 . 1 1 446 446 ALA H H 446 8.402 8.402 7.771 0.631 25932 3543 1 19 . 1 1 447 447 LEU N N 447 117.136 117.136 119.639 -2.503 25932 3544 1 19 . 1 1 447 447 LEU C C 447 178.678 178.678 179.076 -0.398 25932 3545 1 19 . 1 1 447 447 LEU CA C 447 57.767 57.767 58.192 -0.425 25932 3546 1 19 . 1 1 447 447 LEU CB C 447 40.378 40.378 41.899 -1.521 25932 3547 1 19 . 1 1 447 447 LEU H H 447 8.244 8.244 8.294 -0.050 25932 3548 1 19 . 1 1 448 448 ILE N N 448 119.121 119.121 119.870 -0.749 25932 3549 1 19 . 1 1 448 448 ILE C C 448 177.574 177.574 178.122 -0.548 25932 3550 1 19 . 1 1 448 448 ILE CA C 448 65.702 65.702 65.855 -0.153 25932 3551 1 19 . 1 1 448 448 ILE CB C 448 36.464 36.464 37.737 -1.273 25932 3552 1 19 . 1 1 448 448 ILE H H 448 8.286 8.286 7.996 0.290 25932 3553 1 19 . 1 1 449 449 VAL N N 449 119.052 119.052 119.829 -0.777 25932 3554 1 19 . 1 1 449 449 VAL C C 449 179.135 179.135 177.929 1.206 25932 3555 1 19 . 1 1 449 449 VAL CA C 449 67.051 67.051 67.011 0.040 25932 3556 1 19 . 1 1 449 449 VAL CB C 449 30.175 30.175 31.321 -1.146 25932 3557 1 19 . 1 1 449 449 VAL H H 449 8.327 8.327 7.740 0.587 25932 3558 1 19 . 1 1 450 450 ILE N N 450 123.014 123.014 120.719 2.295 25932 3559 1 19 . 1 1 450 450 ILE C C 450 177.074 177.074 177.724 -0.650 25932 3560 1 19 . 1 1 450 450 ILE CA C 450 65.594 65.594 65.444 0.150 25932 3561 1 19 . 1 1 450 450 ILE CB C 450 36.594 36.594 37.569 -0.975 25932 3562 1 19 . 1 1 450 450 ILE H H 450 8.670 8.670 7.588 1.082 25932 3563 1 19 . 1 1 451 451 PHE N N 451 119.392 119.392 118.809 0.583 25932 3564 1 19 . 1 1 451 451 PHE C C 451 177.297 177.297 178.061 -0.764 25932 3565 1 19 . 1 1 451 451 PHE CA C 451 61.389 61.389 62.578 -1.189 25932 3566 1 19 . 1 1 451 451 PHE CB C 451 37.970 37.970 38.317 -0.347 25932 3567 1 19 . 1 1 451 451 PHE H H 451 8.651 8.651 7.807 0.844 25932 3568 1 19 . 1 1 452 452 LEU N N 452 118.367 118.367 119.599 -1.232 25932 3569 1 19 . 1 1 452 452 LEU C C 452 177.967 177.967 179.204 -1.237 25932 3570 1 19 . 1 1 452 452 LEU CA C 452 57.606 57.606 58.224 -0.618 25932 3571 1 19 . 1 1 452 452 LEU CB C 452 40.924 40.924 41.511 -0.587 25932 3572 1 19 . 1 1 452 452 LEU H H 452 8.731 8.731 8.043 0.688 25932 3573 1 19 . 1 1 453 453 THR N N 453 116.173 116.173 115.897 0.276 25932 3574 1 19 . 1 1 453 453 THR C C 453 176.220 176.220 176.768 -0.548 25932 3575 1 19 . 1 1 453 453 THR CA C 453 67.919 67.919 66.373 1.546 25932 3576 1 19 . 1 1 453 453 THR CB C 453 67.006 67.006 68.446 -1.440 25932 3577 1 19 . 1 1 453 453 THR H H 453 8.104 8.104 8.426 -0.322 25932 3578 1 19 . 1 1 454 454 ILE N N 454 120.077 120.077 121.283 -1.206 25932 3579 1 19 . 1 1 454 454 ILE C C 454 176.915 176.915 176.729 0.186 25932 3580 1 19 . 1 1 454 454 ILE CA C 454 65.041 65.041 64.165 0.876 25932 3581 1 19 . 1 1 454 454 ILE CB C 454 36.464 36.464 37.706 -1.242 25932 3582 1 19 . 1 1 454 454 ILE H H 454 8.043 8.043 8.257 -0.214 25932 3583 1 19 . 1 1 455 455 ALA N N 455 121.174 121.174 122.863 -1.689 25932 3584 1 19 . 1 1 455 455 ALA C C 455 178.806 178.806 179.696 -0.890 25932 3585 1 19 . 1 1 455 455 ALA CA C 455 55.346 55.346 55.498 -0.152 25932 3586 1 19 . 1 1 455 455 ALA CB C 455 16.890 16.890 18.028 -1.138 25932 3587 1 19 . 1 1 455 455 ALA H H 455 8.265 8.265 8.368 -0.103 25932 3588 1 19 . 1 1 456 456 VAL N N 456 116.661 116.661 118.703 -2.042 25932 3589 1 19 . 1 1 456 456 VAL C C 456 177.489 177.489 178.097 -0.608 25932 3590 1 19 . 1 1 456 456 VAL CA C 456 66.494 66.494 66.826 -0.332 25932 3591 1 19 . 1 1 456 456 VAL CB C 456 30.226 30.226 31.275 -1.049 25932 3592 1 19 . 1 1 456 456 VAL H H 456 8.211 8.211 7.763 0.448 25932 3593 1 19 . 1 1 457 457 LEU N N 457 119.465 119.465 120.267 -0.802 25932 3594 1 19 . 1 1 457 457 LEU C C 457 179.517 179.517 179.443 0.074 25932 3595 1 19 . 1 1 457 457 LEU CA C 457 58.056 58.056 58.063 -0.007 25932 3596 1 19 . 1 1 457 457 LEU CB C 457 40.414 40.414 41.514 -1.100 25932 3597 1 19 . 1 1 457 457 LEU H H 457 8.150 8.150 7.413 0.737 25932 3598 1 19 . 1 1 458 458 LEU N N 458 118.436 118.436 119.676 -1.240 25932 3599 1 19 . 1 1 458 458 LEU C C 458 178.891 178.891 179.004 -0.113 25932 3600 1 19 . 1 1 458 458 LEU CA C 458 57.395 57.395 58.277 -0.882 25932 3601 1 19 . 1 1 458 458 LEU CB C 458 40.484 40.484 41.078 -0.594 25932 3602 1 19 . 1 1 458 458 LEU H H 458 8.542 8.542 7.936 0.606 25932 3603 1 19 . 1 1 459 459 ALA N N 459 122.337 122.337 121.668 0.669 25932 3604 1 19 . 1 1 459 459 ALA C C 459 179.793 179.793 179.502 0.291 25932 3605 1 19 . 1 1 459 459 ALA CA C 459 55.122 55.122 55.145 -0.022 25932 3606 1 19 . 1 1 459 459 ALA CB C 459 17.208 17.208 18.593 -1.385 25932 3607 1 19 . 1 1 459 459 ALA H H 459 8.401 8.401 7.975 0.426 25932 3608 1 19 . 1 1 460 460 LEU N N 460 117.961 117.961 120.581 -2.620 25932 3609 1 19 . 1 1 460 460 LEU C C 460 179.262 179.262 178.685 0.577 25932 3610 1 19 . 1 1 460 460 LEU CA C 460 57.673 57.673 57.976 -0.303 25932 3611 1 19 . 1 1 460 460 LEU CB C 460 40.414 40.414 41.495 -1.081 25932 3612 1 19 . 1 1 460 460 LEU H H 460 8.518 8.518 8.466 0.052 25932 3613 1 19 . 1 1 461 461 ARG N N 461 119.534 119.534 119.642 -0.108 25932 3614 1 19 . 1 1 461 461 ARG C C 461 178.625 178.625 178.434 0.191 25932 3615 1 19 . 1 1 461 461 ARG CA C 461 57.818 57.818 59.149 -1.331 25932 3616 1 19 . 1 1 461 461 ARG CB C 461 28.443 28.443 29.811 -1.368 25932 3617 1 19 . 1 1 461 461 ARG H H 461 8.029 8.029 8.021 0.008 25932 3618 1 19 . 1 1 462 462 PHE N N 462 118.777 118.777 121.046 -2.269 25932 3619 1 19 . 1 1 462 462 PHE C C 462 177.127 177.127 177.204 -0.077 25932 3620 1 19 . 1 1 462 462 PHE CA C 462 60.624 60.624 61.411 -0.787 25932 3621 1 19 . 1 1 462 462 PHE CB C 462 38.633 38.633 39.002 -0.369 25932 3622 1 19 . 1 1 462 462 PHE H H 462 8.460 8.460 7.922 0.538 25932 3623 1 19 . 1 1 463 463 CYS N N 463 116.386 116.386 116.608 -0.222 25932 3624 1 19 . 1 1 463 463 CYS C C 463 175.980 175.980 177.230 -1.250 25932 3625 1 19 . 1 1 463 463 CYS CA C 463 61.999 61.999 63.492 -1.493 25932 3626 1 19 . 1 1 463 463 CYS CB C 463 26.966 26.966 27.921 -0.955 25932 3627 1 19 . 1 1 463 463 CYS H H 463 8.278 8.278 8.441 -0.163 25932 3628 1 19 . 1 1 464 464 GLY N N 464 107.774 107.774 109.045 -1.271 25932 3629 1 19 . 1 1 464 464 GLY C C 464 174.990 174.990 175.585 -0.595 25932 3630 1 19 . 1 1 464 464 GLY CA C 464 45.944 45.944 46.879 -0.935 25932 3631 1 19 . 1 1 464 464 GLY H H 464 8.050 8.050 8.252 -0.202 25932 3632 1 19 . 1 1 465 465 ILE N N 465 119.940 119.940 118.547 1.393 25932 3633 1 19 . 1 1 465 465 ILE C C 465 176.458 176.458 175.664 0.794 25932 3634 1 19 . 1 1 465 465 ILE CA C 465 62.423 62.423 61.670 0.752 25932 3635 1 19 . 1 1 465 465 ILE CB C 465 37.409 37.409 38.376 -0.967 25932 3636 1 19 . 1 1 465 465 ILE H H 465 7.745 7.745 7.938 -0.193 25932 3637 1 19 . 1 1 466 466 TYR N N 466 118.846 118.846 118.806 0.040 25932 3638 1 19 . 1 1 466 466 TYR C C 466 176.150 176.150 175.751 0.399 25932 3639 1 19 . 1 1 466 466 TYR CA C 466 58.429 58.429 57.779 0.650 25932 3640 1 19 . 1 1 466 466 TYR CB C 466 37.917 37.917 38.726 -0.809 25932 3641 1 19 . 1 1 466 466 TYR H H 466 7.807 7.807 7.177 0.630 25932 3642 1 19 . 1 1 467 467 GLY N N 467 107.987 107.987 106.915 1.072 25932 3643 1 19 . 1 1 467 467 GLY C C 467 174.143 174.143 174.674 -0.531 25932 3644 1 19 . 1 1 467 467 GLY CA C 467 45.547 45.547 45.107 0.440 25932 3645 1 19 . 1 1 467 467 GLY H H 467 7.887 7.887 7.492 0.395 25932 3646 1 19 . 1 1 468 468 TYR N N 468 119.878 119.878 118.549 1.329 25932 3647 1 19 . 1 1 468 468 TYR C C 468 175.524 175.524 174.317 1.207 25932 3648 1 19 . 1 1 468 468 TYR CA C 468 58.164 58.164 59.484 -1.320 25932 3649 1 19 . 1 1 468 468 TYR CB C 468 37.786 37.786 38.958 -1.172 25932 3650 1 19 . 1 1 468 468 TYR H H 468 7.867 7.867 8.269 -0.402 25932 3651 1 19 . 1 1 469 469 ARG N N 469 121.174 121.174 122.358 -1.184 25932 3652 1 19 . 1 1 469 469 ARG C C 469 175.800 175.800 175.010 0.790 25932 3653 1 19 . 1 1 469 469 ARG CA C 469 55.334 55.334 55.272 0.062 25932 3654 1 19 . 1 1 469 469 ARG CB C 469 30.035 30.035 30.430 -0.395 25932 3655 1 19 . 1 1 469 469 ARG H H 469 7.873 7.873 7.158 0.715 25932 3656 1 19 . 1 1 470 470 LEU N N 470 121.718 121.718 122.773 -1.055 25932 3657 1 19 . 1 1 470 470 LEU C C 470 176.618 176.618 177.069 -0.451 25932 3658 1 19 . 1 1 470 470 LEU CA C 470 54.858 54.858 54.091 0.767 25932 3659 1 19 . 1 1 470 470 LEU CB C 470 41.331 41.331 43.314 -1.983 25932 3660 1 19 . 1 1 470 470 LEU H H 470 7.940 7.940 8.366 -0.426 25932 3661 1 19 . 1 1 471 471 ARG N N 471 120.624 120.624 123.307 -2.683 25932 3662 1 19 . 1 1 471 471 ARG CA C 471 55.308 55.308 58.818 -3.510 25932 3663 1 19 . 1 1 471 471 ARG CB C 471 30.010 30.010 30.490 -0.480 25932 3664 1 19 . 1 1 471 471 ARG H H 471 7.922 7.922 8.663 -0.741 25932 3665 1 19 . 1 1 472 472 ARG C C 472 175.258 175.258 177.072 -1.814 25932 3666 1 19 . 1 1 472 472 ARG CA C 472 55.704 55.704 57.826 -2.122 25932 3667 1 19 . 1 1 472 472 ARG CB C 472 29.851 29.851 30.503 -0.652 25932 3668 1 20 . 1 1 433 433 SER C C 433 174.143 174.143 173.848 0.295 25932 3669 1 20 . 1 1 433 433 SER CA C 433 57.715 57.715 58.606 -0.891 25932 3670 1 20 . 1 1 433 433 SER CB C 433 63.602 63.602 63.837 -0.235 25932 3671 1 20 . 1 1 434 434 TRP N N 434 122.746 122.746 123.240 -0.494 25932 3672 1 20 . 1 1 434 434 TRP C C 434 175.587 175.587 176.369 -0.782 25932 3673 1 20 . 1 1 434 434 TRP CA C 434 56.604 56.604 55.794 0.810 25932 3674 1 20 . 1 1 434 434 TRP CB C 434 29.269 29.269 29.915 -0.645 25932 3675 1 20 . 1 1 434 434 TRP H H 434 8.283 8.283 8.287 -0.004 25932 3676 1 20 . 1 1 435 435 ASP N N 435 121.374 121.374 122.607 -1.233 25932 3677 1 20 . 1 1 435 435 ASP C C 435 176.543 176.543 177.585 -1.042 25932 3678 1 20 . 1 1 435 435 ASP CA C 435 53.562 53.562 54.160 -0.598 25932 3679 1 20 . 1 1 435 435 ASP CB C 435 40.854 40.854 42.474 -1.620 25932 3680 1 20 . 1 1 435 435 ASP H H 435 8.219 8.219 8.350 -0.131 25932 3681 1 20 . 1 1 436 436 THR N N 436 116.111 116.111 115.905 0.206 25932 3682 1 20 . 1 1 436 436 THR C C 436 175.651 175.651 176.327 -0.676 25932 3683 1 20 . 1 1 436 436 THR CA C 436 65.015 65.015 64.852 0.163 25932 3684 1 20 . 1 1 436 436 THR CB C 436 68.416 68.416 69.254 -0.838 25932 3685 1 20 . 1 1 436 436 THR H H 436 8.251 8.251 8.471 -0.220 25932 3686 1 20 . 1 1 437 437 GLU N N 437 121.374 121.374 121.487 -0.113 25932 3687 1 20 . 1 1 437 437 GLU C C 437 177.988 177.988 178.825 -0.837 25932 3688 1 20 . 1 1 437 437 GLU CA C 437 59.513 59.513 59.550 -0.037 25932 3689 1 20 . 1 1 437 437 GLU CB C 437 28.370 28.370 29.181 -0.811 25932 3690 1 20 . 1 1 437 437 GLU H H 437 8.897 8.897 8.843 0.054 25932 3691 1 20 . 1 1 438 438 SER N N 438 115.658 115.658 115.256 0.402 25932 3692 1 20 . 1 1 438 438 SER C C 438 175.832 175.832 176.673 -0.841 25932 3693 1 20 . 1 1 438 438 SER CA C 438 60.889 60.889 61.453 -0.563 25932 3694 1 20 . 1 1 438 438 SER CB C 438 62.491 62.491 62.867 -0.376 25932 3695 1 20 . 1 1 438 438 SER H H 438 8.018 8.018 7.667 0.351 25932 3696 1 20 . 1 1 439 439 VAL N N 439 122.608 122.608 122.035 0.573 25932 3697 1 20 . 1 1 439 439 VAL C C 439 177.743 177.743 178.046 -0.303 25932 3698 1 20 . 1 1 439 439 VAL CA C 439 65.861 65.861 65.962 -0.101 25932 3699 1 20 . 1 1 439 439 VAL CB C 439 30.698 30.698 31.635 -0.937 25932 3700 1 20 . 1 1 439 439 VAL H H 439 7.908 7.908 7.430 0.478 25932 3701 1 20 . 1 1 440 440 LEU N N 440 120.077 120.077 120.697 -0.620 25932 3702 1 20 . 1 1 440 440 LEU C C 440 178.466 178.466 178.066 0.400 25932 3703 1 20 . 1 1 440 440 LEU CA C 440 57.953 57.953 58.231 -0.278 25932 3704 1 20 . 1 1 440 440 LEU CB C 440 40.378 40.378 41.754 -1.376 25932 3705 1 20 . 1 1 440 440 LEU H H 440 8.171 8.171 8.309 -0.138 25932 3706 1 20 . 1 1 441 441 ALA N N 441 119.465 119.465 121.197 -1.732 25932 3707 1 20 . 1 1 441 441 ALA C C 441 178.986 178.986 179.590 -0.604 25932 3708 1 20 . 1 1 441 441 ALA CA C 441 55.122 55.122 54.829 0.293 25932 3709 1 20 . 1 1 441 441 ALA CB C 441 17.367 17.367 18.223 -0.855 25932 3710 1 20 . 1 1 441 441 ALA H H 441 8.090 8.090 7.745 0.345 25932 3711 1 20 . 1 1 442 442 MET N N 442 116.111 116.111 116.818 -0.707 25932 3712 1 20 . 1 1 442 442 MET C C 442 178.073 178.073 178.231 -0.158 25932 3713 1 20 . 1 1 442 442 MET CA C 442 58.217 58.217 57.574 0.643 25932 3714 1 20 . 1 1 442 442 MET CB C 442 31.597 31.597 31.584 0.013 25932 3715 1 20 . 1 1 442 442 MET H H 442 7.875 7.875 7.458 0.417 25932 3716 1 20 . 1 1 443 443 TRP N N 443 119.802 119.802 119.002 0.800 25932 3717 1 20 . 1 1 443 443 TRP C C 443 178.445 178.445 177.977 0.468 25932 3718 1 20 . 1 1 443 443 TRP CA C 443 60.624 60.624 59.222 1.402 25932 3719 1 20 . 1 1 443 443 TRP CB C 443 28.899 28.899 28.228 0.671 25932 3720 1 20 . 1 1 443 443 TRP H H 443 8.196 8.196 7.512 0.684 25932 3721 1 20 . 1 1 444 444 VAL N N 444 118.509 118.509 122.114 -3.605 25932 3722 1 20 . 1 1 444 444 VAL C C 444 177.563 177.563 177.277 0.286 25932 3723 1 20 . 1 1 444 444 VAL CA C 444 66.866 66.866 65.245 1.621 25932 3724 1 20 . 1 1 444 444 VAL CB C 444 30.221 30.221 30.715 -0.494 25932 3725 1 20 . 1 1 444 444 VAL H H 444 8.353 8.353 6.155 2.198 25932 3726 1 20 . 1 1 445 445 LEU N N 445 119.328 119.328 120.514 -1.186 25932 3727 1 20 . 1 1 445 445 LEU C C 445 178.168 178.168 178.144 0.024 25932 3728 1 20 . 1 1 445 445 LEU CA C 445 57.979 57.979 57.806 0.173 25932 3729 1 20 . 1 1 445 445 LEU CB C 445 40.431 40.431 41.052 -0.621 25932 3730 1 20 . 1 1 445 445 LEU H H 445 8.233 8.233 7.249 0.984 25932 3731 1 20 . 1 1 446 446 ALA N N 446 120.009 120.009 122.056 -2.047 25932 3732 1 20 . 1 1 446 446 ALA C C 446 179.071 179.071 179.762 -0.691 25932 3733 1 20 . 1 1 446 446 ALA CA C 446 55.096 55.096 55.234 -0.138 25932 3734 1 20 . 1 1 446 446 ALA CB C 446 16.996 16.996 18.232 -1.236 25932 3735 1 20 . 1 1 446 446 ALA H H 446 8.402 8.402 7.679 0.723 25932 3736 1 20 . 1 1 447 447 LEU N N 447 117.136 117.136 119.935 -2.799 25932 3737 1 20 . 1 1 447 447 LEU C C 447 178.678 178.678 179.163 -0.485 25932 3738 1 20 . 1 1 447 447 LEU CA C 447 57.767 57.767 58.379 -0.612 25932 3739 1 20 . 1 1 447 447 LEU CB C 447 40.378 40.378 41.733 -1.355 25932 3740 1 20 . 1 1 447 447 LEU H H 447 8.244 8.244 8.160 0.084 25932 3741 1 20 . 1 1 448 448 ILE N N 448 119.121 119.121 119.364 -0.243 25932 3742 1 20 . 1 1 448 448 ILE C C 448 177.574 177.574 178.445 -0.871 25932 3743 1 20 . 1 1 448 448 ILE CA C 448 65.702 65.702 64.247 1.455 25932 3744 1 20 . 1 1 448 448 ILE CB C 448 36.464 36.464 36.709 -0.245 25932 3745 1 20 . 1 1 448 448 ILE H H 448 8.286 8.286 7.816 0.470 25932 3746 1 20 . 1 1 449 449 VAL N N 449 119.052 119.052 120.272 -1.220 25932 3747 1 20 . 1 1 449 449 VAL C C 449 179.135 179.135 178.375 0.760 25932 3748 1 20 . 1 1 449 449 VAL CA C 449 67.051 67.051 67.216 -0.165 25932 3749 1 20 . 1 1 449 449 VAL CB C 449 30.175 30.175 31.770 -1.595 25932 3750 1 20 . 1 1 449 449 VAL H H 449 8.327 8.327 7.704 0.623 25932 3751 1 20 . 1 1 450 450 ILE N N 450 123.014 123.014 120.713 2.301 25932 3752 1 20 . 1 1 450 450 ILE C C 450 177.074 177.074 178.005 -0.931 25932 3753 1 20 . 1 1 450 450 ILE CA C 450 65.594 65.594 65.504 0.090 25932 3754 1 20 . 1 1 450 450 ILE CB C 450 36.594 36.594 37.941 -1.347 25932 3755 1 20 . 1 1 450 450 ILE H H 450 8.670 8.670 7.839 0.831 25932 3756 1 20 . 1 1 451 451 PHE N N 451 119.392 119.392 119.135 0.257 25932 3757 1 20 . 1 1 451 451 PHE C C 451 177.297 177.297 177.999 -0.702 25932 3758 1 20 . 1 1 451 451 PHE CA C 451 61.389 61.389 62.495 -1.106 25932 3759 1 20 . 1 1 451 451 PHE CB C 451 37.970 37.970 38.443 -0.473 25932 3760 1 20 . 1 1 451 451 PHE H H 451 8.651 8.651 8.176 0.475 25932 3761 1 20 . 1 1 452 452 LEU N N 452 118.367 118.367 119.515 -1.148 25932 3762 1 20 . 1 1 452 452 LEU C C 452 177.967 177.967 179.033 -1.066 25932 3763 1 20 . 1 1 452 452 LEU CA C 452 57.606 57.606 58.293 -0.687 25932 3764 1 20 . 1 1 452 452 LEU CB C 452 40.924 40.924 41.367 -0.443 25932 3765 1 20 . 1 1 452 452 LEU H H 452 8.731 8.731 7.917 0.814 25932 3766 1 20 . 1 1 453 453 THR N N 453 116.173 116.173 116.384 -0.211 25932 3767 1 20 . 1 1 453 453 THR C C 453 176.220 176.220 176.782 -0.562 25932 3768 1 20 . 1 1 453 453 THR CA C 453 67.919 67.919 67.676 0.243 25932 3769 1 20 . 1 1 453 453 THR CB C 453 67.006 67.006 68.763 -1.757 25932 3770 1 20 . 1 1 453 453 THR H H 453 8.104 8.104 8.083 0.021 25932 3771 1 20 . 1 1 454 454 ILE N N 454 120.077 120.077 121.071 -0.994 25932 3772 1 20 . 1 1 454 454 ILE C C 454 176.915 176.915 176.625 0.290 25932 3773 1 20 . 1 1 454 454 ILE CA C 454 65.041 65.041 63.911 1.130 25932 3774 1 20 . 1 1 454 454 ILE CB C 454 36.464 36.464 37.853 -1.389 25932 3775 1 20 . 1 1 454 454 ILE H H 454 8.043 8.043 8.138 -0.095 25932 3776 1 20 . 1 1 455 455 ALA N N 455 121.174 121.174 122.788 -1.614 25932 3777 1 20 . 1 1 455 455 ALA C C 455 178.806 178.806 179.635 -0.829 25932 3778 1 20 . 1 1 455 455 ALA CA C 455 55.346 55.346 55.401 -0.055 25932 3779 1 20 . 1 1 455 455 ALA CB C 455 16.890 16.890 17.961 -1.071 25932 3780 1 20 . 1 1 455 455 ALA H H 455 8.265 8.265 8.167 0.098 25932 3781 1 20 . 1 1 456 456 VAL N N 456 116.661 116.661 119.254 -2.593 25932 3782 1 20 . 1 1 456 456 VAL C C 456 177.489 177.489 178.095 -0.606 25932 3783 1 20 . 1 1 456 456 VAL CA C 456 66.494 66.494 66.722 -0.228 25932 3784 1 20 . 1 1 456 456 VAL CB C 456 30.226 30.226 31.211 -0.985 25932 3785 1 20 . 1 1 456 456 VAL H H 456 8.211 8.211 7.672 0.539 25932 3786 1 20 . 1 1 457 457 LEU N N 457 119.465 119.465 120.318 -0.853 25932 3787 1 20 . 1 1 457 457 LEU C C 457 179.517 179.517 179.642 -0.125 25932 3788 1 20 . 1 1 457 457 LEU CA C 457 58.056 58.056 58.103 -0.047 25932 3789 1 20 . 1 1 457 457 LEU CB C 457 40.414 40.414 40.599 -0.185 25932 3790 1 20 . 1 1 457 457 LEU H H 457 8.150 8.150 7.369 0.781 25932 3791 1 20 . 1 1 458 458 LEU N N 458 118.436 118.436 120.006 -1.570 25932 3792 1 20 . 1 1 458 458 LEU C C 458 178.891 178.891 179.024 -0.133 25932 3793 1 20 . 1 1 458 458 LEU CA C 458 57.395 57.395 58.376 -0.981 25932 3794 1 20 . 1 1 458 458 LEU CB C 458 40.484 40.484 40.951 -0.467 25932 3795 1 20 . 1 1 458 458 LEU H H 458 8.542 8.542 7.859 0.683 25932 3796 1 20 . 1 1 459 459 ALA N N 459 122.337 122.337 121.707 0.630 25932 3797 1 20 . 1 1 459 459 ALA C C 459 179.793 179.793 179.458 0.335 25932 3798 1 20 . 1 1 459 459 ALA CA C 459 55.122 55.122 55.103 0.019 25932 3799 1 20 . 1 1 459 459 ALA CB C 459 17.208 17.208 18.533 -1.325 25932 3800 1 20 . 1 1 459 459 ALA H H 459 8.401 8.401 7.982 0.419 25932 3801 1 20 . 1 1 460 460 LEU N N 460 117.961 117.961 120.630 -2.669 25932 3802 1 20 . 1 1 460 460 LEU C C 460 179.262 179.262 178.678 0.584 25932 3803 1 20 . 1 1 460 460 LEU CA C 460 57.673 57.673 58.004 -0.331 25932 3804 1 20 . 1 1 460 460 LEU CB C 460 40.414 40.414 41.470 -1.056 25932 3805 1 20 . 1 1 460 460 LEU H H 460 8.518 8.518 8.450 0.068 25932 3806 1 20 . 1 1 461 461 ARG N N 461 119.534 119.534 119.568 -0.034 25932 3807 1 20 . 1 1 461 461 ARG C C 461 178.625 178.625 178.439 0.186 25932 3808 1 20 . 1 1 461 461 ARG CA C 461 57.818 57.818 59.121 -1.303 25932 3809 1 20 . 1 1 461 461 ARG CB C 461 28.443 28.443 29.816 -1.373 25932 3810 1 20 . 1 1 461 461 ARG H H 461 8.029 8.029 7.969 0.060 25932 3811 1 20 . 1 1 462 462 PHE N N 462 118.777 118.777 120.002 -1.225 25932 3812 1 20 . 1 1 462 462 PHE C C 462 177.127 177.127 176.624 0.503 25932 3813 1 20 . 1 1 462 462 PHE CA C 462 60.624 60.624 60.986 -0.362 25932 3814 1 20 . 1 1 462 462 PHE CB C 462 38.633 38.633 38.896 -0.263 25932 3815 1 20 . 1 1 462 462 PHE H H 462 8.460 8.460 7.997 0.463 25932 3816 1 20 . 1 1 463 463 CYS N N 463 116.386 116.386 116.966 -0.580 25932 3817 1 20 . 1 1 463 463 CYS C C 463 175.980 175.980 176.593 -0.613 25932 3818 1 20 . 1 1 463 463 CYS CA C 463 61.999 61.999 62.420 -0.421 25932 3819 1 20 . 1 1 463 463 CYS CB C 463 26.966 26.966 28.805 -1.839 25932 3820 1 20 . 1 1 463 463 CYS H H 463 8.278 8.278 8.596 -0.318 25932 3821 1 20 . 1 1 464 464 GLY N N 464 107.774 107.774 109.108 -1.334 25932 3822 1 20 . 1 1 464 464 GLY C C 464 174.990 174.990 176.162 -1.172 25932 3823 1 20 . 1 1 464 464 GLY CA C 464 45.944 45.944 46.999 -1.055 25932 3824 1 20 . 1 1 464 464 GLY H H 464 8.050 8.050 8.358 -0.308 25932 3825 1 20 . 1 1 465 465 ILE N N 465 119.940 119.940 120.586 -0.646 25932 3826 1 20 . 1 1 465 465 ILE C C 465 176.458 176.458 175.413 1.045 25932 3827 1 20 . 1 1 465 465 ILE CA C 465 62.423 62.423 61.865 0.558 25932 3828 1 20 . 1 1 465 465 ILE CB C 465 37.409 37.409 38.153 -0.744 25932 3829 1 20 . 1 1 465 465 ILE H H 465 7.745 7.745 8.019 -0.274 25932 3830 1 20 . 1 1 466 466 TYR N N 466 118.846 118.846 120.521 -1.675 25932 3831 1 20 . 1 1 466 466 TYR C C 466 176.150 176.150 175.921 0.229 25932 3832 1 20 . 1 1 466 466 TYR CA C 466 58.429 58.429 58.034 0.395 25932 3833 1 20 . 1 1 466 466 TYR CB C 466 37.917 37.917 39.209 -1.292 25932 3834 1 20 . 1 1 466 466 TYR H H 466 7.807 7.807 7.634 0.173 25932 3835 1 20 . 1 1 467 467 GLY N N 467 107.987 107.987 107.065 0.922 25932 3836 1 20 . 1 1 467 467 GLY C C 467 174.143 174.143 173.354 0.789 25932 3837 1 20 . 1 1 467 467 GLY CA C 467 45.547 45.547 45.034 0.513 25932 3838 1 20 . 1 1 467 467 GLY H H 467 7.887 7.887 7.404 0.483 25932 3839 1 20 . 1 1 468 468 TYR N N 468 119.878 119.878 121.777 -1.899 25932 3840 1 20 . 1 1 468 468 TYR C C 468 175.524 175.524 175.383 0.141 25932 3841 1 20 . 1 1 468 468 TYR CA C 468 58.164 58.164 58.005 0.159 25932 3842 1 20 . 1 1 468 468 TYR CB C 468 37.786 37.786 39.499 -1.713 25932 3843 1 20 . 1 1 468 468 TYR H H 468 7.867 7.867 7.941 -0.074 25932 3844 1 20 . 1 1 469 469 ARG N N 469 121.174 121.174 126.466 -5.292 25932 3845 1 20 . 1 1 469 469 ARG C C 469 175.800 175.800 174.832 0.968 25932 3846 1 20 . 1 1 469 469 ARG CA C 469 55.334 55.334 55.395 -0.061 25932 3847 1 20 . 1 1 469 469 ARG CB C 469 30.035 30.035 30.966 -0.931 25932 3848 1 20 . 1 1 469 469 ARG H H 469 7.873 7.873 7.897 -0.024 25932 3849 1 20 . 1 1 470 470 LEU N N 470 121.718 121.718 122.823 -1.105 25932 3850 1 20 . 1 1 470 470 LEU C C 470 176.618 176.618 177.085 -0.467 25932 3851 1 20 . 1 1 470 470 LEU CA C 470 54.858 54.858 54.078 0.780 25932 3852 1 20 . 1 1 470 470 LEU CB C 470 41.331 41.331 42.480 -1.149 25932 3853 1 20 . 1 1 470 470 LEU H H 470 7.940 7.940 8.324 -0.384 25932 3854 1 20 . 1 1 471 471 ARG N N 471 120.624 120.624 123.843 -3.219 25932 3855 1 20 . 1 1 471 471 ARG CA C 471 55.308 55.308 55.858 -0.550 25932 3856 1 20 . 1 1 471 471 ARG CB C 471 30.010 30.010 31.126 -1.116 25932 3857 1 20 . 1 1 471 471 ARG H H 471 7.922 7.922 8.523 -0.601 25932 3858 1 20 . 1 1 472 472 ARG C C 472 175.258 175.258 175.578 -0.320 25932 3859 1 20 . 1 1 472 472 ARG CA C 472 55.704 55.704 55.712 -0.008 25932 3860 1 20 . 1 1 472 472 ARG CB C 472 29.851 29.851 31.352 -1.500 25932 3861 1 21 . 1 1 433 433 SER C C 433 174.143 174.143 174.964 -0.821 25932 3862 1 21 . 1 1 433 433 SER CA C 433 57.715 57.715 57.081 0.634 25932 3863 1 21 . 1 1 433 433 SER CB C 433 63.602 63.602 64.036 -0.434 25932 3864 1 21 . 1 1 434 434 TRP N N 434 122.746 122.746 124.774 -2.028 25932 3865 1 21 . 1 1 434 434 TRP C C 434 175.587 175.587 176.507 -0.920 25932 3866 1 21 . 1 1 434 434 TRP CA C 434 56.604 56.604 58.444 -1.840 25932 3867 1 21 . 1 1 434 434 TRP CB C 434 29.269 29.269 29.827 -0.558 25932 3868 1 21 . 1 1 434 434 TRP H H 434 8.283 8.283 8.371 -0.088 25932 3869 1 21 . 1 1 435 435 ASP N N 435 121.374 121.374 115.457 5.917 25932 3870 1 21 . 1 1 435 435 ASP C C 435 176.543 176.543 177.296 -0.753 25932 3871 1 21 . 1 1 435 435 ASP CA C 435 53.562 53.562 55.203 -1.641 25932 3872 1 21 . 1 1 435 435 ASP CB C 435 40.854 40.854 39.039 1.815 25932 3873 1 21 . 1 1 435 435 ASP H H 435 8.219 8.219 8.069 0.150 25932 3874 1 21 . 1 1 436 436 THR N N 436 116.111 116.111 108.600 7.511 25932 3875 1 21 . 1 1 436 436 THR C C 436 175.651 175.651 176.201 -0.550 25932 3876 1 21 . 1 1 436 436 THR CA C 436 65.015 65.015 64.968 0.048 25932 3877 1 21 . 1 1 436 436 THR CB C 436 68.416 68.416 68.879 -0.463 25932 3878 1 21 . 1 1 436 436 THR H H 436 8.251 8.251 8.656 -0.405 25932 3879 1 21 . 1 1 437 437 GLU N N 437 121.374 121.374 122.224 -0.850 25932 3880 1 21 . 1 1 437 437 GLU C C 437 177.988 177.988 178.490 -0.502 25932 3881 1 21 . 1 1 437 437 GLU CA C 437 59.513 59.513 59.571 -0.058 25932 3882 1 21 . 1 1 437 437 GLU CB C 437 28.370 28.370 29.176 -0.806 25932 3883 1 21 . 1 1 437 437 GLU H H 437 8.897 8.897 8.689 0.208 25932 3884 1 21 . 1 1 438 438 SER N N 438 115.658 115.658 115.394 0.264 25932 3885 1 21 . 1 1 438 438 SER C C 438 175.832 175.832 176.497 -0.665 25932 3886 1 21 . 1 1 438 438 SER CA C 438 60.889 60.889 61.581 -0.692 25932 3887 1 21 . 1 1 438 438 SER CB C 438 62.491 62.491 62.586 -0.095 25932 3888 1 21 . 1 1 438 438 SER H H 438 8.018 8.018 7.816 0.202 25932 3889 1 21 . 1 1 439 439 VAL N N 439 122.608 122.608 123.795 -1.187 25932 3890 1 21 . 1 1 439 439 VAL C C 439 177.743 177.743 177.873 -0.130 25932 3891 1 21 . 1 1 439 439 VAL CA C 439 65.861 65.861 66.115 -0.254 25932 3892 1 21 . 1 1 439 439 VAL CB C 439 30.698 30.698 31.157 -0.459 25932 3893 1 21 . 1 1 439 439 VAL H H 439 7.908 7.908 7.247 0.661 25932 3894 1 21 . 1 1 440 440 LEU N N 440 120.077 120.077 121.168 -1.091 25932 3895 1 21 . 1 1 440 440 LEU C C 440 178.466 178.466 178.068 0.398 25932 3896 1 21 . 1 1 440 440 LEU CA C 440 57.953 57.953 58.159 -0.206 25932 3897 1 21 . 1 1 440 440 LEU CB C 440 40.378 40.378 41.401 -1.022 25932 3898 1 21 . 1 1 440 440 LEU H H 440 8.171 8.171 8.135 0.036 25932 3899 1 21 . 1 1 441 441 ALA N N 441 119.465 119.465 121.383 -1.918 25932 3900 1 21 . 1 1 441 441 ALA C C 441 178.986 178.986 179.652 -0.666 25932 3901 1 21 . 1 1 441 441 ALA CA C 441 55.122 55.122 54.871 0.251 25932 3902 1 21 . 1 1 441 441 ALA CB C 441 17.367 17.367 18.256 -0.889 25932 3903 1 21 . 1 1 441 441 ALA H H 441 8.090 8.090 7.775 0.315 25932 3904 1 21 . 1 1 442 442 MET N N 442 116.111 116.111 117.322 -1.211 25932 3905 1 21 . 1 1 442 442 MET C C 442 178.073 178.073 178.219 -0.146 25932 3906 1 21 . 1 1 442 442 MET CA C 442 58.217 58.217 59.283 -1.067 25932 3907 1 21 . 1 1 442 442 MET CB C 442 31.597 31.597 32.763 -1.166 25932 3908 1 21 . 1 1 442 442 MET H H 442 7.875 7.875 7.963 -0.088 25932 3909 1 21 . 1 1 443 443 TRP N N 443 119.802 119.802 119.122 0.680 25932 3910 1 21 . 1 1 443 443 TRP C C 443 178.445 178.445 177.774 0.671 25932 3911 1 21 . 1 1 443 443 TRP CA C 443 60.624 60.624 59.231 1.393 25932 3912 1 21 . 1 1 443 443 TRP CB C 443 28.899 28.899 28.997 -0.098 25932 3913 1 21 . 1 1 443 443 TRP H H 443 8.196 8.196 7.911 0.285 25932 3914 1 21 . 1 1 444 444 VAL N N 444 118.509 118.509 122.158 -3.649 25932 3915 1 21 . 1 1 444 444 VAL C C 444 177.563 177.563 177.321 0.242 25932 3916 1 21 . 1 1 444 444 VAL CA C 444 66.866 66.866 65.608 1.258 25932 3917 1 21 . 1 1 444 444 VAL CB C 444 30.221 30.221 31.065 -0.844 25932 3918 1 21 . 1 1 444 444 VAL H H 444 8.353 8.353 6.631 1.722 25932 3919 1 21 . 1 1 445 445 LEU N N 445 119.328 119.328 119.467 -0.139 25932 3920 1 21 . 1 1 445 445 LEU C C 445 178.168 178.168 178.636 -0.468 25932 3921 1 21 . 1 1 445 445 LEU CA C 445 57.979 57.979 58.045 -0.066 25932 3922 1 21 . 1 1 445 445 LEU CB C 445 40.431 40.431 41.097 -0.666 25932 3923 1 21 . 1 1 445 445 LEU H H 445 8.233 8.233 7.357 0.876 25932 3924 1 21 . 1 1 446 446 ALA N N 446 120.009 120.009 122.512 -2.503 25932 3925 1 21 . 1 1 446 446 ALA C C 446 179.071 179.071 179.785 -0.714 25932 3926 1 21 . 1 1 446 446 ALA CA C 446 55.096 55.096 55.198 -0.102 25932 3927 1 21 . 1 1 446 446 ALA CB C 446 16.996 16.996 18.224 -1.228 25932 3928 1 21 . 1 1 446 446 ALA H H 446 8.402 8.402 7.723 0.680 25932 3929 1 21 . 1 1 447 447 LEU N N 447 117.136 117.136 119.390 -2.254 25932 3930 1 21 . 1 1 447 447 LEU C C 447 178.678 178.678 179.252 -0.574 25932 3931 1 21 . 1 1 447 447 LEU CA C 447 57.767 57.767 58.301 -0.534 25932 3932 1 21 . 1 1 447 447 LEU CB C 447 40.378 40.378 41.522 -1.144 25932 3933 1 21 . 1 1 447 447 LEU H H 447 8.244 8.244 8.159 0.085 25932 3934 1 21 . 1 1 448 448 ILE N N 448 119.121 119.121 119.416 -0.295 25932 3935 1 21 . 1 1 448 448 ILE C C 448 177.574 177.574 178.230 -0.656 25932 3936 1 21 . 1 1 448 448 ILE CA C 448 65.702 65.702 65.910 -0.208 25932 3937 1 21 . 1 1 448 448 ILE CB C 448 36.464 36.464 37.968 -1.504 25932 3938 1 21 . 1 1 448 448 ILE H H 448 8.286 8.286 7.823 0.463 25932 3939 1 21 . 1 1 449 449 VAL N N 449 119.052 119.052 119.543 -0.491 25932 3940 1 21 . 1 1 449 449 VAL C C 449 179.135 179.135 177.896 1.239 25932 3941 1 21 . 1 1 449 449 VAL CA C 449 67.051 67.051 67.253 -0.202 25932 3942 1 21 . 1 1 449 449 VAL CB C 449 30.175 30.175 31.825 -1.650 25932 3943 1 21 . 1 1 449 449 VAL H H 449 8.327 8.327 7.704 0.623 25932 3944 1 21 . 1 1 450 450 ILE N N 450 123.014 123.014 118.213 4.801 25932 3945 1 21 . 1 1 450 450 ILE C C 450 177.074 177.074 177.746 -0.672 25932 3946 1 21 . 1 1 450 450 ILE CA C 450 65.594 65.594 64.466 1.128 25932 3947 1 21 . 1 1 450 450 ILE CB C 450 36.594 36.594 37.562 -0.968 25932 3948 1 21 . 1 1 450 450 ILE H H 450 8.670 8.670 7.643 1.027 25932 3949 1 21 . 1 1 451 451 PHE N N 451 119.392 119.392 119.969 -0.577 25932 3950 1 21 . 1 1 451 451 PHE C C 451 177.297 177.297 177.958 -0.661 25932 3951 1 21 . 1 1 451 451 PHE CA C 451 61.389 61.389 62.251 -0.862 25932 3952 1 21 . 1 1 451 451 PHE CB C 451 37.970 37.970 38.156 -0.186 25932 3953 1 21 . 1 1 451 451 PHE H H 451 8.651 8.651 7.402 1.249 25932 3954 1 21 . 1 1 452 452 LEU N N 452 118.367 118.367 119.341 -0.974 25932 3955 1 21 . 1 1 452 452 LEU C C 452 177.967 177.967 179.062 -1.095 25932 3956 1 21 . 1 1 452 452 LEU CA C 452 57.606 57.606 58.184 -0.578 25932 3957 1 21 . 1 1 452 452 LEU CB C 452 40.924 40.924 41.499 -0.575 25932 3958 1 21 . 1 1 452 452 LEU H H 452 8.731 8.731 7.821 0.910 25932 3959 1 21 . 1 1 453 453 THR N N 453 116.173 116.173 114.406 1.767 25932 3960 1 21 . 1 1 453 453 THR C C 453 176.220 176.220 176.758 -0.538 25932 3961 1 21 . 1 1 453 453 THR CA C 453 67.919 67.919 65.703 2.216 25932 3962 1 21 . 1 1 453 453 THR CB C 453 67.006 67.006 68.202 -1.196 25932 3963 1 21 . 1 1 453 453 THR H H 453 8.104 8.104 7.972 0.132 25932 3964 1 21 . 1 1 454 454 ILE N N 454 120.077 120.077 122.190 -2.113 25932 3965 1 21 . 1 1 454 454 ILE C C 454 176.915 176.915 177.641 -0.726 25932 3966 1 21 . 1 1 454 454 ILE CA C 454 65.041 65.041 65.214 -0.173 25932 3967 1 21 . 1 1 454 454 ILE CB C 454 36.464 36.464 37.438 -0.974 25932 3968 1 21 . 1 1 454 454 ILE H H 454 8.043 8.043 8.282 -0.239 25932 3969 1 21 . 1 1 455 455 ALA N N 455 121.174 121.174 122.683 -1.509 25932 3970 1 21 . 1 1 455 455 ALA C C 455 178.806 178.806 179.747 -0.941 25932 3971 1 21 . 1 1 455 455 ALA CA C 455 55.346 55.346 55.506 -0.160 25932 3972 1 21 . 1 1 455 455 ALA CB C 455 16.890 16.890 18.096 -1.206 25932 3973 1 21 . 1 1 455 455 ALA H H 455 8.265 8.265 8.540 -0.275 25932 3974 1 21 . 1 1 456 456 VAL N N 456 116.661 116.661 119.375 -2.714 25932 3975 1 21 . 1 1 456 456 VAL C C 456 177.489 177.489 178.163 -0.674 25932 3976 1 21 . 1 1 456 456 VAL CA C 456 66.494 66.494 66.906 -0.411 25932 3977 1 21 . 1 1 456 456 VAL CB C 456 30.226 30.226 31.252 -1.026 25932 3978 1 21 . 1 1 456 456 VAL H H 456 8.211 8.211 7.745 0.466 25932 3979 1 21 . 1 1 457 457 LEU N N 457 119.465 119.465 120.181 -0.716 25932 3980 1 21 . 1 1 457 457 LEU C C 457 179.517 179.517 179.573 -0.056 25932 3981 1 21 . 1 1 457 457 LEU CA C 457 58.056 58.056 58.223 -0.167 25932 3982 1 21 . 1 1 457 457 LEU CB C 457 40.414 40.414 40.807 -0.393 25932 3983 1 21 . 1 1 457 457 LEU H H 457 8.150 8.150 7.518 0.632 25932 3984 1 21 . 1 1 458 458 LEU N N 458 118.436 118.436 119.460 -1.024 25932 3985 1 21 . 1 1 458 458 LEU C C 458 178.891 178.891 179.042 -0.151 25932 3986 1 21 . 1 1 458 458 LEU CA C 458 57.395 57.395 58.184 -0.789 25932 3987 1 21 . 1 1 458 458 LEU CB C 458 40.484 40.484 41.361 -0.876 25932 3988 1 21 . 1 1 458 458 LEU H H 458 8.542 8.542 8.016 0.526 25932 3989 1 21 . 1 1 459 459 ALA N N 459 122.337 122.337 121.595 0.742 25932 3990 1 21 . 1 1 459 459 ALA C C 459 179.793 179.793 179.415 0.378 25932 3991 1 21 . 1 1 459 459 ALA CA C 459 55.122 55.122 55.003 0.119 25932 3992 1 21 . 1 1 459 459 ALA CB C 459 17.208 17.208 18.600 -1.392 25932 3993 1 21 . 1 1 459 459 ALA H H 459 8.401 8.401 8.225 0.176 25932 3994 1 21 . 1 1 460 460 LEU N N 460 117.961 117.961 120.589 -2.628 25932 3995 1 21 . 1 1 460 460 LEU C C 460 179.262 179.262 178.704 0.558 25932 3996 1 21 . 1 1 460 460 LEU CA C 460 57.673 57.673 57.981 -0.308 25932 3997 1 21 . 1 1 460 460 LEU CB C 460 40.414 40.414 41.449 -1.034 25932 3998 1 21 . 1 1 460 460 LEU H H 460 8.518 8.518 8.554 -0.036 25932 3999 1 21 . 1 1 461 461 ARG N N 461 119.534 119.534 119.589 -0.055 25932 4000 1 21 . 1 1 461 461 ARG C C 461 178.625 178.625 178.512 0.113 25932 4001 1 21 . 1 1 461 461 ARG CA C 461 57.818 57.818 59.005 -1.187 25932 4002 1 21 . 1 1 461 461 ARG CB C 461 28.443 28.443 29.577 -1.134 25932 4003 1 21 . 1 1 461 461 ARG H H 461 8.029 8.029 8.003 0.026 25932 4004 1 21 . 1 1 462 462 PHE N N 462 118.777 118.777 119.975 -1.198 25932 4005 1 21 . 1 1 462 462 PHE C C 462 177.127 177.127 176.598 0.529 25932 4006 1 21 . 1 1 462 462 PHE CA C 462 60.624 60.624 60.992 -0.368 25932 4007 1 21 . 1 1 462 462 PHE CB C 462 38.633 38.633 38.798 -0.165 25932 4008 1 21 . 1 1 462 462 PHE H H 462 8.460 8.460 7.852 0.608 25932 4009 1 21 . 1 1 463 463 CYS N N 463 116.386 116.386 117.162 -0.776 25932 4010 1 21 . 1 1 463 463 CYS C C 463 175.980 175.980 176.665 -0.685 25932 4011 1 21 . 1 1 463 463 CYS CA C 463 61.999 61.999 62.554 -0.555 25932 4012 1 21 . 1 1 463 463 CYS CB C 463 26.966 26.966 28.730 -1.764 25932 4013 1 21 . 1 1 463 463 CYS H H 463 8.278 8.278 8.416 -0.138 25932 4014 1 21 . 1 1 464 464 GLY N N 464 107.774 107.774 108.657 -0.883 25932 4015 1 21 . 1 1 464 464 GLY C C 464 174.990 174.990 176.300 -1.310 25932 4016 1 21 . 1 1 464 464 GLY CA C 464 45.944 45.944 47.007 -1.063 25932 4017 1 21 . 1 1 464 464 GLY H H 464 8.050 8.050 8.642 -0.592 25932 4018 1 21 . 1 1 465 465 ILE N N 465 119.940 119.940 119.771 0.169 25932 4019 1 21 . 1 1 465 465 ILE C C 465 176.458 176.458 175.500 0.958 25932 4020 1 21 . 1 1 465 465 ILE CA C 465 62.423 62.423 61.790 0.633 25932 4021 1 21 . 1 1 465 465 ILE CB C 465 37.409 37.409 38.356 -0.947 25932 4022 1 21 . 1 1 465 465 ILE H H 465 7.745 7.745 8.235 -0.490 25932 4023 1 21 . 1 1 466 466 TYR N N 466 118.846 118.846 119.540 -0.694 25932 4024 1 21 . 1 1 466 466 TYR C C 466 176.150 176.150 175.810 0.340 25932 4025 1 21 . 1 1 466 466 TYR CA C 466 58.429 58.429 57.105 1.324 25932 4026 1 21 . 1 1 466 466 TYR CB C 466 37.917 37.917 38.443 -0.526 25932 4027 1 21 . 1 1 466 466 TYR H H 466 7.807 7.807 7.616 0.191 25932 4028 1 21 . 1 1 467 467 GLY N N 467 107.987 107.987 106.416 1.571 25932 4029 1 21 . 1 1 467 467 GLY C C 467 174.143 174.143 173.600 0.543 25932 4030 1 21 . 1 1 467 467 GLY CA C 467 45.547 45.547 45.110 0.437 25932 4031 1 21 . 1 1 467 467 GLY H H 467 7.887 7.887 7.447 0.440 25932 4032 1 21 . 1 1 468 468 TYR N N 468 119.878 119.878 120.349 -0.471 25932 4033 1 21 . 1 1 468 468 TYR C C 468 175.524 175.524 174.300 1.224 25932 4034 1 21 . 1 1 468 468 TYR CA C 468 58.164 58.164 56.887 1.277 25932 4035 1 21 . 1 1 468 468 TYR CB C 468 37.786 37.786 40.579 -2.793 25932 4036 1 21 . 1 1 468 468 TYR H H 468 7.867 7.867 8.487 -0.620 25932 4037 1 21 . 1 1 469 469 ARG N N 469 121.174 121.174 121.850 -0.676 25932 4038 1 21 . 1 1 469 469 ARG C C 469 175.800 175.800 175.861 -0.061 25932 4039 1 21 . 1 1 469 469 ARG CA C 469 55.334 55.334 54.718 0.616 25932 4040 1 21 . 1 1 469 469 ARG CB C 469 30.035 30.035 33.151 -3.116 25932 4041 1 21 . 1 1 469 469 ARG H H 469 7.873 7.873 8.553 -0.680 25932 4042 1 21 . 1 1 470 470 LEU N N 470 121.718 121.718 122.296 -0.578 25932 4043 1 21 . 1 1 470 470 LEU C C 470 176.618 176.618 177.633 -1.015 25932 4044 1 21 . 1 1 470 470 LEU CA C 470 54.858 54.858 56.689 -1.831 25932 4045 1 21 . 1 1 470 470 LEU CB C 470 41.331 41.331 42.510 -1.179 25932 4046 1 21 . 1 1 470 470 LEU H H 470 7.940 7.940 8.560 -0.620 25932 4047 1 21 . 1 1 471 471 ARG N N 471 120.624 120.624 118.880 1.744 25932 4048 1 21 . 1 1 471 471 ARG CA C 471 55.308 55.308 55.174 0.134 25932 4049 1 21 . 1 1 471 471 ARG CB C 471 30.010 30.010 31.463 -1.454 25932 4050 1 21 . 1 1 471 471 ARG H H 471 7.922 7.922 7.758 0.164 25932 4051 1 21 . 1 1 472 472 ARG C C 472 175.258 175.258 175.367 -0.109 25932 4052 1 21 . 1 1 472 472 ARG CA C 472 55.704 55.704 56.082 -0.378 25932 4053 1 21 . 1 1 472 472 ARG CB C 472 29.851 29.851 29.619 0.233 25932 stop_ loop_ _SPARTA_output.Data_ID _SPARTA_output.Entity_delta_chem_shifts_ID _SPARTA_output.Conformer_ID _SPARTA_output.Data_type _SPARTA_output.Data_atom _SPARTA_output.Data_num_shifts _SPARTA_output.Data_value _SPARTA_output.Data_low_range _SPARTA_output.Data_high_range _SPARTA_output.Entry_ID 1 1 1 "Average Difference" N 38 1.999 0.750 1.878 25932 2 1 1 "Average Difference" HA 0 0.000 0.000 0.000 25932 3 1 1 "Average Difference" C 39 0.721 0.310 0.659 25932 4 1 1 "Average Difference" CA 40 0.830 0.394 0.739 25932 5 1 1 "Average Difference" CB 38 1.029 0.703 0.761 25932 6 1 1 "Average Difference" HN 38 0.528 -0.204 0.494 25932 7 1 2 "Average Difference" N 38 1.669 0.787 1.491 25932 8 1 2 "Average Difference" HA 0 0.000 0.000 0.000 25932 9 1 2 "Average Difference" C 39 0.658 0.235 0.623 25932 10 1 2 "Average Difference" CA 40 0.845 0.211 0.829 25932 11 1 2 "Average Difference" CB 38 1.020 0.839 0.588 25932 12 1 2 "Average Difference" HN 38 0.538 -0.247 0.484 25932 13 1 3 "Average Difference" N 38 1.773 0.592 1.694 25932 14 1 3 "Average Difference" HA 0 0.000 0.000 0.000 25932 15 1 3 "Average Difference" C 39 0.833 0.326 0.777 25932 16 1 3 "Average Difference" CA 40 1.042 0.359 0.991 25932 17 1 3 "Average Difference" CB 38 1.081 0.817 0.718 25932 18 1 3 "Average Difference" HN 38 0.558 -0.289 0.484 25932 19 1 4 "Average Difference" N 38 1.401 0.642 1.261 25932 20 1 4 "Average Difference" HA 0 0.000 0.000 0.000 25932 21 1 4 "Average Difference" C 39 0.706 0.210 0.683 25932 22 1 4 "Average Difference" CA 40 0.729 0.227 0.702 25932 23 1 4 "Average Difference" CB 38 1.200 0.937 0.761 25932 24 1 4 "Average Difference" HN 38 0.536 -0.172 0.514 25932 25 1 5 "Average Difference" N 38 1.424 0.467 1.364 25932 26 1 5 "Average Difference" HA 0 0.000 0.000 0.000 25932 27 1 5 "Average Difference" C 39 0.634 0.261 0.585 25932 28 1 5 "Average Difference" CA 40 0.799 0.121 0.800 25932 29 1 5 "Average Difference" CB 38 1.113 0.928 0.624 25932 30 1 5 "Average Difference" HN 38 0.551 -0.276 0.484 25932 31 1 6 "Average Difference" N 38 1.482 0.631 1.359 25932 32 1 6 "Average Difference" HA 0 0.000 0.000 0.000 25932 33 1 6 "Average Difference" C 39 0.672 0.238 0.636 25932 34 1 6 "Average Difference" CA 40 0.867 0.240 0.844 25932 35 1 6 "Average Difference" CB 38 1.131 0.943 0.634 25932 36 1 6 "Average Difference" HN 38 0.558 -0.212 0.523 25932 37 1 7 "Average Difference" N 38 1.920 1.051 1.628 25932 38 1 7 "Average Difference" HA 0 0.000 0.000 0.000 25932 39 1 7 "Average Difference" C 39 0.701 0.193 0.683 25932 40 1 7 "Average Difference" CA 40 0.695 0.037 0.703 25932 41 1 7 "Average Difference" CB 38 1.220 0.996 0.715 25932 42 1 7 "Average Difference" HN 38 0.583 -0.281 0.518 25932 43 1 8 "Average Difference" N 38 1.847 0.778 1.697 25932 44 1 8 "Average Difference" HA 0 0.000 0.000 0.000 25932 45 1 8 "Average Difference" C 39 0.594 0.192 0.569 25932 46 1 8 "Average Difference" CA 40 0.916 0.172 0.911 25932 47 1 8 "Average Difference" CB 38 1.010 0.821 0.596 25932 48 1 8 "Average Difference" HN 38 0.594 -0.267 0.538 25932 49 1 9 "Average Difference" N 38 1.558 0.874 1.307 25932 50 1 9 "Average Difference" HA 0 0.000 0.000 0.000 25932 51 1 9 "Average Difference" C 39 0.746 0.273 0.703 25932 52 1 9 "Average Difference" CA 40 0.859 0.182 0.850 25932 53 1 9 "Average Difference" CB 38 1.019 0.777 0.668 25932 54 1 9 "Average Difference" HN 38 0.599 -0.252 0.551 25932 55 1 10 "Average Difference" N 38 1.799 0.415 1.773 25932 56 1 10 "Average Difference" HA 0 0.000 0.000 0.000 25932 57 1 10 "Average Difference" C 39 0.840 0.410 0.743 25932 58 1 10 "Average Difference" CA 40 1.196 0.360 1.155 25932 59 1 10 "Average Difference" CB 38 1.012 0.781 0.653 25932 60 1 10 "Average Difference" HN 38 0.594 -0.281 0.530 25932 61 1 11 "Average Difference" N 38 1.526 0.417 1.488 25932 62 1 11 "Average Difference" HA 0 0.000 0.000 0.000 25932 63 1 11 "Average Difference" C 39 0.646 0.234 0.610 25932 64 1 11 "Average Difference" CA 40 0.832 0.098 0.837 25932 65 1 11 "Average Difference" CB 38 1.027 0.903 0.494 25932 66 1 11 "Average Difference" HN 38 0.600 -0.287 0.534 25932 67 1 12 "Average Difference" N 38 1.701 0.695 1.573 25932 68 1 12 "Average Difference" HA 0 0.000 0.000 0.000 25932 69 1 12 "Average Difference" C 39 0.808 0.312 0.756 25932 70 1 12 "Average Difference" CA 40 1.019 0.231 1.005 25932 71 1 12 "Average Difference" CB 38 1.198 0.948 0.742 25932 72 1 12 "Average Difference" HN 38 0.531 -0.176 0.508 25932 73 1 13 "Average Difference" N 38 1.568 0.671 1.436 25932 74 1 13 "Average Difference" HA 0 0.000 0.000 0.000 25932 75 1 13 "Average Difference" C 39 0.657 0.234 0.622 25932 76 1 13 "Average Difference" CA 40 0.815 0.165 0.809 25932 77 1 13 "Average Difference" CB 38 1.043 0.913 0.512 25932 78 1 13 "Average Difference" HN 38 0.546 -0.241 0.496 25932 79 1 14 "Average Difference" N 38 1.608 0.568 1.524 25932 80 1 14 "Average Difference" HA 0 0.000 0.000 0.000 25932 81 1 14 "Average Difference" C 39 0.671 0.242 0.634 25932 82 1 14 "Average Difference" CA 40 0.876 0.131 0.877 25932 83 1 14 "Average Difference" CB 38 1.095 0.821 0.735 25932 84 1 14 "Average Difference" HN 38 0.596 -0.246 0.550 25932 85 1 15 "Average Difference" N 38 1.746 0.218 1.755 25932 86 1 15 "Average Difference" HA 0 0.000 0.000 0.000 25932 87 1 15 "Average Difference" C 39 0.697 0.307 0.634 25932 88 1 15 "Average Difference" CA 40 0.980 0.233 0.964 25932 89 1 15 "Average Difference" CB 38 0.962 0.690 0.680 25932 90 1 15 "Average Difference" HN 38 0.642 -0.354 0.543 25932 91 1 16 "Average Difference" N 38 1.618 0.713 1.471 25932 92 1 16 "Average Difference" HA 0 0.000 0.000 0.000 25932 93 1 16 "Average Difference" C 39 0.651 0.317 0.576 25932 94 1 16 "Average Difference" CA 40 0.900 0.236 0.879 25932 95 1 16 "Average Difference" CB 38 1.070 0.893 0.598 25932 96 1 16 "Average Difference" HN 38 0.583 -0.295 0.510 25932 97 1 17 "Average Difference" N 38 1.837 0.355 1.826 25932 98 1 17 "Average Difference" HA 0 0.000 0.000 0.000 25932 99 1 17 "Average Difference" C 39 0.881 0.470 0.756 25932 100 1 17 "Average Difference" CA 40 1.217 0.378 1.172 25932 101 1 17 "Average Difference" CB 38 0.940 0.691 0.646 25932 102 1 17 "Average Difference" HN 38 0.577 -0.270 0.516 25932 103 1 18 "Average Difference" N 38 1.429 0.645 1.293 25932 104 1 18 "Average Difference" HA 0 0.000 0.000 0.000 25932 105 1 18 "Average Difference" C 39 0.668 0.273 0.618 25932 106 1 18 "Average Difference" CA 40 0.892 0.219 0.876 25932 107 1 18 "Average Difference" CB 38 1.048 0.900 0.544 25932 108 1 18 "Average Difference" HN 38 0.582 -0.297 0.508 25932 109 1 19 "Average Difference" N 38 1.483 0.710 1.320 25932 110 1 19 "Average Difference" HA 0 0.000 0.000 0.000 25932 111 1 19 "Average Difference" C 39 0.745 0.228 0.718 25932 112 1 19 "Average Difference" CA 40 0.971 0.208 0.960 25932 113 1 19 "Average Difference" CB 38 1.002 0.831 0.568 25932 114 1 19 "Average Difference" HN 38 0.595 -0.279 0.533 25932 115 1 20 "Average Difference" N 38 1.728 1.015 1.417 25932 116 1 20 "Average Difference" HA 0 0.000 0.000 0.000 25932 117 1 20 "Average Difference" C 39 0.644 0.193 0.622 25932 118 1 20 "Average Difference" CA 40 0.687 0.003 0.695 25932 119 1 20 "Average Difference" CB 38 1.074 0.920 0.561 25932 120 1 20 "Average Difference" HN 38 0.575 -0.283 0.507 25932 121 1 21 "Average Difference" N 38 2.236 0.264 2.250 25932 122 1 21 "Average Difference" HA 0 0.000 0.000 0.000 25932 123 1 21 "Average Difference" C 39 0.686 0.232 0.653 25932 124 1 21 "Average Difference" CA 40 0.884 0.106 0.889 25932 125 1 21 "Average Difference" CB 38 1.190 0.892 0.799 25932 126 1 21 "Average Difference" HN 38 0.578 -0.226 0.539 25932 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.Model_type average _Entity_delta_chem_shifts.Entry_ID 25932 _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.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_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.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 . 1 1 433 433 SER C C 433 174.143 174.143 174.047 0.096 25932 2 1 . 1 1 433 433 SER CA C 433 57.715 57.715 58.282 -0.567 25932 3 1 . 1 1 433 433 SER CB C 433 63.602 63.602 64.011 -0.409 25932 4 1 . 1 1 434 434 TRP N N 434 122.746 122.746 122.594 0.152 25932 5 1 . 1 1 434 434 TRP C C 434 175.587 175.587 176.280 -0.693 25932 6 1 . 1 1 434 434 TRP CA C 434 56.604 56.604 57.413 -0.809 25932 7 1 . 1 1 434 434 TRP CB C 434 29.269 29.269 30.163 -0.894 25932 8 1 . 1 1 434 434 TRP H H 434 8.283 8.283 8.160 0.123 25932 9 1 . 1 1 435 435 ASP N N 435 121.374 121.374 121.459 -0.085 25932 10 1 . 1 1 435 435 ASP C C 435 176.543 176.543 177.432 -0.889 25932 11 1 . 1 1 435 435 ASP CA C 435 53.562 53.562 54.424 -0.862 25932 12 1 . 1 1 435 435 ASP CB C 435 40.854 40.854 41.199 -0.345 25932 13 1 . 1 1 435 435 ASP H H 435 8.219 8.219 8.513 -0.294 25932 14 1 . 1 1 436 436 THR N N 436 116.111 116.111 116.088 0.023 25932 15 1 . 1 1 436 436 THR C C 436 175.651 175.651 176.295 -0.644 25932 16 1 . 1 1 436 436 THR CA C 436 65.015 65.015 65.087 -0.072 25932 17 1 . 1 1 436 436 THR CB C 436 68.416 68.416 68.883 -0.467 25932 18 1 . 1 1 436 436 THR H H 436 8.251 8.251 8.380 -0.129 25932 19 1 . 1 1 437 437 GLU N N 437 121.374 121.374 121.534 -0.160 25932 20 1 . 1 1 437 437 GLU C C 437 177.988 177.988 178.665 -0.677 25932 21 1 . 1 1 437 437 GLU CA C 437 59.513 59.513 59.627 -0.114 25932 22 1 . 1 1 437 437 GLU CB C 437 28.370 28.370 29.277 -0.907 25932 23 1 . 1 1 437 437 GLU H H 437 8.897 8.897 8.550 0.347 25932 24 1 . 1 1 438 438 SER N N 438 115.658 115.658 115.347 0.311 25932 25 1 . 1 1 438 438 SER C C 438 175.832 175.832 176.685 -0.853 25932 26 1 . 1 1 438 438 SER CA C 438 60.889 60.889 61.521 -0.632 25932 27 1 . 1 1 438 438 SER CB C 438 62.491 62.491 62.752 -0.261 25932 28 1 . 1 1 438 438 SER H H 438 8.018 8.018 7.806 0.212 25932 29 1 . 1 1 439 439 VAL N N 439 122.608 122.608 122.505 0.103 25932 30 1 . 1 1 439 439 VAL C C 439 177.743 177.743 177.901 -0.158 25932 31 1 . 1 1 439 439 VAL CA C 439 65.861 65.861 66.071 -0.210 25932 32 1 . 1 1 439 439 VAL CB C 439 30.698 30.698 31.476 -0.778 25932 33 1 . 1 1 439 439 VAL H H 439 7.908 7.908 7.297 0.611 25932 34 1 . 1 1 440 440 LEU N N 440 120.077 120.077 120.347 -0.270 25932 35 1 . 1 1 440 440 LEU C C 440 178.466 178.466 178.328 0.138 25932 36 1 . 1 1 440 440 LEU CA C 440 57.953 57.953 58.149 -0.196 25932 37 1 . 1 1 440 440 LEU CB C 440 40.378 40.378 41.606 -1.228 25932 38 1 . 1 1 440 440 LEU H H 440 8.171 8.171 8.281 -0.110 25932 39 1 . 1 1 441 441 ALA N N 441 119.465 119.465 121.159 -1.694 25932 40 1 . 1 1 441 441 ALA C C 441 178.986 178.986 179.433 -0.447 25932 41 1 . 1 1 441 441 ALA CA C 441 55.122 55.122 54.744 0.378 25932 42 1 . 1 1 441 441 ALA CB C 441 17.367 17.367 18.174 -0.807 25932 43 1 . 1 1 441 441 ALA H H 441 8.090 8.090 7.743 0.347 25932 44 1 . 1 1 442 442 MET N N 442 116.111 116.111 117.099 -0.988 25932 45 1 . 1 1 442 442 MET C C 442 178.073 178.073 178.037 0.036 25932 46 1 . 1 1 442 442 MET CA C 442 58.217 58.217 58.818 -0.602 25932 47 1 . 1 1 442 442 MET CB C 442 31.597 31.597 32.319 -0.722 25932 48 1 . 1 1 442 442 MET H H 442 7.875 7.875 7.540 0.335 25932 49 1 . 1 1 443 443 TRP N N 443 119.802 119.802 118.489 1.313 25932 50 1 . 1 1 443 443 TRP C C 443 178.445 178.445 177.785 0.660 25932 51 1 . 1 1 443 443 TRP CA C 443 60.624 60.624 59.303 1.321 25932 52 1 . 1 1 443 443 TRP CB C 443 28.899 28.899 28.323 0.576 25932 53 1 . 1 1 443 443 TRP H H 443 8.196 8.196 7.517 0.679 25932 54 1 . 1 1 444 444 VAL N N 444 118.509 118.509 121.824 -3.315 25932 55 1 . 1 1 444 444 VAL C C 444 177.563 177.563 178.021 -0.458 25932 56 1 . 1 1 444 444 VAL CA C 444 66.866 66.866 66.039 0.827 25932 57 1 . 1 1 444 444 VAL CB C 444 30.221 30.221 30.619 -0.398 25932 58 1 . 1 1 444 444 VAL H H 444 8.353 8.353 6.435 1.918 25932 59 1 . 1 1 445 445 LEU N N 445 119.328 119.328 120.289 -0.961 25932 60 1 . 1 1 445 445 LEU C C 445 178.168 178.168 178.525 -0.357 25932 61 1 . 1 1 445 445 LEU CA C 445 57.979 57.979 57.921 0.058 25932 62 1 . 1 1 445 445 LEU CB C 445 40.431 40.431 41.068 -0.637 25932 63 1 . 1 1 445 445 LEU H H 445 8.233 8.233 7.400 0.833 25932 64 1 . 1 1 446 446 ALA N N 446 120.009 120.009 122.196 -2.187 25932 65 1 . 1 1 446 446 ALA C C 446 179.071 179.071 179.805 -0.734 25932 66 1 . 1 1 446 446 ALA CA C 446 55.096 55.096 55.213 -0.117 25932 67 1 . 1 1 446 446 ALA CB C 446 16.996 16.996 18.233 -1.237 25932 68 1 . 1 1 446 446 ALA H H 446 8.402 8.402 7.795 0.607 25932 69 1 . 1 1 447 447 LEU N N 447 117.136 117.136 119.568 -2.432 25932 70 1 . 1 1 447 447 LEU C C 447 178.678 178.678 179.187 -0.509 25932 71 1 . 1 1 447 447 LEU CA C 447 57.767 57.767 58.091 -0.324 25932 72 1 . 1 1 447 447 LEU CB C 447 40.378 40.378 41.810 -1.432 25932 73 1 . 1 1 447 447 LEU H H 447 8.244 8.244 8.229 0.015 25932 74 1 . 1 1 448 448 ILE N N 448 119.121 119.121 119.703 -0.582 25932 75 1 . 1 1 448 448 ILE C C 448 177.574 177.574 178.315 -0.741 25932 76 1 . 1 1 448 448 ILE CA C 448 65.702 65.702 65.223 0.479 25932 77 1 . 1 1 448 448 ILE CB C 448 36.464 36.464 37.297 -0.833 25932 78 1 . 1 1 448 448 ILE H H 448 8.286 8.286 7.929 0.357 25932 79 1 . 1 1 449 449 VAL N N 449 119.052 119.052 119.856 -0.804 25932 80 1 . 1 1 449 449 VAL C C 449 179.135 179.135 178.187 0.948 25932 81 1 . 1 1 449 449 VAL CA C 449 67.051 67.051 66.940 0.111 25932 82 1 . 1 1 449 449 VAL CB C 449 30.175 30.175 31.337 -1.162 25932 83 1 . 1 1 449 449 VAL H H 449 8.327 8.327 7.788 0.539 25932 84 1 . 1 1 450 450 ILE N N 450 123.014 123.014 120.579 2.435 25932 85 1 . 1 1 450 450 ILE C C 450 177.074 177.074 177.912 -0.838 25932 86 1 . 1 1 450 450 ILE CA C 450 65.594 65.594 65.048 0.546 25932 87 1 . 1 1 450 450 ILE CB C 450 36.594 36.594 37.364 -0.770 25932 88 1 . 1 1 450 450 ILE H H 450 8.670 8.670 7.731 0.939 25932 89 1 . 1 1 451 451 PHE N N 451 119.392 119.392 119.023 0.369 25932 90 1 . 1 1 451 451 PHE C C 451 177.297 177.297 178.071 -0.774 25932 91 1 . 1 1 451 451 PHE CA C 451 61.389 61.389 62.566 -1.177 25932 92 1 . 1 1 451 451 PHE CB C 451 37.970 37.970 38.258 -0.288 25932 93 1 . 1 1 451 451 PHE H H 451 8.651 8.651 7.842 0.809 25932 94 1 . 1 1 452 452 LEU N N 452 118.367 118.367 119.561 -1.194 25932 95 1 . 1 1 452 452 LEU C C 452 177.967 177.967 179.111 -1.144 25932 96 1 . 1 1 452 452 LEU CA C 452 57.606 57.606 58.285 -0.679 25932 97 1 . 1 1 452 452 LEU CB C 452 40.924 40.924 41.357 -0.434 25932 98 1 . 1 1 452 452 LEU H H 452 8.731 8.731 8.047 0.684 25932 99 1 . 1 1 453 453 THR N N 453 116.173 116.173 116.401 -0.228 25932 100 1 . 1 1 453 453 THR C C 453 176.220 176.220 176.814 -0.594 25932 101 1 . 1 1 453 453 THR CA C 453 67.919 67.919 67.053 0.866 25932 102 1 . 1 1 453 453 THR CB C 453 67.006 67.006 68.578 -1.572 25932 103 1 . 1 1 453 453 THR H H 453 8.104 8.104 8.191 -0.087 25932 104 1 . 1 1 454 454 ILE N N 454 120.077 120.077 120.982 -0.905 25932 105 1 . 1 1 454 454 ILE C C 454 176.915 176.915 177.298 -0.383 25932 106 1 . 1 1 454 454 ILE CA C 454 65.041 65.041 64.782 0.259 25932 107 1 . 1 1 454 454 ILE CB C 454 36.464 36.464 37.572 -1.108 25932 108 1 . 1 1 454 454 ILE H H 454 8.043 8.043 8.276 -0.233 25932 109 1 . 1 1 455 455 ALA N N 455 121.174 121.174 122.979 -1.805 25932 110 1 . 1 1 455 455 ALA C C 455 178.806 178.806 179.673 -0.867 25932 111 1 . 1 1 455 455 ALA CA C 455 55.346 55.346 55.503 -0.156 25932 112 1 . 1 1 455 455 ALA CB C 455 16.890 16.890 18.075 -1.185 25932 113 1 . 1 1 455 455 ALA H H 455 8.265 8.265 8.401 -0.136 25932 114 1 . 1 1 456 456 VAL N N 456 116.661 116.661 119.035 -2.374 25932 115 1 . 1 1 456 456 VAL C C 456 177.489 177.489 178.088 -0.599 25932 116 1 . 1 1 456 456 VAL CA C 456 66.494 66.494 66.644 -0.150 25932 117 1 . 1 1 456 456 VAL CB C 456 30.226 30.226 31.432 -1.206 25932 118 1 . 1 1 456 456 VAL H H 456 8.211 8.211 7.820 0.391 25932 119 1 . 1 1 457 457 LEU N N 457 119.465 119.465 120.061 -0.596 25932 120 1 . 1 1 457 457 LEU C C 457 179.517 179.517 179.272 0.245 25932 121 1 . 1 1 457 457 LEU CA C 457 58.056 58.056 58.207 -0.151 25932 122 1 . 1 1 457 457 LEU CB C 457 40.414 40.414 41.404 -0.990 25932 123 1 . 1 1 457 457 LEU H H 457 8.150 8.150 7.463 0.687 25932 124 1 . 1 1 458 458 LEU N N 458 118.436 118.436 119.348 -0.912 25932 125 1 . 1 1 458 458 LEU C C 458 178.891 178.891 179.034 -0.143 25932 126 1 . 1 1 458 458 LEU CA C 458 57.395 57.395 58.107 -0.712 25932 127 1 . 1 1 458 458 LEU CB C 458 40.484 40.484 41.362 -0.878 25932 128 1 . 1 1 458 458 LEU H H 458 8.542 8.542 7.987 0.555 25932 129 1 . 1 1 459 459 ALA N N 459 122.337 122.337 121.693 0.644 25932 130 1 . 1 1 459 459 ALA C C 459 179.793 179.793 179.462 0.331 25932 131 1 . 1 1 459 459 ALA CA C 459 55.122 55.122 55.050 0.072 25932 132 1 . 1 1 459 459 ALA CB C 459 17.208 17.208 18.603 -1.395 25932 133 1 . 1 1 459 459 ALA H H 459 8.401 8.401 8.084 0.317 25932 134 1 . 1 1 460 460 LEU N N 460 117.961 117.961 120.598 -2.637 25932 135 1 . 1 1 460 460 LEU C C 460 179.262 179.262 178.652 0.610 25932 136 1 . 1 1 460 460 LEU CA C 460 57.673 57.673 58.016 -0.343 25932 137 1 . 1 1 460 460 LEU CB C 460 40.414 40.414 41.451 -1.037 25932 138 1 . 1 1 460 460 LEU H H 460 8.518 8.518 8.501 0.017 25932 139 1 . 1 1 461 461 ARG N N 461 119.534 119.534 119.520 0.014 25932 140 1 . 1 1 461 461 ARG C C 461 178.625 178.625 178.407 0.218 25932 141 1 . 1 1 461 461 ARG CA C 461 57.818 57.818 59.139 -1.321 25932 142 1 . 1 1 461 461 ARG CB C 461 28.443 28.443 29.796 -1.353 25932 143 1 . 1 1 461 461 ARG H H 461 8.029 8.029 7.971 0.058 25932 144 1 . 1 1 462 462 PHE N N 462 118.777 118.777 120.680 -1.903 25932 145 1 . 1 1 462 462 PHE C C 462 177.127 177.127 177.115 0.012 25932 146 1 . 1 1 462 462 PHE CA C 462 60.624 60.624 61.195 -0.571 25932 147 1 . 1 1 462 462 PHE CB C 462 38.633 38.633 38.981 -0.348 25932 148 1 . 1 1 462 462 PHE H H 462 8.460 8.460 7.978 0.482 25932 149 1 . 1 1 463 463 CYS N N 463 116.386 116.386 116.912 -0.526 25932 150 1 . 1 1 463 463 CYS C C 463 175.980 175.980 176.814 -0.834 25932 151 1 . 1 1 463 463 CYS CA C 463 61.999 61.999 62.737 -0.738 25932 152 1 . 1 1 463 463 CYS CB C 463 26.966 26.966 28.234 -1.268 25932 153 1 . 1 1 463 463 CYS H H 463 8.278 8.278 8.514 -0.236 25932 154 1 . 1 1 464 464 GLY N N 464 107.774 107.774 109.018 -1.244 25932 155 1 . 1 1 464 464 GLY C C 464 174.990 174.990 175.780 -0.790 25932 156 1 . 1 1 464 464 GLY CA C 464 45.944 45.944 46.855 -0.911 25932 157 1 . 1 1 464 464 GLY H H 464 8.050 8.050 8.226 -0.176 25932 158 1 . 1 1 465 465 ILE N N 465 119.940 119.940 119.479 0.461 25932 159 1 . 1 1 465 465 ILE C C 465 176.458 176.458 175.501 0.957 25932 160 1 . 1 1 465 465 ILE CA C 465 62.423 62.423 61.764 0.659 25932 161 1 . 1 1 465 465 ILE CB C 465 37.409 37.409 38.209 -0.800 25932 162 1 . 1 1 465 465 ILE H H 465 7.745 7.745 7.878 -0.133 25932 163 1 . 1 1 466 466 TYR N N 466 118.846 118.846 119.438 -0.592 25932 164 1 . 1 1 466 466 TYR C C 466 176.150 176.150 175.882 0.268 25932 165 1 . 1 1 466 466 TYR CA C 466 58.429 58.429 57.720 0.709 25932 166 1 . 1 1 466 466 TYR CB C 466 37.917 37.917 38.971 -1.054 25932 167 1 . 1 1 466 466 TYR H H 466 7.807 7.807 7.322 0.485 25932 168 1 . 1 1 467 467 GLY N N 467 107.987 107.987 107.019 0.968 25932 169 1 . 1 1 467 467 GLY C C 467 174.143 174.143 174.165 -0.022 25932 170 1 . 1 1 467 467 GLY CA C 467 45.547 45.547 45.304 0.243 25932 171 1 . 1 1 467 467 GLY H H 467 7.887 7.887 7.558 0.329 25932 172 1 . 1 1 468 468 TYR N N 468 119.878 119.878 119.774 0.104 25932 173 1 . 1 1 468 468 TYR C C 468 175.524 175.524 175.374 0.150 25932 174 1 . 1 1 468 468 TYR CA C 468 58.164 58.164 59.130 -0.966 25932 175 1 . 1 1 468 468 TYR CB C 468 37.786 37.786 38.824 -1.038 25932 176 1 . 1 1 468 468 TYR H H 468 7.867 7.867 8.064 -0.197 25932 177 1 . 1 1 469 469 ARG N N 469 121.174 121.174 122.204 -1.030 25932 178 1 . 1 1 469 469 ARG C C 469 175.800 175.800 175.509 0.291 25932 179 1 . 1 1 469 469 ARG CA C 469 55.334 55.334 55.995 -0.661 25932 180 1 . 1 1 469 469 ARG CB C 469 30.035 30.035 30.963 -0.928 25932 181 1 . 1 1 469 469 ARG H H 469 7.873 7.873 8.243 -0.370 25932 182 1 . 1 1 470 470 LEU N N 470 121.718 121.718 121.817 -0.099 25932 183 1 . 1 1 470 470 LEU C C 470 176.618 176.618 177.318 -0.700 25932 184 1 . 1 1 470 470 LEU CA C 470 54.858 54.858 54.916 -0.058 25932 185 1 . 1 1 470 470 LEU CB C 470 41.331 41.331 42.443 -1.112 25932 186 1 . 1 1 470 470 LEU H H 470 7.940 7.940 8.284 -0.345 25932 187 1 . 1 1 471 471 ARG N N 471 120.624 120.624 121.986 -1.362 25932 188 1 . 1 1 471 471 ARG CA C 471 55.308 55.308 56.427 -1.119 25932 189 1 . 1 1 471 471 ARG CB C 471 30.010 30.010 30.798 -0.788 25932 190 1 . 1 1 471 471 ARG H H 471 7.922 7.922 8.322 -0.400 25932 191 1 . 1 1 472 472 ARG C C 472 175.258 175.258 175.935 -0.677 25932 192 1 . 1 1 472 472 ARG CA C 472 55.704 55.704 56.230 -0.526 25932 193 1 . 1 1 472 472 ARG CB C 472 29.851 29.851 30.827 -0.976 25932 stop_ save_