data_15924_sparta save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 15924 _Entry.PDB_ID 2K7P _Entry.NMR_STAR_version 3.0.9.100 save_ save_delta_chem_shifts_single _Entity_delta_chem_shifts.Sf_category delta_chem_shifts _Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_single _Entity_delta_chem_shifts.Conformer_type "single" _Entity_delta_chem_shifts.Conformer_count 40 _Entity_delta_chem_shifts.Best_conformer 1 _Entity_delta_chem_shifts.ID 1 loop_ _Delta_CS.Assigned_chem_shift_list_ID _Delta_CS.Atom_chem_shift_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Conformer_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.PDB_asym_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entity_delta_chem_shifts_ID 1 4 . 1 1 1 A 2 2 ALA HA H -2 4.368 4.128 0.240 1 1 8 . 1 1 1 A 2 2 ALA CA C -2 52.604 53.953 -1.349 1 1 9 . 1 1 1 A 2 2 ALA CB C -2 19.551 19.599 -0.048 1 1 32 . 1 1 1 A 5 5 PRO HA H 1773 4.433 4.653 -0.220 1 1 39 . 1 1 1 A 5 5 PRO CA C 1773 63.017 62.433 0.584 1 1 40 . 1 1 1 A 5 5 PRO CB C 1773 32.155 33.007 -0.852 1 1 43 . 1 1 1 A 6 6 GLU H H 1774 8.495 8.969 -0.474 1 1 44 . 1 1 1 A 6 6 GLU HA H 1774 4.242 4.469 -0.227 1 1 49 . 1 1 1 A 6 6 GLU CA C 1774 56.735 56.469 0.266 1 1 50 . 1 1 1 A 6 6 GLU CB C 1774 30.401 29.762 0.639 1 1 52 . 1 1 1 A 6 6 GLU N N 1774 122.494 119.433 3.061 1 1 53 . 1 1 1 A 7 7 ARG H H 1775 8.275 7.956 0.319 1 1 54 . 1 1 1 A 7 7 ARG HA H 1775 4.648 4.654 -0.006 1 1 61 . 1 1 1 A 7 7 ARG CA C 1775 53.827 54.354 -0.527 1 1 62 . 1 1 1 A 7 7 ARG CB C 1775 30.417 30.396 0.021 1 1 65 . 1 1 1 A 7 7 ARG N N 1775 124.017 117.783 6.234 1 1 66 . 1 1 1 A 8 8 PRO HA H 1776 4.433 4.715 -0.282 1 1 73 . 1 1 1 A 8 8 PRO CA C 1776 63.036 62.817 0.219 1 1 74 . 1 1 1 A 8 8 PRO CB C 1776 32.201 33.066 -0.865 1 1 77 . 1 1 1 A 9 9 LEU H H 1777 8.349 8.641 -0.292 1 1 78 . 1 1 1 A 9 9 LEU HA H 1777 4.365 4.810 -0.445 1 1 88 . 1 1 1 A 9 9 LEU CA C 1777 55.275 54.063 1.212 1 1 89 . 1 1 1 A 9 9 LEU CB C 1777 42.376 46.053 -3.677 1 1 93 . 1 1 1 A 9 9 LEU N N 1777 123.820 121.703 2.117 1 1 94 . 1 1 1 A 10 10 VAL H H 1778 7.989 8.803 -0.814 1 1 95 . 1 1 1 A 10 10 VAL HA H 1778 4.182 4.925 -0.743 1 1 103 . 1 1 1 A 10 10 VAL CA C 1778 62.141 60.577 1.564 1 1 104 . 1 1 1 A 10 10 VAL CB C 1778 33.175 34.300 -1.125 1 1 106 . 1 1 1 A 10 10 VAL N N 1778 121.714 125.954 -4.240 1 1 107 . 1 1 1 A 11 11 GLY H H 1779 8.450 8.640 -0.190 1 1 108 . 1 1 1 A 11 11 GLY HA2 H 1779 4.002 4.375 -0.373 1 1 109 . 1 1 1 A 11 11 GLY HA3 H 1779 4.002 4.375 -0.373 1 1 110 . 1 1 1 A 11 11 GLY CA C 1779 45.297 44.732 0.565 1 1 111 . 1 1 1 A 11 11 GLY N N 1779 113.826 113.870 -0.044 1 1 112 . 1 1 1 A 12 12 VAL H H 1780 8.013 9.068 -1.055 1 1 113 . 1 1 1 A 12 12 VAL HA H 1780 4.136 4.256 -0.120 1 1 121 . 1 1 1 A 12 12 VAL CA C 1780 62.466 62.013 0.453 1 1 122 . 1 1 1 A 12 12 VAL CB C 1780 32.752 32.376 0.376 1 1 125 . 1 1 1 A 12 12 VAL N N 1780 120.109 121.318 -1.209 1 1 126 . 1 1 1 A 13 13 ASN H H 1781 8.528 8.766 -0.238 1 1 127 . 1 1 1 A 13 13 ASN HA H 1781 4.712 4.894 -0.182 1 1 132 . 1 1 1 A 13 13 ASN CA C 1781 53.485 53.837 -0.352 1 1 133 . 1 1 1 A 13 13 ASN CB C 1781 38.996 39.164 -0.168 1 1 134 . 1 1 1 A 13 13 ASN N N 1781 122.648 125.026 -2.378 1 1 136 . 1 1 1 A 14 14 GLY H H 1782 8.283 7.805 0.478 1 1 137 . 1 1 1 A 14 14 GLY HA2 H 1782 3.929 4.063 -0.134 1 1 138 . 1 1 1 A 14 14 GLY HA3 H 1782 3.929 4.066 -0.137 1 1 139 . 1 1 1 A 14 14 GLY CA C 1782 45.531 44.974 0.557 1 1 140 . 1 1 1 A 14 14 GLY N N 1782 110.229 107.595 2.634 1 1 141 . 1 1 1 A 15 15 LEU H H 1783 7.925 8.300 -0.375 1 1 142 . 1 1 1 A 15 15 LEU HA H 1783 4.340 4.935 -0.595 1 1 152 . 1 1 1 A 15 15 LEU CA C 1783 55.045 53.713 1.332 1 1 153 . 1 1 1 A 15 15 LEU CB C 1783 42.682 43.944 -1.262 1 1 157 . 1 1 1 A 15 15 LEU N N 1783 122.626 122.361 0.265 1 1 158 . 1 1 1 A 16 16 ASP H H 1784 8.360 8.410 -0.050 1 1 159 . 1 1 1 A 16 16 ASP HA H 1784 4.747 5.062 -0.315 1 1 162 . 1 1 1 A 16 16 ASP CA C 1784 53.939 52.826 1.113 1 1 163 . 1 1 1 A 16 16 ASP CB C 1784 41.150 44.429 -3.279 1 1 164 . 1 1 1 A 16 16 ASP N N 1784 122.868 119.868 3.000 1 1 165 . 1 1 1 A 17 17 VAL H H 1785 8.201 8.582 -0.381 1 1 166 . 1 1 1 A 17 17 VAL HA H 1785 4.237 3.879 0.358 1 1 174 . 1 1 1 A 17 17 VAL CA C 1785 62.881 64.945 -2.064 1 1 175 . 1 1 1 A 17 17 VAL CB C 1785 31.967 31.817 0.150 1 1 178 . 1 1 1 A 17 17 VAL N N 1785 121.110 123.899 -2.789 1 1 179 . 1 1 1 A 18 18 THR H H 1786 8.291 7.794 0.497 1 1 180 . 1 1 1 A 18 18 THR HA H 1786 4.466 4.012 0.454 1 1 185 . 1 1 1 A 18 18 THR CA C 1786 62.388 64.894 -2.506 1 1 186 . 1 1 1 A 18 18 THR CB C 1786 69.719 68.825 0.894 1 1 188 . 1 1 1 A 18 18 THR N N 1786 115.267 115.607 -0.340 1 1 189 . 1 1 1 A 19 19 SER H H 1787 8.148 7.879 0.269 1 1 190 . 1 1 1 A 19 19 SER HA H 1787 4.542 4.626 -0.084 1 1 193 . 1 1 1 A 19 19 SER CA C 1787 59.096 58.181 0.915 1 1 194 . 1 1 1 A 19 19 SER CB C 1787 63.993 65.182 -1.189 1 1 195 . 1 1 1 A 19 19 SER N N 1787 118.576 110.869 7.707 1 1 196 . 1 1 1 A 20 20 LEU H H 1788 8.263 7.825 0.438 1 1 197 . 1 1 1 A 20 20 LEU HA H 1788 4.243 4.873 -0.630 1 1 207 . 1 1 1 A 20 20 LEU CA C 1788 54.087 53.433 0.654 1 1 208 . 1 1 1 A 20 20 LEU CB C 1788 43.006 44.426 -1.420 1 1 212 . 1 1 1 A 20 20 LEU N N 1788 125.834 122.948 2.886 1 1 213 . 1 1 1 A 21 21 ARG H H 1789 8.191 8.507 -0.316 1 1 214 . 1 1 1 A 21 21 ARG HA H 1789 4.080 4.405 -0.325 1 1 222 . 1 1 1 A 21 21 ARG CA C 1789 54.894 54.102 0.792 1 1 223 . 1 1 1 A 21 21 ARG CB C 1789 30.881 30.501 0.380 1 1 226 . 1 1 1 A 21 21 ARG N N 1789 127.213 123.048 4.165 1 1 228 . 1 1 1 A 22 22 PRO HA H 1790 4.441 4.670 -0.229 1 1 233 . 1 1 1 A 22 22 PRO CA C 1790 62.882 62.581 0.301 1 1 234 . 1 1 1 A 22 22 PRO CB C 1790 32.204 32.535 -0.331 1 1 237 . 1 1 1 A 23 23 PHE H H 1791 8.336 8.386 -0.050 1 1 238 . 1 1 1 A 23 23 PHE HA H 1791 4.701 5.072 -0.371 1 1 246 . 1 1 1 A 23 23 PHE CA C 1791 57.504 56.931 0.573 1 1 247 . 1 1 1 A 23 23 PHE CB C 1791 42.192 41.760 0.432 1 1 251 . 1 1 1 A 23 23 PHE N N 1791 122.145 122.184 -0.039 1 1 252 . 1 1 1 A 24 24 ASP H H 1792 6.954 9.284 -2.330 1 1 253 . 1 1 1 A 24 24 ASP HA H 1792 5.039 5.498 -0.459 1 1 256 . 1 1 1 A 24 24 ASP CA C 1792 52.871 52.774 0.097 1 1 257 . 1 1 1 A 24 24 ASP CB C 1792 44.696 44.347 0.349 1 1 258 . 1 1 1 A 24 24 ASP N N 1792 127.481 126.378 1.103 1 1 259 . 1 1 1 A 25 25 LEU H H 1793 8.372 8.817 -0.445 1 1 260 . 1 1 1 A 25 25 LEU HA H 1793 4.336 5.046 -0.710 1 1 270 . 1 1 1 A 25 25 LEU CA C 1793 54.860 53.173 1.687 1 1 271 . 1 1 1 A 25 25 LEU CB C 1793 47.575 46.741 0.834 1 1 274 . 1 1 1 A 25 25 LEU N N 1793 123.241 124.089 -0.848 1 1 275 . 1 1 1 A 26 26 VAL H H 1794 8.489 8.948 -0.459 1 1 276 . 1 1 1 A 26 26 VAL HA H 1794 4.903 5.009 -0.106 1 1 284 . 1 1 1 A 26 26 VAL CA C 1794 61.669 59.892 1.777 1 1 285 . 1 1 1 A 26 26 VAL CB C 1794 32.458 35.783 -3.325 1 1 288 . 1 1 1 A 26 26 VAL N N 1794 128.849 120.210 8.639 1 1 289 . 1 1 1 A 27 27 ILE H H 1795 9.101 9.185 -0.084 1 1 290 . 1 1 1 A 27 27 ILE HA H 1795 4.701 4.445 0.256 1 1 300 . 1 1 1 A 27 27 ILE CA C 1795 57.433 57.472 -0.039 1 1 301 . 1 1 1 A 27 27 ILE CB C 1795 41.865 41.728 0.137 1 1 305 . 1 1 1 A 27 27 ILE N N 1795 127.511 128.140 -0.629 1 1 306 . 1 1 1 A 28 28 PRO HA H 1796 4.838 4.849 -0.011 1 1 313 . 1 1 1 A 28 28 PRO CA C 1796 62.406 62.711 -0.305 1 1 314 . 1 1 1 A 28 28 PRO CB C 1796 30.684 31.607 -0.923 1 1 317 . 1 1 1 A 29 29 PHE H H 1797 8.255 8.407 -0.152 1 1 318 . 1 1 1 A 29 29 PHE HA H 1797 4.151 4.959 -0.808 1 1 326 . 1 1 1 A 29 29 PHE CA C 1797 60.405 58.227 2.178 1 1 327 . 1 1 1 A 29 29 PHE CB C 1797 41.395 42.205 -0.810 1 1 331 . 1 1 1 A 29 29 PHE N N 1797 128.572 122.680 5.892 1 1 332 . 1 1 1 A 30 30 THR H H 1798 7.433 7.692 -0.259 1 1 333 . 1 1 1 A 30 30 THR HA H 1798 4.108 5.038 -0.930 1 1 338 . 1 1 1 A 30 30 THR CA C 1798 61.473 61.319 0.154 1 1 339 . 1 1 1 A 30 30 THR CB C 1798 69.324 71.724 -2.400 1 1 341 . 1 1 1 A 30 30 THR N N 1798 123.124 118.309 4.815 1 1 342 . 1 1 1 A 31 31 ILE H H 1799 8.402 9.391 -0.989 1 1 343 . 1 1 1 A 31 31 ILE HA H 1799 3.653 4.331 -0.678 1 1 353 . 1 1 1 A 31 31 ILE CA C 1799 61.802 61.334 0.468 1 1 354 . 1 1 1 A 31 31 ILE CB C 1799 38.548 38.233 0.315 1 1 358 . 1 1 1 A 31 31 ILE N N 1799 128.616 127.451 1.165 1 1 359 . 1 1 1 A 32 32 LYS H H 1800 7.742 8.783 -1.041 1 1 360 . 1 1 1 A 32 32 LYS HA H 1800 4.558 4.554 0.004 1 1 365 . 1 1 1 A 32 32 LYS CA C 1800 56.566 57.691 -1.125 1 1 366 . 1 1 1 A 32 32 LYS CB C 1800 31.982 35.608 -3.626 1 1 368 . 1 1 1 A 32 32 LYS N N 1800 128.656 128.638 0.018 1 1 369 . 1 1 1 A 33 33 LYS HA H 1801 4.531 4.884 -0.353 1 1 378 . 1 1 1 A 33 33 LYS CA C 1801 56.310 55.798 0.512 1 1 379 . 1 1 1 A 33 33 LYS CB C 1801 33.027 36.067 -3.040 1 1 383 . 1 1 1 A 34 34 GLY H H 1802 8.088 8.474 -0.386 1 1 384 . 1 1 1 A 34 34 GLY HA2 H 1802 4.159 4.051 0.108 1 1 385 . 1 1 1 A 34 34 GLY HA3 H 1802 3.712 4.057 -0.345 1 1 386 . 1 1 1 A 34 34 GLY CA C 1802 45.302 44.289 1.013 1 1 387 . 1 1 1 A 34 34 GLY N N 1802 110.338 112.716 -2.378 1 1 388 . 1 1 1 A 35 35 GLU H H 1803 8.219 8.081 0.138 1 1 389 . 1 1 1 A 35 35 GLU HA H 1803 4.692 4.929 -0.237 1 1 394 . 1 1 1 A 35 35 GLU CA C 1803 55.160 55.281 -0.121 1 1 395 . 1 1 1 A 35 35 GLU CB C 1803 32.407 33.973 -1.566 1 1 397 . 1 1 1 A 35 35 GLU N N 1803 119.576 120.409 -0.833 1 1 398 . 1 1 1 A 36 36 ILE H H 1804 8.869 8.743 0.126 1 1 399 . 1 1 1 A 36 36 ILE HA H 1804 5.468 5.217 0.251 1 1 409 . 1 1 1 A 36 36 ILE CA C 1804 58.861 58.770 0.091 1 1 410 . 1 1 1 A 36 36 ILE CB C 1804 41.007 41.784 -0.777 1 1 414 . 1 1 1 A 36 36 ILE N N 1804 128.141 124.327 3.814 1 1 415 . 1 1 1 A 37 37 THR H H 1805 9.075 8.902 0.173 1 1 416 . 1 1 1 A 37 37 THR HA H 1805 4.703 5.111 -0.408 1 1 421 . 1 1 1 A 37 37 THR CA C 1805 59.932 60.028 -0.096 1 1 422 . 1 1 1 A 37 37 THR CB C 1805 72.441 72.417 0.024 1 1 424 . 1 1 1 A 37 37 THR N N 1805 119.846 116.831 3.015 1 1 425 . 1 1 1 A 38 38 GLY H H 1806 8.468 8.378 0.090 1 1 426 . 1 1 1 A 38 38 GLY HA2 H 1806 5.076 4.249 0.827 1 1 427 . 1 1 1 A 38 38 GLY HA3 H 1806 3.503 4.258 -0.755 1 1 428 . 1 1 1 A 38 38 GLY CA C 1806 45.593 45.823 -0.230 1 1 429 . 1 1 1 A 38 38 GLY N N 1806 107.815 108.412 -0.597 1 1 430 . 1 1 1 A 39 39 GLU H H 1807 8.519 8.608 -0.089 1 1 431 . 1 1 1 A 39 39 GLU HA H 1807 4.713 5.180 -0.467 1 1 436 . 1 1 1 A 39 39 GLU CA C 1807 56.936 55.596 1.340 1 1 437 . 1 1 1 A 39 39 GLU CB C 1807 34.937 33.953 0.984 1 1 439 . 1 1 1 A 39 39 GLU N N 1807 120.173 119.728 0.445 1 1 440 . 1 1 1 A 40 40 VAL H H 1808 9.156 9.421 -0.265 1 1 441 . 1 1 1 A 40 40 VAL HA H 1808 4.778 4.813 -0.035 1 1 449 . 1 1 1 A 40 40 VAL CA C 1808 60.574 61.115 -0.541 1 1 450 . 1 1 1 A 40 40 VAL CB C 1808 34.168 33.899 0.269 1 1 452 . 1 1 1 A 40 40 VAL N N 1808 126.330 127.042 -0.712 1 1 453 . 1 1 1 A 41 41 ARG H H 1809 9.044 8.897 0.147 1 1 454 . 1 1 1 A 41 41 ARG HA H 1809 4.778 5.010 -0.232 1 1 462 . 1 1 1 A 41 41 ARG CA C 1809 55.317 54.288 1.029 1 1 463 . 1 1 1 A 41 41 ARG CB C 1809 31.940 33.255 -1.315 1 1 466 . 1 1 1 A 41 41 ARG N N 1809 127.098 126.180 0.918 1 1 468 . 1 1 1 A 42 42 MET H H 1810 8.264 8.651 -0.387 1 1 469 . 1 1 1 A 42 42 MET HA H 1810 4.050 4.798 -0.748 1 1 477 . 1 1 1 A 42 42 MET CA C 1810 53.716 53.788 -0.072 1 1 478 . 1 1 1 A 42 42 MET CB C 1810 32.779 33.613 -0.834 1 1 481 . 1 1 1 A 42 42 MET N N 1810 123.461 123.152 0.309 1 1 482 . 1 1 1 A 43 43 PRO HA H 1811 4.179 4.175 0.004 1 1 489 . 1 1 1 A 43 43 PRO CA C 1811 66.422 64.831 1.591 1 1 490 . 1 1 1 A 43 43 PRO CB C 1811 31.462 31.820 -0.358 1 1 493 . 1 1 1 A 44 44 SER H H 1812 8.860 7.768 1.092 1 1 494 . 1 1 1 A 44 44 SER HA H 1812 5.516 4.497 1.019 1 1 497 . 1 1 1 A 44 44 SER CA C 1812 59.937 58.602 1.335 1 1 498 . 1 1 1 A 44 44 SER CB C 1812 62.755 63.390 -0.635 1 1 499 . 1 1 1 A 44 44 SER N N 1812 112.267 112.350 -0.083 1 1 500 . 1 1 1 A 45 45 GLY H H 1813 8.368 7.941 0.427 1 1 501 . 1 1 1 A 45 45 GLY HA2 H 1813 4.461 3.886 0.575 1 1 502 . 1 1 1 A 45 45 GLY HA3 H 1813 3.569 3.892 -0.323 1 1 503 . 1 1 1 A 45 45 GLY CA C 1813 44.525 45.392 -0.867 1 1 504 . 1 1 1 A 45 45 GLY N N 1813 112.727 109.608 3.119 1 1 505 . 1 1 1 A 46 46 LYS H H 1814 7.126 7.838 -0.712 1 1 506 . 1 1 1 A 46 46 LYS HA H 1814 4.206 4.589 -0.383 1 1 515 . 1 1 1 A 46 46 LYS CA C 1814 57.460 55.627 1.833 1 1 516 . 1 1 1 A 46 46 LYS CB C 1814 33.453 34.081 -0.628 1 1 520 . 1 1 1 A 46 46 LYS N N 1814 122.101 120.121 1.980 1 1 521 . 1 1 1 A 47 47 VAL H H 1815 8.056 8.932 -0.876 1 1 522 . 1 1 1 A 47 47 VAL HA H 1815 5.400 5.069 0.331 1 1 530 . 1 1 1 A 47 47 VAL CA C 1815 60.048 59.574 0.474 1 1 531 . 1 1 1 A 47 47 VAL CB C 1815 35.044 36.122 -1.078 1 1 534 . 1 1 1 A 47 47 VAL N N 1815 118.680 118.338 0.342 1 1 535 . 1 1 1 A 48 48 ALA H H 1816 9.110 8.494 0.616 1 1 536 . 1 1 1 A 48 48 ALA HA H 1816 4.804 4.876 -0.072 1 1 540 . 1 1 1 A 48 48 ALA CA C 1816 50.808 51.300 -0.492 1 1 541 . 1 1 1 A 48 48 ALA CB C 1816 24.108 23.746 0.362 1 1 542 . 1 1 1 A 48 48 ALA N N 1816 128.274 123.755 4.519 1 1 543 . 1 1 1 A 49 49 GLN H H 1817 8.725 8.563 0.162 1 1 544 . 1 1 1 A 49 49 GLN HA H 1817 5.069 4.862 0.207 1 1 551 . 1 1 1 A 49 49 GLN CA C 1817 53.524 52.228 1.296 1 1 552 . 1 1 1 A 49 49 GLN CB C 1817 30.432 29.534 0.898 1 1 554 . 1 1 1 A 49 49 GLN N N 1817 120.102 118.508 1.594 1 1 556 . 1 1 1 A 50 50 PRO HA H 1818 5.136 4.790 0.346 1 1 563 . 1 1 1 A 50 50 PRO CA C 1818 61.966 62.413 -0.447 1 1 564 . 1 1 1 A 50 50 PRO CB C 1818 32.722 32.871 -0.149 1 1 567 . 1 1 1 A 51 51 THR H H 1819 9.072 8.611 0.461 1 1 568 . 1 1 1 A 51 51 THR HA H 1819 4.566 5.058 -0.492 1 1 573 . 1 1 1 A 51 51 THR CA C 1819 62.695 60.815 1.880 1 1 574 . 1 1 1 A 51 51 THR CB C 1819 70.056 70.747 -0.691 1 1 576 . 1 1 1 A 51 51 THR N N 1819 117.512 113.253 4.259 1 1 577 . 1 1 1 A 52 52 ILE H H 1820 8.900 9.199 -0.299 1 1 578 . 1 1 1 A 52 52 ILE HA H 1820 4.905 5.173 -0.268 1 1 588 . 1 1 1 A 52 52 ILE CA C 1820 60.869 59.538 1.331 1 1 589 . 1 1 1 A 52 52 ILE CB C 1820 39.670 40.438 -0.768 1 1 593 . 1 1 1 A 52 52 ILE N N 1820 129.513 127.143 2.370 1 1 594 . 1 1 1 A 53 53 THR H H 1821 9.200 9.202 -0.002 1 1 595 . 1 1 1 A 53 53 THR HA H 1821 4.541 4.800 -0.259 1 1 600 . 1 1 1 A 53 53 THR CA C 1821 61.084 61.618 -0.534 1 1 601 . 1 1 1 A 53 53 THR CB C 1821 71.410 71.983 -0.573 1 1 603 . 1 1 1 A 53 53 THR N N 1821 125.271 123.627 1.644 1 1 604 . 1 1 1 A 54 54 ASP H H 1822 8.918 8.763 0.155 1 1 605 . 1 1 1 A 54 54 ASP HA H 1822 4.756 4.821 -0.065 1 1 608 . 1 1 1 A 54 54 ASP CA C 1822 53.906 54.631 -0.725 1 1 609 . 1 1 1 A 54 54 ASP CB C 1822 41.443 41.807 -0.364 1 1 610 . 1 1 1 A 54 54 ASP N N 1822 126.647 126.861 -0.214 1 1 611 . 1 1 1 A 55 55 ASN H H 1823 8.342 8.948 -0.606 1 1 612 . 1 1 1 A 55 55 ASN HA H 1823 4.704 4.669 0.035 1 1 617 . 1 1 1 A 55 55 ASN CA C 1823 54.421 53.018 1.403 1 1 618 . 1 1 1 A 55 55 ASN CB C 1823 38.557 38.724 -0.167 1 1 619 . 1 1 1 A 55 55 ASN N N 1823 126.271 124.095 2.176 1 1 621 . 1 1 1 A 56 56 LYS H H 1824 9.232 8.011 1.221 1 1 622 . 1 1 1 A 56 56 LYS HA H 1824 4.099 4.037 0.062 1 1 631 . 1 1 1 A 56 56 LYS CA C 1824 58.015 57.397 0.618 1 1 632 . 1 1 1 A 56 56 LYS CB C 1824 28.691 29.172 -0.481 1 1 636 . 1 1 1 A 56 56 LYS N N 1824 115.352 115.155 0.197 1 1 637 . 1 1 1 A 57 57 ASP H H 1825 7.905 8.092 -0.187 1 1 638 . 1 1 1 A 57 57 ASP HA H 1825 4.791 4.815 -0.024 1 1 641 . 1 1 1 A 57 57 ASP CA C 1825 52.401 53.603 -1.202 1 1 642 . 1 1 1 A 57 57 ASP CB C 1825 41.166 41.135 0.031 1 1 643 . 1 1 1 A 57 57 ASP N N 1825 119.741 118.976 0.765 1 1 644 . 1 1 1 A 58 58 GLY H H 1826 8.930 8.905 0.025 1 1 645 . 1 1 1 A 58 58 GLY HA2 H 1826 4.265 3.888 0.377 1 1 646 . 1 1 1 A 58 58 GLY HA3 H 1826 3.712 3.900 -0.188 1 1 647 . 1 1 1 A 58 58 GLY CA C 1826 44.870 45.438 -0.568 1 1 648 . 1 1 1 A 58 58 GLY N N 1826 109.578 108.327 1.251 1 1 649 . 1 1 1 A 59 59 THR H H 1827 8.004 7.641 0.363 1 1 650 . 1 1 1 A 59 59 THR HA H 1827 5.394 5.097 0.297 1 1 655 . 1 1 1 A 59 59 THR CA C 1827 60.262 59.133 1.129 1 1 656 . 1 1 1 A 59 59 THR CB C 1827 73.892 72.733 1.159 1 1 658 . 1 1 1 A 59 59 THR N N 1827 112.179 110.110 2.069 1 1 659 . 1 1 1 A 60 60 VAL H H 1828 8.822 9.259 -0.437 1 1 660 . 1 1 1 A 60 60 VAL HA H 1828 5.124 4.907 0.217 1 1 668 . 1 1 1 A 60 60 VAL CA C 1828 59.430 59.820 -0.390 1 1 669 . 1 1 1 A 60 60 VAL CB C 1828 35.088 34.241 0.847 1 1 672 . 1 1 1 A 60 60 VAL N N 1828 115.300 117.520 -2.220 1 1 673 . 1 1 1 A 61 61 THR H H 1829 9.115 9.113 0.002 1 1 674 . 1 1 1 A 61 61 THR HA H 1829 5.128 4.986 0.142 1 1 679 . 1 1 1 A 61 61 THR CA C 1829 61.934 62.116 -0.182 1 1 680 . 1 1 1 A 61 61 THR CB C 1829 70.561 70.272 0.289 1 1 682 . 1 1 1 A 61 61 THR N N 1829 121.210 120.419 0.791 1 1 683 . 1 1 1 A 62 62 VAL H H 1830 9.530 9.086 0.444 1 1 684 . 1 1 1 A 62 62 VAL HA H 1830 4.803 5.020 -0.217 1 1 692 . 1 1 1 A 62 62 VAL CA C 1830 60.580 60.533 0.047 1 1 693 . 1 1 1 A 62 62 VAL CB C 1830 33.747 34.552 -0.805 1 1 696 . 1 1 1 A 62 62 VAL N N 1830 129.896 125.314 4.582 1 1 697 . 1 1 1 A 63 63 ARG H H 1831 8.879 9.024 -0.145 1 1 698 . 1 1 1 A 63 63 ARG HA H 1831 5.282 5.138 0.144 1 1 705 . 1 1 1 A 63 63 ARG CA C 1831 54.759 53.919 0.840 1 1 706 . 1 1 1 A 63 63 ARG CB C 1831 34.410 34.434 -0.024 1 1 709 . 1 1 1 A 63 63 ARG N N 1831 125.701 125.584 0.117 1 1 710 . 1 1 1 A 64 64 TYR H H 1832 8.878 8.799 0.079 1 1 711 . 1 1 1 A 64 64 TYR HA H 1832 4.888 4.989 -0.101 1 1 718 . 1 1 1 A 64 64 TYR CA C 1832 57.694 57.742 -0.048 1 1 719 . 1 1 1 A 64 64 TYR CB C 1832 42.389 42.057 0.332 1 1 722 . 1 1 1 A 64 64 TYR N N 1832 122.731 123.713 -0.982 1 1 723 . 1 1 1 A 65 65 ALA H H 1833 7.925 8.307 -0.382 1 1 724 . 1 1 1 A 65 65 ALA HA H 1833 4.736 4.464 0.272 1 1 728 . 1 1 1 A 65 65 ALA CA C 1833 47.938 49.554 -1.616 1 1 729 . 1 1 1 A 65 65 ALA CB C 1833 18.320 19.523 -1.203 1 1 730 . 1 1 1 A 65 65 ALA N N 1833 135.415 128.973 6.442 1 1 731 . 1 1 1 A 66 66 PRO HA H 1834 4.198 4.743 -0.545 1 1 738 . 1 1 1 A 66 66 PRO CA C 1834 62.701 62.347 0.354 1 1 739 . 1 1 1 A 66 66 PRO CB C 1834 34.445 33.255 1.190 1 1 742 . 1 1 1 A 67 67 SER H H 1835 9.019 8.589 0.430 1 1 743 . 1 1 1 A 67 67 SER HA H 1835 4.555 4.812 -0.257 1 1 746 . 1 1 1 A 67 67 SER CA C 1835 57.320 57.843 -0.523 1 1 747 . 1 1 1 A 67 67 SER CB C 1835 64.778 65.393 -0.615 1 1 748 . 1 1 1 A 67 67 SER N N 1835 112.422 114.064 -1.642 1 1 749 . 1 1 1 A 68 68 GLU H H 1836 7.625 7.750 -0.125 1 1 750 . 1 1 1 A 68 68 GLU HA H 1836 4.513 4.806 -0.293 1 1 755 . 1 1 1 A 68 68 GLU CA C 1836 54.777 54.620 0.157 1 1 756 . 1 1 1 A 68 68 GLU CB C 1836 33.981 34.740 -0.759 1 1 758 . 1 1 1 A 68 68 GLU N N 1836 123.025 119.812 3.213 1 1 759 . 1 1 1 A 69 69 ALA H H 1837 8.133 8.588 -0.455 1 1 760 . 1 1 1 A 69 69 ALA HA H 1837 4.088 4.422 -0.334 1 1 764 . 1 1 1 A 69 69 ALA CA C 1837 51.070 51.799 -0.729 1 1 765 . 1 1 1 A 69 69 ALA CB C 1837 19.665 19.947 -0.282 1 1 766 . 1 1 1 A 69 69 ALA N N 1837 122.311 124.979 -2.668 1 1 767 . 1 1 1 A 70 70 GLY H H 1838 9.120 7.907 1.213 1 1 768 . 1 1 1 A 70 70 GLY HA2 H 1838 4.453 3.761 0.692 1 1 769 . 1 1 1 A 70 70 GLY HA3 H 1838 2.953 3.925 -0.972 1 1 770 . 1 1 1 A 70 70 GLY CA C 1838 43.362 43.386 -0.024 1 1 771 . 1 1 1 A 70 70 GLY N N 1838 107.031 105.890 1.141 1 1 772 . 1 1 1 A 71 71 LEU H H 1839 9.096 8.237 0.859 1 1 773 . 1 1 1 A 71 71 LEU HA H 1839 4.336 4.608 -0.272 1 1 783 . 1 1 1 A 71 71 LEU CA C 1839 56.657 53.922 2.735 1 1 784 . 1 1 1 A 71 71 LEU CB C 1839 42.032 43.587 -1.555 1 1 788 . 1 1 1 A 71 71 LEU N N 1839 127.931 121.674 6.257 1 1 789 . 1 1 1 A 72 72 HIS H H 1840 9.359 9.470 -0.111 1 1 790 . 1 1 1 A 72 72 HIS HA H 1840 4.595 5.253 -0.658 1 1 796 . 1 1 1 A 72 72 HIS CA C 1840 54.539 54.151 0.388 1 1 797 . 1 1 1 A 72 72 HIS CB C 1840 31.421 33.983 -2.562 1 1 800 . 1 1 1 A 72 72 HIS N N 1840 128.527 125.075 3.452 1 1 802 . 1 1 1 A 73 73 GLU H H 1841 7.925 9.270 -1.345 1 1 803 . 1 1 1 A 73 73 GLU HA H 1841 5.142 5.359 -0.217 1 1 808 . 1 1 1 A 73 73 GLU CA C 1841 54.381 54.919 -0.538 1 1 809 . 1 1 1 A 73 73 GLU CB C 1841 34.043 33.942 0.101 1 1 811 . 1 1 1 A 73 73 GLU N N 1841 119.347 118.632 0.715 1 1 812 . 1 1 1 A 74 74 MET H H 1842 9.383 9.136 0.247 1 1 813 . 1 1 1 A 74 74 MET HA H 1842 5.548 5.255 0.293 1 1 821 . 1 1 1 A 74 74 MET CA C 1842 53.859 54.377 -0.518 1 1 822 . 1 1 1 A 74 74 MET CB C 1842 38.571 35.977 2.594 1 1 825 . 1 1 1 A 74 74 MET N N 1842 124.747 120.531 4.216 1 1 826 . 1 1 1 A 75 75 ASP H H 1843 9.005 9.013 -0.008 1 1 827 . 1 1 1 A 75 75 ASP HA H 1843 5.277 5.281 -0.004 1 1 830 . 1 1 1 A 75 75 ASP CA C 1843 52.774 53.380 -0.606 1 1 831 . 1 1 1 A 75 75 ASP CB C 1843 43.493 42.629 0.864 1 1 832 . 1 1 1 A 75 75 ASP N N 1843 128.148 125.616 2.532 1 1 833 . 1 1 1 A 76 76 ILE H H 1844 9.434 8.690 0.744 1 1 834 . 1 1 1 A 76 76 ILE HA H 1844 4.672 4.806 -0.134 1 1 844 . 1 1 1 A 76 76 ILE CA C 1844 60.715 59.826 0.889 1 1 845 . 1 1 1 A 76 76 ILE CB C 1844 39.470 40.931 -1.461 1 1 849 . 1 1 1 A 76 76 ILE N N 1844 124.097 123.267 0.830 1 1 850 . 1 1 1 A 77 77 ARG H H 1845 8.888 9.145 -0.257 1 1 851 . 1 1 1 A 77 77 ARG HA H 1845 5.050 4.833 0.217 1 1 859 . 1 1 1 A 77 77 ARG CA C 1845 53.780 54.156 -0.376 1 1 860 . 1 1 1 A 77 77 ARG CB C 1845 34.564 33.629 0.935 1 1 863 . 1 1 1 A 77 77 ARG N N 1845 124.944 124.392 0.552 1 1 865 . 1 1 1 A 78 78 TYR H H 1846 8.974 9.168 -0.194 1 1 866 . 1 1 1 A 78 78 TYR HA H 1846 5.151 4.935 0.216 1 1 873 . 1 1 1 A 78 78 TYR CA C 1846 55.909 57.582 -1.673 1 1 874 . 1 1 1 A 78 78 TYR CB C 1846 41.732 40.812 0.920 1 1 877 . 1 1 1 A 78 78 TYR N N 1846 121.774 124.258 -2.484 1 1 878 . 1 1 1 A 79 79 ASP H H 1847 9.026 9.368 -0.342 1 1 879 . 1 1 1 A 79 79 ASP HA H 1847 4.127 4.238 -0.111 1 1 882 . 1 1 1 A 79 79 ASP CA C 1847 55.808 55.101 0.707 1 1 883 . 1 1 1 A 79 79 ASP CB C 1847 39.181 39.576 -0.395 1 1 884 . 1 1 1 A 79 79 ASP N N 1847 131.304 128.049 3.255 1 1 885 . 1 1 1 A 80 80 ASN H H 1848 8.608 8.586 0.022 1 1 886 . 1 1 1 A 80 80 ASN HA H 1848 3.990 4.355 -0.365 1 1 891 . 1 1 1 A 80 80 ASN CA C 1848 55.149 54.898 0.251 1 1 892 . 1 1 1 A 80 80 ASN CB C 1848 38.470 37.033 1.437 1 1 893 . 1 1 1 A 80 80 ASN N N 1848 108.490 109.476 -0.986 1 1 895 . 1 1 1 A 81 81 MET H H 1849 7.820 7.922 -0.102 1 1 896 . 1 1 1 A 81 81 MET HA H 1849 4.819 4.914 -0.095 1 1 904 . 1 1 1 A 81 81 MET CA C 1849 53.852 54.452 -0.600 1 1 905 . 1 1 1 A 81 81 MET CB C 1849 34.665 34.990 -0.325 1 1 908 . 1 1 1 A 81 81 MET N N 1849 121.878 119.242 2.636 1 1 909 . 1 1 1 A 82 82 HIS H H 1850 8.575 8.769 -0.194 1 1 910 . 1 1 1 A 82 82 HIS HA H 1850 4.539 4.707 -0.168 1 1 915 . 1 1 1 A 82 82 HIS CA C 1850 58.819 57.344 1.475 1 1 916 . 1 1 1 A 82 82 HIS CB C 1850 32.419 30.581 1.838 1 1 919 . 1 1 1 A 82 82 HIS N N 1850 124.291 124.657 -0.366 1 1 920 . 1 1 1 A 83 83 ILE H H 1851 8.333 8.109 0.224 1 1 921 . 1 1 1 A 83 83 ILE HA H 1851 4.608 4.408 0.200 1 1 931 . 1 1 1 A 83 83 ILE CA C 1851 60.727 59.432 1.295 1 1 932 . 1 1 1 A 83 83 ILE CB C 1851 35.928 37.715 -1.787 1 1 936 . 1 1 1 A 83 83 ILE N N 1851 120.786 120.989 -0.203 1 1 937 . 1 1 1 A 84 84 PRO HA H 1852 4.426 4.332 0.094 1 1 944 . 1 1 1 A 84 84 PRO CA C 1852 65.249 64.024 1.225 1 1 945 . 1 1 1 A 84 84 PRO CB C 1852 31.120 31.451 -0.331 1 1 948 . 1 1 1 A 85 85 GLY H H 1853 8.498 8.996 -0.498 1 1 949 . 1 1 1 A 85 85 GLY HA2 H 1853 4.284 4.046 0.238 1 1 950 . 1 1 1 A 85 85 GLY HA3 H 1853 3.397 4.082 -0.685 1 1 951 . 1 1 1 A 85 85 GLY CA C 1853 44.913 45.206 -0.293 1 1 952 . 1 1 1 A 85 85 GLY N N 1853 114.093 113.755 0.338 1 1 953 . 1 1 1 A 86 86 SER H H 1854 7.823 7.996 -0.173 1 1 954 . 1 1 1 A 86 86 SER HA H 1854 4.834 4.726 0.108 1 1 957 . 1 1 1 A 86 86 SER CA C 1854 55.628 55.684 -0.056 1 1 958 . 1 1 1 A 86 86 SER CB C 1854 63.063 64.017 -0.954 1 1 959 . 1 1 1 A 86 86 SER N N 1854 112.722 117.596 -4.874 1 1 960 . 1 1 1 A 87 87 PRO HA H 1855 5.681 4.815 0.866 1 1 967 . 1 1 1 A 87 87 PRO CA C 1855 63.079 62.639 0.440 1 1 968 . 1 1 1 A 87 87 PRO CB C 1855 34.406 32.503 1.903 1 1 971 . 1 1 1 A 88 88 LEU H H 1856 9.168 8.740 0.428 1 1 972 . 1 1 1 A 88 88 LEU HA H 1856 4.909 4.951 -0.042 1 1 982 . 1 1 1 A 88 88 LEU CA C 1856 53.839 54.096 -0.257 1 1 983 . 1 1 1 A 88 88 LEU CB C 1856 45.558 43.828 1.730 1 1 987 . 1 1 1 A 88 88 LEU N N 1856 122.495 121.666 0.829 1 1 988 . 1 1 1 A 89 89 GLN H H 1857 9.583 8.751 0.832 1 1 989 . 1 1 1 A 89 89 GLN HA H 1857 5.508 5.302 0.206 1 1 996 . 1 1 1 A 89 89 GLN CA C 1857 54.609 54.980 -0.371 1 1 997 . 1 1 1 A 89 89 GLN CB C 1857 32.840 32.219 0.621 1 1 999 . 1 1 1 A 89 89 GLN N N 1857 119.151 121.366 -2.215 1 1 1001 . 1 1 1 A 90 90 PHE H H 1858 8.600 8.961 -0.361 1 1 1002 . 1 1 1 A 90 90 PHE HA H 1858 5.095 5.142 -0.047 1 1 1010 . 1 1 1 A 90 90 PHE CA C 1858 56.161 56.330 -0.169 1 1 1011 . 1 1 1 A 90 90 PHE CB C 1858 41.411 40.521 0.890 1 1 1015 . 1 1 1 A 90 90 PHE N N 1858 118.242 120.400 -2.158 1 1 1016 . 1 1 1 A 91 91 TYR H H 1859 9.892 8.785 1.107 1 1 1017 . 1 1 1 A 91 91 TYR HA H 1859 4.790 5.066 -0.276 1 1 1024 . 1 1 1 A 91 91 TYR CA C 1859 58.205 56.230 1.975 1 1 1025 . 1 1 1 A 91 91 TYR CB C 1859 40.867 41.693 -0.826 1 1 1028 . 1 1 1 A 91 91 TYR N N 1859 127.393 121.595 5.798 1 1 1029 . 1 1 1 A 92 92 VAL H H 1860 8.072 8.086 -0.014 1 1 1030 . 1 1 1 A 92 92 VAL HA H 1860 4.377 4.553 -0.176 1 1 1038 . 1 1 1 A 92 92 VAL CA C 1860 62.583 60.617 1.966 1 1 1039 . 1 1 1 A 92 92 VAL CB C 1860 33.609 33.585 0.024 1 1 1042 . 1 1 1 A 92 92 VAL N N 1860 132.007 125.594 6.413 1 1 1043 . 1 1 1 A 93 93 ASP H H 1861 8.438 8.945 -0.507 1 1 1044 . 1 1 1 A 93 93 ASP HA H 1861 5.024 4.939 0.085 1 1 1047 . 1 1 1 A 93 93 ASP CA C 1861 50.678 52.727 -2.049 1 1 1048 . 1 1 1 A 93 93 ASP CB C 1861 46.086 44.764 1.322 1 1 1049 . 1 1 1 A 93 93 ASP N N 1861 130.459 124.322 6.137 1 1 1050 . 1 1 1 A 94 94 TYR H H 1862 9.674 8.395 1.279 1 1 1051 . 1 1 1 A 94 94 TYR HA H 1862 4.606 4.676 -0.070 1 1 1058 . 1 1 1 A 94 94 TYR CA C 1862 58.983 57.469 1.514 1 1 1059 . 1 1 1 A 94 94 TYR CB C 1862 39.727 37.134 2.593 1 1 1062 . 1 1 1 A 94 94 TYR N N 1862 120.069 120.982 -0.913 1 1 1063 . 1 1 1 A 95 95 VAL H H 1863 8.371 8.023 0.348 1 1 1064 . 1 1 1 A 95 95 VAL HA H 1863 3.654 3.915 -0.261 1 1 1072 . 1 1 1 A 95 95 VAL CA C 1863 64.922 64.691 0.231 1 1 1073 . 1 1 1 A 95 95 VAL CB C 1863 32.270 31.757 0.513 1 1 1076 . 1 1 1 A 95 95 VAL N N 1863 121.770 125.240 -3.470 1 1 1077 . 1 1 1 A 96 96 ASN H H 1864 8.729 7.872 0.857 1 1 1078 . 1 1 1 A 96 96 ASN HA H 1864 4.901 4.709 0.192 1 1 1083 . 1 1 1 A 96 96 ASN CA C 1864 52.652 55.517 -2.865 1 1 1084 . 1 1 1 A 96 96 ASN CB C 1864 38.160 38.659 -0.499 1 1 1085 . 1 1 1 A 96 96 ASN N N 1864 120.006 118.450 1.556 1 1 1087 . 1 1 1 A 97 97 CYS H H 1865 7.875 7.705 0.170 1 1 1088 . 1 1 1 A 97 97 CYS HA H 1865 4.575 4.581 -0.006 1 1 1091 . 1 1 1 A 97 97 CYS CA C 1865 57.009 59.365 -2.356 1 1 1092 . 1 1 1 A 97 97 CYS CB C 1865 29.845 29.322 0.523 1 1 1093 . 1 1 1 A 97 97 CYS N N 1865 117.023 119.276 -2.253 1 1 1094 . 1 1 1 A 98 98 GLY HA2 H 1866 4.045 3.917 0.128 1 1 1095 . 1 1 1 A 98 98 GLY HA3 H 1866 3.866 3.943 -0.077 1 1 1096 . 1 1 1 A 98 98 GLY CA C 1866 46.078 45.681 0.397 1 1 1097 . 1 1 1 A 99 99 HIS H H 1867 7.144 8.015 -0.871 1 1 1098 . 1 1 1 A 99 99 HIS HA H 1867 4.940 4.510 0.430 1 1 1103 . 1 1 1 A 99 99 HIS CA C 1867 53.843 55.985 -2.142 1 1 1104 . 1 1 1 A 99 99 HIS CB C 1867 31.584 30.845 0.739 1 1 1107 . 1 1 1 A 99 99 HIS N N 1867 115.591 117.757 -2.166 1 1 1108 . 1 1 1 A 100 100 VAL H H 1868 8.434 8.544 -0.110 1 1 1109 . 1 1 1 A 100 100 VAL HA H 1868 4.143 4.156 -0.013 1 1 1117 . 1 1 1 A 100 100 VAL CA C 1868 63.974 63.092 0.882 1 1 1118 . 1 1 1 A 100 100 VAL CB C 1868 31.525 32.114 -0.589 1 1 1121 . 1 1 1 A 100 100 VAL N N 1868 122.851 120.979 1.872 1 1 1122 . 1 1 1 A 101 101 THR H H 1869 7.869 8.305 -0.436 1 1 1123 . 1 1 1 A 101 101 THR HA H 1869 5.217 4.941 0.276 1 1 1128 . 1 1 1 A 101 101 THR CA C 1869 59.495 60.897 -1.402 1 1 1129 . 1 1 1 A 101 101 THR CB C 1869 72.402 70.403 1.999 1 1 1131 . 1 1 1 A 101 101 THR N N 1869 118.578 121.400 -2.822 1 1 1132 . 1 1 1 A 102 102 ALA H H 1870 8.512 8.908 -0.396 1 1 1133 . 1 1 1 A 102 102 ALA HA H 1870 5.687 5.334 0.353 1 1 1137 . 1 1 1 A 102 102 ALA CA C 1870 50.497 50.828 -0.331 1 1 1138 . 1 1 1 A 102 102 ALA CB C 1870 23.128 23.523 -0.395 1 1 1139 . 1 1 1 A 102 102 ALA N N 1870 125.193 126.038 -0.845 1 1 1140 . 1 1 1 A 103 103 TYR H H 1871 8.753 8.790 -0.037 1 1 1141 . 1 1 1 A 103 103 TYR HA H 1871 5.019 5.196 -0.177 1 1 1148 . 1 1 1 A 103 103 TYR CA C 1871 56.303 56.100 0.203 1 1 1149 . 1 1 1 A 103 103 TYR CB C 1871 39.347 41.068 -1.721 1 1 1152 . 1 1 1 A 103 103 TYR N N 1871 119.968 116.787 3.181 1 1 1153 . 1 1 1 A 104 104 GLY H H 1872 9.006 8.586 0.420 1 1 1154 . 1 1 1 A 104 104 GLY HA2 H 1872 5.326 4.356 0.970 1 1 1155 . 1 1 1 A 104 104 GLY HA3 H 1872 4.226 4.384 -0.158 1 1 1156 . 1 1 1 A 104 104 GLY CA C 1872 44.624 44.619 0.005 1 1 1157 . 1 1 1 A 104 104 GLY N N 1872 109.622 106.955 2.667 1 1 1158 . 1 1 1 A 105 105 PRO HA H 1873 4.450 4.457 -0.007 1 1 1165 . 1 1 1 A 105 105 PRO CA C 1873 66.676 65.042 1.634 1 1 1166 . 1 1 1 A 105 105 PRO CB C 1873 32.425 32.118 0.307 1 1 1169 . 1 1 1 A 106 106 GLY H H 1874 9.251 8.662 0.589 1 1 1170 . 1 1 1 A 106 106 GLY HA2 H 1874 4.600 3.901 0.699 1 1 1171 . 1 1 1 A 106 106 GLY HA3 H 1874 3.521 4.130 -0.609 1 1 1172 . 1 1 1 A 106 106 GLY CA C 1874 46.454 47.055 -0.601 1 1 1173 . 1 1 1 A 106 106 GLY N N 1874 105.282 105.493 -0.211 1 1 1174 . 1 1 1 A 107 107 LEU H H 1875 7.161 7.841 -0.680 1 1 1175 . 1 1 1 A 107 107 LEU HA H 1875 4.062 3.961 0.101 1 1 1185 . 1 1 1 A 107 107 LEU CA C 1875 55.592 56.182 -0.590 1 1 1186 . 1 1 1 A 107 107 LEU CB C 1875 41.516 40.679 0.837 1 1 1190 . 1 1 1 A 107 107 LEU N N 1875 117.141 119.325 -2.184 1 1 1191 . 1 1 1 A 108 108 THR H H 1876 8.298 7.907 0.391 1 1 1192 . 1 1 1 A 108 108 THR HA H 1876 5.038 4.463 0.575 1 1 1197 . 1 1 1 A 108 108 THR CA C 1876 64.551 63.693 0.858 1 1 1198 . 1 1 1 A 108 108 THR CB C 1876 72.706 70.856 1.850 1 1 1200 . 1 1 1 A 108 108 THR N N 1876 114.411 112.164 2.247 1 1 1201 . 1 1 1 A 109 109 HIS H H 1877 9.030 7.938 1.092 1 1 1202 . 1 1 1 A 109 109 HIS HA H 1877 5.854 5.054 0.800 1 1 1207 . 1 1 1 A 109 109 HIS CA C 1877 56.127 54.828 1.299 1 1 1208 . 1 1 1 A 109 109 HIS CB C 1877 36.258 33.207 3.051 1 1 1211 . 1 1 1 A 109 109 HIS N N 1877 125.809 117.281 8.528 1 1 1212 . 1 1 1 A 110 110 GLY H H 1878 7.497 7.967 -0.470 1 1 1213 . 1 1 1 A 110 110 GLY HA2 H 1878 4.075 4.098 -0.023 1 1 1214 . 1 1 1 A 110 110 GLY HA3 H 1878 3.512 4.107 -0.595 1 1 1215 . 1 1 1 A 110 110 GLY CA C 1878 44.559 44.046 0.513 1 1 1216 . 1 1 1 A 110 110 GLY N N 1878 111.907 111.392 0.515 1 1 1217 . 1 1 1 A 111 111 VAL H H 1879 8.776 8.369 0.407 1 1 1218 . 1 1 1 A 111 111 VAL HA H 1879 4.741 4.754 -0.013 1 1 1226 . 1 1 1 A 111 111 VAL CA C 1879 60.188 60.505 -0.317 1 1 1227 . 1 1 1 A 111 111 VAL CB C 1879 35.130 35.374 -0.244 1 1 1230 . 1 1 1 A 111 111 VAL N N 1879 119.617 120.257 -0.640 1 1 1231 . 1 1 1 A 112 112 VAL H H 1880 7.841 8.639 -0.798 1 1 1232 . 1 1 1 A 112 112 VAL HA H 1880 3.343 3.918 -0.575 1 1 1240 . 1 1 1 A 112 112 VAL CA C 1880 63.553 62.700 0.853 1 1 1241 . 1 1 1 A 112 112 VAL CB C 1880 32.257 31.576 0.681 1 1 1243 . 1 1 1 A 112 112 VAL N N 1880 122.070 126.305 -4.235 1 1 1244 . 1 1 1 A 113 113 ASN H H 1881 8.822 9.078 -0.256 1 1 1245 . 1 1 1 A 113 113 ASN HA H 1881 4.079 4.342 -0.263 1 1 1250 . 1 1 1 A 113 113 ASN CA C 1881 55.459 54.973 0.486 1 1 1251 . 1 1 1 A 113 113 ASN CB C 1881 37.330 37.158 0.172 1 1 1252 . 1 1 1 A 113 113 ASN N N 1881 115.063 117.850 -2.787 1 1 1254 . 1 1 1 A 114 114 LYS H H 1882 8.073 7.516 0.557 1 1 1255 . 1 1 1 A 114 114 LYS HA H 1882 4.818 4.659 0.159 1 1 1260 . 1 1 1 A 114 114 LYS CA C 1882 53.039 52.677 0.362 1 1 1261 . 1 1 1 A 114 114 LYS CB C 1882 34.020 33.173 0.847 1 1 1263 . 1 1 1 A 114 114 LYS N N 1882 121.439 119.220 2.219 1 1 1264 . 1 1 1 A 115 115 PRO HA H 1883 4.409 4.714 -0.305 1 1 1271 . 1 1 1 A 115 115 PRO CA C 1883 63.121 62.514 0.607 1 1 1272 . 1 1 1 A 115 115 PRO CB C 1883 31.515 31.678 -0.163 1 1 1275 . 1 1 1 A 116 116 ALA H H 1884 8.868 8.173 0.695 1 1 1276 . 1 1 1 A 116 116 ALA HA H 1884 4.804 4.980 -0.176 1 1 1280 . 1 1 1 A 116 116 ALA CA C 1884 50.620 50.445 0.175 1 1 1281 . 1 1 1 A 116 116 ALA CB C 1884 19.426 20.531 -1.105 1 1 1282 . 1 1 1 A 116 116 ALA N N 1884 132.329 126.337 5.992 1 1 1283 . 1 1 1 A 117 117 THR H H 1885 8.433 8.902 -0.469 1 1 1284 . 1 1 1 A 117 117 THR HA H 1885 5.747 5.557 0.190 1 1 1289 . 1 1 1 A 117 117 THR CA C 1885 60.364 59.456 0.908 1 1 1290 . 1 1 1 A 117 117 THR CB C 1885 72.204 72.231 -0.027 1 1 1292 . 1 1 1 A 117 117 THR N N 1885 113.428 111.474 1.954 1 1 1293 . 1 1 1 A 118 118 PHE H H 1886 9.069 8.500 0.569 1 1 1294 . 1 1 1 A 118 118 PHE HA H 1886 5.123 5.172 -0.049 1 1 1301 . 1 1 1 A 118 118 PHE CA C 1886 57.059 56.047 1.012 1 1 1302 . 1 1 1 A 118 118 PHE CB C 1886 39.994 41.068 -1.074 1 1 1305 . 1 1 1 A 118 118 PHE N N 1886 119.166 117.499 1.667 1 1 1306 . 1 1 1 A 119 119 THR H H 1887 9.451 8.955 0.496 1 1 1307 . 1 1 1 A 119 119 THR HA H 1887 5.097 5.222 -0.125 1 1 1312 . 1 1 1 A 119 119 THR CA C 1887 62.050 61.223 0.827 1 1 1313 . 1 1 1 A 119 119 THR CB C 1887 71.696 71.986 -0.290 1 1 1315 . 1 1 1 A 119 119 THR N N 1887 119.436 114.307 5.129 1 1 1316 . 1 1 1 A 120 120 VAL H H 1888 8.812 9.329 -0.517 1 1 1317 . 1 1 1 A 120 120 VAL HA H 1888 4.807 4.534 0.273 1 1 1325 . 1 1 1 A 120 120 VAL CA C 1888 61.140 61.028 0.112 1 1 1326 . 1 1 1 A 120 120 VAL CB C 1888 34.059 34.040 0.019 1 1 1329 . 1 1 1 A 120 120 VAL N N 1888 124.304 126.524 -2.220 1 1 1330 . 1 1 1 A 121 121 ASN H H 1889 9.291 9.098 0.193 1 1 1331 . 1 1 1 A 121 121 ASN HA H 1889 5.177 5.071 0.106 1 1 1336 . 1 1 1 A 121 121 ASN CA C 1889 52.470 52.776 -0.306 1 1 1337 . 1 1 1 A 121 121 ASN CB C 1889 39.766 39.569 0.197 1 1 1338 . 1 1 1 A 121 121 ASN N N 1889 128.674 126.422 2.252 1 1 1340 . 1 1 1 A 122 122 THR H H 1890 8.553 7.978 0.575 1 1 1341 . 1 1 1 A 122 122 THR HA H 1890 4.236 4.846 -0.610 1 1 1346 . 1 1 1 A 122 122 THR CA C 1890 61.062 61.129 -0.067 1 1 1347 . 1 1 1 A 122 122 THR CB C 1890 68.437 69.333 -0.896 1 1 1349 . 1 1 1 A 122 122 THR N N 1890 116.203 113.746 2.457 1 1 1350 . 1 1 1 A 123 123 LYS H H 1891 8.210 7.919 0.291 1 1 1351 . 1 1 1 A 123 123 LYS HA H 1891 4.019 4.071 -0.052 1 1 1360 . 1 1 1 A 123 123 LYS CA C 1891 58.646 59.069 -0.423 1 1 1361 . 1 1 1 A 123 123 LYS CB C 1891 31.868 32.325 -0.457 1 1 1365 . 1 1 1 A 123 123 LYS N N 1891 124.070 122.430 1.640 1 1 1366 . 1 1 1 A 124 124 ASP H H 1892 8.596 7.924 0.672 1 1 1367 . 1 1 1 A 124 124 ASP HA H 1892 4.638 4.959 -0.321 1 1 1370 . 1 1 1 A 124 124 ASP CA C 1892 54.928 52.932 1.996 1 1 1371 . 1 1 1 A 124 124 ASP CB C 1892 40.725 41.614 -0.889 1 1 1372 . 1 1 1 A 124 124 ASP N N 1892 119.838 117.738 2.100 1 1 1373 . 1 1 1 A 125 125 ALA H H 1893 7.792 7.705 0.087 1 1 1374 . 1 1 1 A 125 125 ALA HA H 1893 4.248 4.288 -0.040 1 1 1378 . 1 1 1 A 125 125 ALA CA C 1893 52.852 52.032 0.820 1 1 1379 . 1 1 1 A 125 125 ALA CB C 1893 20.199 19.580 0.619 1 1 1380 . 1 1 1 A 125 125 ALA N N 1893 122.999 121.766 1.233 1 1 1381 . 1 1 1 A 126 126 GLY H H 1894 8.214 7.864 0.350 1 1 1382 . 1 1 1 A 126 126 GLY HA2 H 1894 4.183 3.893 0.290 1 1 1383 . 1 1 1 A 126 126 GLY HA3 H 1894 3.993 3.955 0.038 1 1 1384 . 1 1 1 A 126 126 GLY CA C 1894 44.725 46.143 -1.418 1 1 1385 . 1 1 1 A 126 126 GLY N N 1894 108.359 105.995 2.364 1 1 1386 . 1 1 1 A 127 127 GLU H H 1895 8.633 8.396 0.237 1 1 1387 . 1 1 1 A 127 127 GLU HA H 1895 4.318 5.218 -0.900 1 1 1392 . 1 1 1 A 127 127 GLU CA C 1895 57.280 55.618 1.662 1 1 1393 . 1 1 1 A 127 127 GLU CB C 1895 30.434 33.104 -2.670 1 1 1395 . 1 1 1 A 127 127 GLU N N 1895 122.934 122.151 0.783 1 1 1396 . 1 1 1 A 128 128 GLY H H 1896 8.351 8.463 -0.112 1 1 1397 . 1 1 1 A 128 128 GLY HA2 H 1896 3.853 4.242 -0.389 1 1 1398 . 1 1 1 A 128 128 GLY HA3 H 1896 3.853 4.261 -0.408 1 1 1399 . 1 1 1 A 128 128 GLY CA C 1896 45.766 45.292 0.474 1 1 1400 . 1 1 1 A 128 128 GLY N N 1896 111.048 111.020 0.028 1 1 1401 . 1 1 1 A 129 129 GLY H H 1897 7.580 8.651 -1.071 1 1 1402 . 1 1 1 A 129 129 GLY HA2 H 1897 4.170 4.146 0.024 1 1 1403 . 1 1 1 A 129 129 GLY HA3 H 1897 3.463 4.149 -0.686 1 1 1404 . 1 1 1 A 129 129 GLY CA C 1897 44.670 45.416 -0.746 1 1 1405 . 1 1 1 A 129 129 GLY N N 1897 106.306 110.368 -4.062 1 1 1406 . 1 1 1 A 130 130 LEU H H 1898 8.416 8.729 -0.313 1 1 1407 . 1 1 1 A 130 130 LEU HA H 1898 5.077 4.444 0.633 1 1 1417 . 1 1 1 A 130 130 LEU CA C 1898 54.526 54.487 0.039 1 1 1418 . 1 1 1 A 130 130 LEU CB C 1898 44.499 42.470 2.029 1 1 1422 . 1 1 1 A 130 130 LEU N N 1898 126.737 127.274 -0.537 1 1 1423 . 1 1 1 A 131 131 SER H H 1899 9.254 9.296 -0.042 1 1 1424 . 1 1 1 A 131 131 SER HA H 1899 4.803 5.446 -0.643 1 1 1427 . 1 1 1 A 131 131 SER CA C 1899 57.293 57.178 0.115 1 1 1428 . 1 1 1 A 131 131 SER CB C 1899 65.376 66.451 -1.075 1 1 1429 . 1 1 1 A 131 131 SER N N 1899 123.028 124.379 -1.351 1 1 1430 . 1 1 1 A 132 132 LEU H H 1900 8.410 8.510 -0.100 1 1 1431 . 1 1 1 A 132 132 LEU HA H 1900 5.452 4.964 0.488 1 1 1441 . 1 1 1 A 132 132 LEU CA C 1900 53.045 54.266 -1.221 1 1 1442 . 1 1 1 A 132 132 LEU CB C 1900 46.982 46.045 0.937 1 1 1446 . 1 1 1 A 132 132 LEU N N 1900 126.218 122.962 3.256 1 1 1447 . 1 1 1 A 133 133 ALA H H 1901 8.708 8.601 0.107 1 1 1448 . 1 1 1 A 133 133 ALA HA H 1901 4.591 4.915 -0.324 1 1 1452 . 1 1 1 A 133 133 ALA CA C 1901 52.140 51.351 0.789 1 1 1453 . 1 1 1 A 133 133 ALA CB C 1901 22.653 23.860 -1.207 1 1 1454 . 1 1 1 A 133 133 ALA N N 1901 124.744 126.071 -1.327 1 1 1455 . 1 1 1 A 134 134 ILE H H 1902 8.641 8.586 0.055 1 1 1456 . 1 1 1 A 134 134 ILE HA H 1902 5.256 5.018 0.238 1 1 1466 . 1 1 1 A 134 134 ILE CA C 1902 59.873 59.855 0.018 1 1 1467 . 1 1 1 A 134 134 ILE CB C 1902 41.214 41.760 -0.546 1 1 1471 . 1 1 1 A 134 134 ILE N N 1902 121.132 119.964 1.168 1 1 1472 . 1 1 1 A 135 135 GLU H H 1903 9.294 9.118 0.176 1 1 1473 . 1 1 1 A 135 135 GLU HA H 1903 4.869 5.077 -0.208 1 1 1478 . 1 1 1 A 135 135 GLU CA C 1903 54.307 54.850 -0.543 1 1 1479 . 1 1 1 A 135 135 GLU CB C 1903 32.474 31.585 0.889 1 1 1481 . 1 1 1 A 135 135 GLU N N 1903 129.644 125.660 3.984 1 1 1482 . 1 1 1 A 136 136 GLY H H 1904 8.347 8.579 -0.232 1 1 1483 . 1 1 1 A 136 136 GLY HA2 H 1904 4.005 3.590 0.415 1 1 1484 . 1 1 1 A 136 136 GLY HA3 H 1904 3.629 3.903 -0.274 1 1 1485 . 1 1 1 A 136 136 GLY CA C 1904 45.530 43.754 1.776 1 1 1486 . 1 1 1 A 136 136 GLY N N 1904 112.326 112.297 0.029 1 1 1487 . 1 1 1 A 137 137 PRO HA H 1905 4.268 4.354 -0.086 1 1 1494 . 1 1 1 A 137 137 PRO CA C 1905 64.189 64.108 0.081 1 1 1495 . 1 1 1 A 137 137 PRO CB C 1905 32.482 31.751 0.731 1 1 1498 . 1 1 1 A 138 138 SER H H 1906 7.060 7.303 -0.243 1 1 1499 . 1 1 1 A 138 138 SER HA H 1906 4.603 4.756 -0.153 1 1 1502 . 1 1 1 A 138 138 SER CA C 1906 56.433 56.674 -0.241 1 1 1503 . 1 1 1 A 138 138 SER CB C 1906 66.672 65.841 0.831 1 1 1504 . 1 1 1 A 138 138 SER N N 1906 109.100 112.669 -3.569 1 1 1505 . 1 1 1 A 139 139 LYS H H 1907 8.479 8.276 0.203 1 1 1506 . 1 1 1 A 139 139 LYS HA H 1907 4.413 4.457 -0.044 1 1 1515 . 1 1 1 A 139 139 LYS CA C 1907 56.638 56.734 -0.096 1 1 1516 . 1 1 1 A 139 139 LYS CB C 1907 31.873 32.944 -1.071 1 1 1520 . 1 1 1 A 139 139 LYS N N 1907 124.545 125.486 -0.941 1 1 1521 . 1 1 1 A 140 140 ALA H H 1908 8.358 8.480 -0.122 1 1 1522 . 1 1 1 A 140 140 ALA HA H 1908 4.706 4.582 0.124 1 1 1526 . 1 1 1 A 140 140 ALA CA C 1908 51.081 52.562 -1.481 1 1 1527 . 1 1 1 A 140 140 ALA CB C 1908 20.724 19.537 1.187 1 1 1528 . 1 1 1 A 140 140 ALA N N 1908 131.020 129.747 1.273 1 1 1529 . 1 1 1 A 141 141 GLU H H 1909 8.625 8.170 0.455 1 1 1530 . 1 1 1 A 141 141 GLU HA H 1909 4.248 4.799 -0.551 1 1 1535 . 1 1 1 A 141 141 GLU CA C 1909 56.991 55.739 1.252 1 1 1536 . 1 1 1 A 141 141 GLU CB C 1909 30.453 31.004 -0.551 1 1 1538 . 1 1 1 A 141 141 GLU N N 1909 124.862 120.440 4.422 1 1 1539 . 1 1 1 A 142 142 ILE H H 1910 8.588 8.690 -0.102 1 1 1540 . 1 1 1 A 142 142 ILE HA H 1910 4.871 5.076 -0.205 1 1 1550 . 1 1 1 A 142 142 ILE CA C 1910 60.733 59.966 0.767 1 1 1551 . 1 1 1 A 142 142 ILE CB C 1910 41.494 41.916 -0.422 1 1 1555 . 1 1 1 A 142 142 ILE N N 1910 126.220 123.544 2.676 1 1 1556 . 1 1 1 A 143 143 SER H H 1911 9.269 8.922 0.347 1 1 1557 . 1 1 1 A 143 143 SER HA H 1911 4.804 5.470 -0.666 1 1 1560 . 1 1 1 A 143 143 SER CA C 1911 56.988 57.269 -0.281 1 1 1561 . 1 1 1 A 143 143 SER CB C 1911 65.172 66.085 -0.913 1 1 1562 . 1 1 1 A 143 143 SER N N 1911 124.083 122.636 1.447 1 1 1563 . 1 1 1 A 144 144 CYS H H 1912 8.773 8.944 -0.171 1 1 1564 . 1 1 1 A 144 144 CYS HA H 1912 5.200 5.246 -0.046 1 1 1567 . 1 1 1 A 144 144 CYS CA C 1912 57.256 56.091 1.165 1 1 1568 . 1 1 1 A 144 144 CYS CB C 1912 29.137 30.792 -1.655 1 1 1569 . 1 1 1 A 144 144 CYS N N 1912 125.729 118.723 7.006 1 1 1570 . 1 1 1 A 145 145 THR H H 1913 8.976 8.844 0.132 1 1 1571 . 1 1 1 A 145 145 THR HA H 1913 4.510 4.853 -0.343 1 1 1576 . 1 1 1 A 145 145 THR CA C 1913 61.388 61.455 -0.067 1 1 1577 . 1 1 1 A 145 145 THR CB C 1913 71.558 72.097 -0.539 1 1 1579 . 1 1 1 A 145 145 THR N N 1913 124.914 117.340 7.574 1 1 1580 . 1 1 1 A 146 146 ASP H H 1914 8.843 8.985 -0.142 1 1 1581 . 1 1 1 A 146 146 ASP HA H 1914 4.842 4.794 0.048 1 1 1584 . 1 1 1 A 146 146 ASP CA C 1914 54.307 54.284 0.023 1 1 1585 . 1 1 1 A 146 146 ASP CB C 1914 41.262 41.908 -0.646 1 1 1586 . 1 1 1 A 146 146 ASP N N 1914 128.084 128.587 -0.503 1 1 1587 . 1 1 1 A 147 147 ASN H H 1915 8.700 9.125 -0.425 1 1 1588 . 1 1 1 A 147 147 ASN HA H 1915 4.798 5.013 -0.215 1 1 1593 . 1 1 1 A 147 147 ASN CA C 1915 54.283 51.921 2.362 1 1 1594 . 1 1 1 A 147 147 ASN CB C 1915 38.986 40.647 -1.661 1 1 1595 . 1 1 1 A 147 147 ASN N N 1915 125.720 122.889 2.831 1 1 1597 . 1 1 1 A 148 148 GLN HA H 1916 4.057 4.094 -0.037 1 1 1602 . 1 1 1 A 148 148 GLN CA C 1916 57.839 58.609 -0.770 1 1 1603 . 1 1 1 A 148 148 GLN CB C 1916 26.281 28.317 -2.036 1 1 1605 . 1 1 1 A 149 149 ASP H H 1917 7.892 7.753 0.139 1 1 1606 . 1 1 1 A 149 149 ASP HA H 1917 4.755 4.722 0.033 1 1 1609 . 1 1 1 A 149 149 ASP CA C 1917 52.659 54.111 -1.452 1 1 1610 . 1 1 1 A 149 149 ASP CB C 1917 41.111 41.331 -0.220 1 1 1611 . 1 1 1 A 149 149 ASP N N 1917 118.769 117.452 1.317 1 1 1612 . 1 1 1 A 150 150 GLY H H 1918 8.673 8.136 0.537 1 1 1613 . 1 1 1 A 150 150 GLY HA2 H 1918 4.358 3.926 0.432 1 1 1614 . 1 1 1 A 150 150 GLY HA3 H 1918 3.700 3.931 -0.231 1 1 1615 . 1 1 1 A 150 150 GLY CA C 1918 45.319 45.770 -0.451 1 1 1616 . 1 1 1 A 150 150 GLY N N 1918 110.464 107.729 2.735 1 1 1617 . 1 1 1 A 151 151 THR H H 1919 8.154 7.765 0.389 1 1 1618 . 1 1 1 A 151 151 THR HA H 1919 4.109 4.931 -0.822 1 1 1623 . 1 1 1 A 151 151 THR CA C 1919 60.041 59.473 0.568 1 1 1624 . 1 1 1 A 151 151 THR CB C 1919 73.422 71.619 1.803 1 1 1626 . 1 1 1 A 151 151 THR N N 1919 111.043 110.777 0.266 1 1 1627 . 1 1 1 A 152 152 CYS H H 1920 9.088 9.310 -0.222 1 1 1628 . 1 1 1 A 152 152 CYS HA H 1920 5.362 5.470 -0.108 1 1 1631 . 1 1 1 A 152 152 CYS CA C 1920 56.990 57.029 -0.039 1 1 1632 . 1 1 1 A 152 152 CYS CB C 1920 30.740 29.256 1.484 1 1 1633 . 1 1 1 A 152 152 CYS N N 1920 118.508 121.168 -2.660 1 1 1634 . 1 1 1 A 153 153 SER H H 1921 9.102 8.975 0.127 1 1 1635 . 1 1 1 A 153 153 SER HA H 1921 4.865 4.832 0.033 1 1 1638 . 1 1 1 A 153 153 SER CA C 1921 58.023 57.910 0.113 1 1 1639 . 1 1 1 A 153 153 SER CB C 1921 64.133 64.127 0.006 1 1 1640 . 1 1 1 A 153 153 SER N N 1921 122.048 120.060 1.988 1 1 1641 . 1 1 1 A 154 154 VAL H H 1922 8.983 8.606 0.377 1 1 1642 . 1 1 1 A 154 154 VAL HA H 1922 4.608 4.769 -0.161 1 1 1650 . 1 1 1 A 154 154 VAL CA C 1922 60.575 59.761 0.814 1 1 1651 . 1 1 1 A 154 154 VAL CB C 1922 32.710 34.901 -2.191 1 1 1654 . 1 1 1 A 154 154 VAL N N 1922 130.262 124.505 5.757 1 1 1655 . 1 1 1 A 155 155 SER H H 1923 8.737 8.748 -0.011 1 1 1656 . 1 1 1 A 155 155 SER HA H 1923 5.680 5.508 0.172 1 1 1659 . 1 1 1 A 155 155 SER CA C 1923 55.991 56.477 -0.486 1 1 1660 . 1 1 1 A 155 155 SER CB C 1923 66.306 65.491 0.815 1 1 1661 . 1 1 1 A 155 155 SER N N 1923 121.504 121.299 0.205 1 1 1662 . 1 1 1 A 156 156 TYR H H 1924 9.061 8.971 0.090 1 1 1663 . 1 1 1 A 156 156 TYR HA H 1924 5.790 5.612 0.178 1 1 1671 . 1 1 1 A 156 156 TYR CA C 1924 55.118 55.764 -0.646 1 1 1672 . 1 1 1 A 156 156 TYR CB C 1924 42.344 42.131 0.213 1 1 1675 . 1 1 1 A 156 156 TYR N N 1924 121.858 121.029 0.829 1 1 1676 . 1 1 1 A 157 157 LEU H H 1925 7.505 9.104 -1.599 1 1 1677 . 1 1 1 A 157 157 LEU HA H 1925 4.996 4.770 0.226 1 1 1687 . 1 1 1 A 157 157 LEU CA C 1925 50.476 51.156 -0.680 1 1 1688 . 1 1 1 A 157 157 LEU CB C 1925 43.334 43.438 -0.104 1 1 1692 . 1 1 1 A 157 157 LEU N N 1925 123.272 121.226 2.046 1 1 1693 . 1 1 1 A 158 158 PRO HA H 1926 4.691 4.911 -0.220 1 1 1700 . 1 1 1 A 158 158 PRO CA C 1926 61.808 62.446 -0.638 1 1 1701 . 1 1 1 A 158 158 PRO CB C 1926 32.551 33.414 -0.863 1 1 1704 . 1 1 1 A 159 159 VAL H H 1927 8.388 8.338 0.050 1 1 1705 . 1 1 1 A 159 159 VAL HA H 1927 4.510 4.330 0.180 1 1 1713 . 1 1 1 A 159 159 VAL CA C 1927 61.778 62.000 -0.222 1 1 1714 . 1 1 1 A 159 159 VAL CB C 1927 32.432 34.962 -2.530 1 1 1717 . 1 1 1 A 159 159 VAL N N 1927 115.680 120.563 -4.883 1 1 1718 . 1 1 1 A 160 160 LEU H H 1928 6.931 7.342 -0.411 1 1 1719 . 1 1 1 A 160 160 LEU HA H 1928 4.931 5.128 -0.197 1 1 1729 . 1 1 1 A 160 160 LEU CA C 1928 51.971 51.277 0.694 1 1 1730 . 1 1 1 A 160 160 LEU CB C 1928 45.905 44.723 1.182 1 1 1734 . 1 1 1 A 160 160 LEU N N 1928 120.258 118.766 1.492 1 1 1735 . 1 1 1 A 161 161 PRO HA H 1929 4.317 4.902 -0.585 1 1 1742 . 1 1 1 A 161 161 PRO CA C 1929 62.809 63.112 -0.303 1 1 1743 . 1 1 1 A 161 161 PRO CB C 1929 32.662 32.420 0.242 1 1 1746 . 1 1 1 A 162 162 GLY H H 1930 8.916 7.951 0.965 1 1 1747 . 1 1 1 A 162 162 GLY HA2 H 1930 4.461 4.234 0.227 1 1 1748 . 1 1 1 A 162 162 GLY HA3 H 1930 3.852 4.240 -0.388 1 1 1749 . 1 1 1 A 162 162 GLY CA C 1930 44.496 45.326 -0.830 1 1 1750 . 1 1 1 A 162 162 GLY N N 1930 107.609 108.012 -0.403 1 1 1751 . 1 1 1 A 163 163 ASP H H 1931 8.245 8.655 -0.410 1 1 1752 . 1 1 1 A 163 163 ASP HA H 1931 5.565 5.615 -0.050 1 1 1755 . 1 1 1 A 163 163 ASP CA C 1931 53.628 53.061 0.567 1 1 1756 . 1 1 1 A 163 163 ASP CB C 1931 41.058 42.127 -1.069 1 1 1757 . 1 1 1 A 163 163 ASP N N 1931 121.979 118.824 3.155 1 1 1758 . 1 1 1 A 164 164 TYR H H 1932 9.606 9.563 0.043 1 1 1759 . 1 1 1 A 164 164 TYR HA H 1932 4.896 5.161 -0.265 1 1 1767 . 1 1 1 A 164 164 TYR CA C 1932 56.955 56.374 0.581 1 1 1768 . 1 1 1 A 164 164 TYR CB C 1932 40.339 41.276 -0.937 1 1 1771 . 1 1 1 A 164 164 TYR N N 1932 125.257 122.339 2.918 1 1 1772 . 1 1 1 A 165 165 SER H H 1933 9.095 9.271 -0.176 1 1 1773 . 1 1 1 A 165 165 SER HA H 1933 5.500 5.170 0.330 1 1 1776 . 1 1 1 A 165 165 SER CA C 1933 56.509 58.391 -1.882 1 1 1777 . 1 1 1 A 165 165 SER CB C 1933 64.486 63.921 0.565 1 1 1778 . 1 1 1 A 165 165 SER N N 1933 119.162 120.800 -1.638 1 1 1779 . 1 1 1 A 166 166 ILE H H 1934 9.598 9.234 0.364 1 1 1780 . 1 1 1 A 166 166 ILE HA H 1934 4.541 4.745 -0.204 1 1 1790 . 1 1 1 A 166 166 ILE CA C 1934 61.080 60.279 0.801 1 1 1791 . 1 1 1 A 166 166 ILE CB C 1934 39.282 39.190 0.092 1 1 1795 . 1 1 1 A 166 166 ILE N N 1934 128.701 128.100 0.601 1 1 1796 . 1 1 1 A 167 167 LEU H H 1935 9.359 9.336 0.023 1 1 1797 . 1 1 1 A 167 167 LEU HA H 1935 4.779 5.283 -0.504 1 1 1807 . 1 1 1 A 167 167 LEU CA C 1935 55.921 53.325 2.596 1 1 1808 . 1 1 1 A 167 167 LEU CB C 1935 42.473 45.113 -2.640 1 1 1811 . 1 1 1 A 167 167 LEU N N 1935 131.315 130.423 0.892 1 1 1812 . 1 1 1 A 168 168 VAL H H 1936 9.425 9.007 0.418 1 1 1813 . 1 1 1 A 168 168 VAL HA H 1936 4.617 4.805 -0.188 1 1 1821 . 1 1 1 A 168 168 VAL CA C 1936 61.418 60.938 0.480 1 1 1822 . 1 1 1 A 168 168 VAL CB C 1936 33.616 34.897 -1.281 1 1 1824 . 1 1 1 A 168 168 VAL N N 1936 126.961 126.146 0.815 1 1 1825 . 1 1 1 A 169 169 LYS H H 1937 8.643 8.319 0.324 1 1 1826 . 1 1 1 A 169 169 LYS HA H 1937 5.067 4.904 0.163 1 1 1835 . 1 1 1 A 169 169 LYS CA C 1937 53.949 55.533 -1.584 1 1 1836 . 1 1 1 A 169 169 LYS CB C 1937 36.691 36.239 0.452 1 1 1840 . 1 1 1 A 169 169 LYS N N 1937 124.773 127.341 -2.568 1 1 1841 . 1 1 1 A 170 170 TYR H H 1938 8.877 9.281 -0.404 1 1 1842 . 1 1 1 A 170 170 TYR HA H 1938 5.137 5.051 0.086 1 1 1849 . 1 1 1 A 170 170 TYR CA C 1938 57.034 57.501 -0.467 1 1 1850 . 1 1 1 A 170 170 TYR CB C 1938 42.105 42.077 0.028 1 1 1853 . 1 1 1 A 170 170 TYR N N 1938 122.371 127.024 -4.653 1 1 1854 . 1 1 1 A 171 171 ASN H H 1939 8.933 9.735 -0.802 1 1 1855 . 1 1 1 A 171 171 ASN HA H 1939 4.405 4.423 -0.018 1 1 1860 . 1 1 1 A 171 171 ASN CA C 1939 54.512 54.241 0.271 1 1 1861 . 1 1 1 A 171 171 ASN CB C 1939 37.025 37.159 -0.134 1 1 1862 . 1 1 1 A 171 171 ASN N N 1939 129.922 126.449 3.473 1 1 1864 . 1 1 1 A 172 172 GLU H H 1940 8.857 8.850 0.007 1 1 1865 . 1 1 1 A 172 172 GLU HA H 1940 3.511 4.077 -0.566 1 1 1870 . 1 1 1 A 172 172 GLU CA C 1940 57.910 57.697 0.213 1 1 1871 . 1 1 1 A 172 172 GLU CB C 1940 27.139 27.521 -0.382 1 1 1873 . 1 1 1 A 172 172 GLU N N 1940 107.943 116.280 -8.337 1 1 1874 . 1 1 1 A 173 173 GLN H H 1941 7.544 7.574 -0.030 1 1 1875 . 1 1 1 A 173 173 GLN HA H 1941 4.749 4.771 -0.022 1 1 1882 . 1 1 1 A 173 173 GLN CA C 1941 53.770 54.805 -1.035 1 1 1883 . 1 1 1 A 173 173 GLN CB C 1941 31.078 30.768 0.310 1 1 1885 . 1 1 1 A 173 173 GLN N N 1941 119.865 120.374 -0.509 1 1 1887 . 1 1 1 A 174 174 HIS H H 1942 8.848 8.809 0.039 1 1 1888 . 1 1 1 A 174 174 HIS HA H 1942 4.513 4.706 -0.193 1 1 1893 . 1 1 1 A 174 174 HIS CA C 1942 58.893 56.901 1.992 1 1 1894 . 1 1 1 A 174 174 HIS CB C 1942 32.196 30.335 1.861 1 1 1897 . 1 1 1 A 174 174 HIS N N 1942 126.437 121.965 4.472 1 1 1898 . 1 1 1 A 175 175 VAL H H 1943 8.483 8.427 0.056 1 1 1899 . 1 1 1 A 175 175 VAL HA H 1943 4.643 4.331 0.312 1 1 1907 . 1 1 1 A 175 175 VAL CA C 1943 60.025 60.996 -0.971 1 1 1908 . 1 1 1 A 175 175 VAL CB C 1943 29.439 31.837 -2.398 1 1 1911 . 1 1 1 A 175 175 VAL N N 1943 121.671 120.976 0.695 1 1 1912 . 1 1 1 A 176 176 PRO HA H 1944 4.045 4.081 -0.036 1 1 1919 . 1 1 1 A 176 176 PRO CA C 1944 64.943 63.479 1.464 1 1 1920 . 1 1 1 A 176 176 PRO CB C 1944 31.120 31.075 0.045 1 1 1923 . 1 1 1 A 177 177 GLY H H 1945 7.579 8.498 -0.919 1 1 1924 . 1 1 1 A 177 177 GLY HA2 H 1945 3.210 3.425 -0.215 1 1 1925 . 1 1 1 A 177 177 GLY HA3 H 1945 2.311 3.688 -1.377 1 1 1926 . 1 1 1 A 177 177 GLY CA C 1945 44.184 44.639 -0.455 1 1 1927 . 1 1 1 A 177 177 GLY N N 1945 113.696 112.895 0.801 1 1 1928 . 1 1 1 A 178 178 SER H H 1946 7.469 7.429 0.040 1 1 1929 . 1 1 1 A 178 178 SER HA H 1946 4.023 3.605 0.418 1 1 1932 . 1 1 1 A 178 178 SER CA C 1946 54.593 54.982 -0.389 1 1 1933 . 1 1 1 A 178 178 SER CB C 1946 62.282 63.663 -1.381 1 1 1934 . 1 1 1 A 178 178 SER N N 1946 113.219 116.944 -3.725 1 1 1935 . 1 1 1 A 179 179 PRO HA H 1947 5.314 4.789 0.525 1 1 1942 . 1 1 1 A 179 179 PRO CA C 1947 62.198 62.377 -0.179 1 1 1943 . 1 1 1 A 179 179 PRO CB C 1947 33.923 32.813 1.110 1 1 1946 . 1 1 1 A 180 180 PHE H H 1948 9.395 8.495 0.900 1 1 1947 . 1 1 1 A 180 180 PHE HA H 1948 4.706 4.907 -0.201 1 1 1955 . 1 1 1 A 180 180 PHE CA C 1948 57.298 57.607 -0.309 1 1 1956 . 1 1 1 A 180 180 PHE CB C 1948 41.116 40.349 0.767 1 1 1960 . 1 1 1 A 180 180 PHE N N 1948 127.510 120.640 6.870 1 1 1961 . 1 1 1 A 181 181 THR H H 1949 9.111 8.842 0.269 1 1 1962 . 1 1 1 A 181 181 THR HA H 1949 5.091 5.131 -0.040 1 1 1967 . 1 1 1 A 181 181 THR CA C 1949 62.668 61.269 1.399 1 1 1968 . 1 1 1 A 181 181 THR CB C 1949 70.354 71.349 -0.995 1 1 1970 . 1 1 1 A 181 181 THR N N 1949 120.325 115.259 5.066 1 1 1971 . 1 1 1 A 182 182 ALA H H 1950 8.992 9.350 -0.358 1 1 1972 . 1 1 1 A 182 182 ALA HA H 1950 4.521 5.110 -0.589 1 1 1976 . 1 1 1 A 182 182 ALA CA C 1950 50.080 50.858 -0.778 1 1 1977 . 1 1 1 A 182 182 ALA CB C 1950 21.717 20.757 0.960 1 1 1978 . 1 1 1 A 182 182 ALA N N 1950 130.794 130.484 0.310 1 1 1979 . 1 1 1 A 183 183 ARG H H 1951 7.764 8.476 -0.712 1 1 1980 . 1 1 1 A 183 183 ARG HA H 1951 5.001 4.931 0.070 1 1 1988 . 1 1 1 A 183 183 ARG CA C 1951 55.116 54.856 0.260 1 1 1989 . 1 1 1 A 183 183 ARG CB C 1951 30.631 32.719 -2.088 1 1 1992 . 1 1 1 A 183 183 ARG N N 1951 121.920 122.740 -0.820 1 1 1994 . 1 1 1 A 184 184 VAL H H 1952 9.121 9.415 -0.294 1 1 1995 . 1 1 1 A 184 184 VAL HA H 1952 4.865 4.780 0.085 1 1 2003 . 1 1 1 A 184 184 VAL CA C 1952 60.375 61.154 -0.779 1 1 2004 . 1 1 1 A 184 184 VAL CB C 1952 32.179 33.237 -1.058 1 1 2007 . 1 1 1 A 184 184 VAL N N 1952 125.421 127.800 -2.379 1 1 2008 . 1 1 1 A 185 185 THR H H 1953 8.799 8.924 -0.125 1 1 2009 . 1 1 1 A 185 185 THR HA H 1953 4.829 5.192 -0.363 1 1 2014 . 1 1 1 A 185 185 THR CA C 1953 60.316 59.763 0.553 1 1 2015 . 1 1 1 A 185 185 THR CB C 1953 70.825 71.567 -0.742 1 1 2017 . 1 1 1 A 185 185 THR N N 1953 121.794 117.190 4.604 1 1 2018 . 1 1 1 A 186 186 GLY H H 1954 8.586 8.615 -0.029 1 1 2019 . 1 1 1 A 186 186 GLY HA2 H 1954 4.261 4.073 0.188 1 1 2020 . 1 1 1 A 186 186 GLY HA3 H 1954 4.033 4.081 -0.048 1 1 2021 . 1 1 1 A 186 186 GLY CA C 1954 45.038 45.288 -0.250 1 1 2022 . 1 1 1 A 186 186 GLY N N 1954 107.588 108.157 -0.569 1 1 2023 . 1 1 1 A 187 187 ASP H H 1955 8.386 9.052 -0.666 1 1 2024 . 1 1 1 A 187 187 ASP HA H 1955 4.772 4.589 0.183 1 1 2027 . 1 1 1 A 187 187 ASP CA C 1955 53.909 55.847 -1.938 1 1 2028 . 1 1 1 A 187 187 ASP CB C 1955 41.510 42.066 -0.556 1 1 2029 . 1 1 1 A 187 187 ASP N N 1955 121.829 121.442 0.387 1 1 4 . 2 1 1 A 2 2 ALA HA H -2 4.368 4.167 0.201 1 1 8 . 2 1 1 A 2 2 ALA CA C -2 52.604 53.969 -1.365 1 1 9 . 2 1 1 A 2 2 ALA CB C -2 19.551 19.078 0.473 1 1 32 . 2 1 1 A 5 5 PRO HA H 1773 4.433 4.686 -0.253 1 1 39 . 2 1 1 A 5 5 PRO CA C 1773 63.017 62.368 0.649 1 1 40 . 2 1 1 A 5 5 PRO CB C 1773 32.155 33.192 -1.037 1 1 43 . 2 1 1 A 6 6 GLU H H 1774 8.495 8.683 -0.188 1 1 44 . 2 1 1 A 6 6 GLU HA H 1774 4.242 4.794 -0.552 1 1 49 . 2 1 1 A 6 6 GLU CA C 1774 56.735 54.962 1.773 1 1 50 . 2 1 1 A 6 6 GLU CB C 1774 30.401 32.916 -2.515 1 1 52 . 2 1 1 A 6 6 GLU N N 1774 122.494 117.296 5.198 1 1 53 . 2 1 1 A 7 7 ARG H H 1775 8.275 8.249 0.026 1 1 54 . 2 1 1 A 7 7 ARG HA H 1775 4.648 4.484 0.164 1 1 61 . 2 1 1 A 7 7 ARG CA C 1775 53.827 54.712 -0.885 1 1 62 . 2 1 1 A 7 7 ARG CB C 1775 30.417 29.838 0.579 1 1 65 . 2 1 1 A 7 7 ARG N N 1775 124.017 121.000 3.017 1 1 66 . 2 1 1 A 8 8 PRO HA H 1776 4.433 4.684 -0.251 1 1 73 . 2 1 1 A 8 8 PRO CA C 1776 63.036 62.286 0.750 1 1 74 . 2 1 1 A 8 8 PRO CB C 1776 32.201 32.871 -0.670 1 1 77 . 2 1 1 A 9 9 LEU H H 1777 8.349 8.530 -0.181 1 1 78 . 2 1 1 A 9 9 LEU HA H 1777 4.365 4.356 0.009 1 1 88 . 2 1 1 A 9 9 LEU CA C 1777 55.275 54.214 1.061 1 1 89 . 2 1 1 A 9 9 LEU CB C 1777 42.376 39.875 2.501 1 1 93 . 2 1 1 A 9 9 LEU N N 1777 123.820 121.927 1.893 1 1 94 . 2 1 1 A 10 10 VAL H H 1778 7.989 8.356 -0.367 1 1 95 . 2 1 1 A 10 10 VAL HA H 1778 4.182 4.063 0.119 1 1 103 . 2 1 1 A 10 10 VAL CA C 1778 62.141 63.687 -1.546 1 1 104 . 2 1 1 A 10 10 VAL CB C 1778 33.175 32.520 0.655 1 1 106 . 2 1 1 A 10 10 VAL N N 1778 121.714 120.825 0.889 1 1 107 . 2 1 1 A 11 11 GLY H H 1779 8.450 7.866 0.584 1 1 108 . 2 1 1 A 11 11 GLY HA2 H 1779 4.002 4.054 -0.052 1 1 109 . 2 1 1 A 11 11 GLY HA3 H 1779 4.002 4.054 -0.052 1 1 110 . 2 1 1 A 11 11 GLY CA C 1779 45.297 44.898 0.399 1 1 111 . 2 1 1 A 11 11 GLY N N 1779 113.826 111.206 2.620 1 1 112 . 2 1 1 A 12 12 VAL H H 1780 8.013 8.219 -0.206 1 1 113 . 2 1 1 A 12 12 VAL HA H 1780 4.136 4.823 -0.687 1 1 121 . 2 1 1 A 12 12 VAL CA C 1780 62.466 60.714 1.752 1 1 122 . 2 1 1 A 12 12 VAL CB C 1780 32.752 34.942 -2.190 1 1 125 . 2 1 1 A 12 12 VAL N N 1780 120.109 121.015 -0.906 1 1 126 . 2 1 1 A 13 13 ASN H H 1781 8.528 8.721 -0.193 1 1 127 . 2 1 1 A 13 13 ASN HA H 1781 4.712 4.995 -0.283 1 1 132 . 2 1 1 A 13 13 ASN CA C 1781 53.485 51.790 1.695 1 1 133 . 2 1 1 A 13 13 ASN CB C 1781 38.996 39.399 -0.403 1 1 134 . 2 1 1 A 13 13 ASN N N 1781 122.648 125.453 -2.805 1 1 136 . 2 1 1 A 14 14 GLY H H 1782 8.283 8.026 0.257 1 1 137 . 2 1 1 A 14 14 GLY HA2 H 1782 3.929 4.097 -0.168 1 1 138 . 2 1 1 A 14 14 GLY HA3 H 1782 3.929 4.098 -0.169 1 1 139 . 2 1 1 A 14 14 GLY CA C 1782 45.531 44.959 0.572 1 1 140 . 2 1 1 A 14 14 GLY N N 1782 110.229 110.828 -0.599 1 1 141 . 2 1 1 A 15 15 LEU H H 1783 7.925 8.894 -0.969 1 1 142 . 2 1 1 A 15 15 LEU HA H 1783 4.340 4.175 0.165 1 1 152 . 2 1 1 A 15 15 LEU CA C 1783 55.045 55.007 0.038 1 1 153 . 2 1 1 A 15 15 LEU CB C 1783 42.682 42.047 0.635 1 1 157 . 2 1 1 A 15 15 LEU N N 1783 122.626 125.194 -2.568 1 1 158 . 2 1 1 A 16 16 ASP H H 1784 8.360 8.865 -0.505 1 1 159 . 2 1 1 A 16 16 ASP HA H 1784 4.747 4.487 0.260 1 1 162 . 2 1 1 A 16 16 ASP CA C 1784 53.939 55.801 -1.862 1 1 163 . 2 1 1 A 16 16 ASP CB C 1784 41.150 41.438 -0.288 1 1 164 . 2 1 1 A 16 16 ASP N N 1784 122.868 123.041 -0.173 1 1 165 . 2 1 1 A 17 17 VAL H H 1785 8.201 7.503 0.698 1 1 166 . 2 1 1 A 17 17 VAL HA H 1785 4.237 4.594 -0.357 1 1 174 . 2 1 1 A 17 17 VAL CA C 1785 62.881 59.393 3.488 1 1 175 . 2 1 1 A 17 17 VAL CB C 1785 31.967 35.523 -3.556 1 1 178 . 2 1 1 A 17 17 VAL N N 1785 121.110 113.603 7.507 1 1 179 . 2 1 1 A 18 18 THR H H 1786 8.291 8.848 -0.557 1 1 180 . 2 1 1 A 18 18 THR HA H 1786 4.466 4.540 -0.074 1 1 185 . 2 1 1 A 18 18 THR CA C 1786 62.388 63.294 -0.906 1 1 186 . 2 1 1 A 18 18 THR CB C 1786 69.719 71.630 -1.911 1 1 188 . 2 1 1 A 18 18 THR N N 1786 115.267 118.259 -2.992 1 1 189 . 2 1 1 A 19 19 SER H H 1787 8.148 7.939 0.209 1 1 190 . 2 1 1 A 19 19 SER HA H 1787 4.542 4.809 -0.267 1 1 193 . 2 1 1 A 19 19 SER CA C 1787 59.096 57.660 1.436 1 1 194 . 2 1 1 A 19 19 SER CB C 1787 63.993 65.431 -1.438 1 1 195 . 2 1 1 A 19 19 SER N N 1787 118.576 112.482 6.094 1 1 196 . 2 1 1 A 20 20 LEU H H 1788 8.263 8.706 -0.443 1 1 197 . 2 1 1 A 20 20 LEU HA H 1788 4.243 4.529 -0.286 1 1 207 . 2 1 1 A 20 20 LEU CA C 1788 54.087 53.882 0.205 1 1 208 . 2 1 1 A 20 20 LEU CB C 1788 43.006 42.347 0.659 1 1 212 . 2 1 1 A 20 20 LEU N N 1788 125.834 123.499 2.335 1 1 213 . 2 1 1 A 21 21 ARG H H 1789 8.191 8.225 -0.034 1 1 214 . 2 1 1 A 21 21 ARG HA H 1789 4.080 4.216 -0.136 1 1 222 . 2 1 1 A 21 21 ARG CA C 1789 54.894 54.300 0.594 1 1 223 . 2 1 1 A 21 21 ARG CB C 1789 30.881 30.549 0.332 1 1 226 . 2 1 1 A 21 21 ARG N N 1789 127.213 122.025 5.188 1 1 228 . 2 1 1 A 22 22 PRO HA H 1790 4.441 4.678 -0.237 1 1 233 . 2 1 1 A 22 22 PRO CA C 1790 62.882 62.543 0.339 1 1 234 . 2 1 1 A 22 22 PRO CB C 1790 32.204 32.697 -0.493 1 1 237 . 2 1 1 A 23 23 PHE H H 1791 8.336 8.230 0.106 1 1 238 . 2 1 1 A 23 23 PHE HA H 1791 4.701 4.965 -0.264 1 1 246 . 2 1 1 A 23 23 PHE CA C 1791 57.504 56.616 0.888 1 1 247 . 2 1 1 A 23 23 PHE CB C 1791 42.192 41.341 0.851 1 1 251 . 2 1 1 A 23 23 PHE N N 1791 122.145 123.124 -0.979 1 1 252 . 2 1 1 A 24 24 ASP H H 1792 6.954 9.283 -2.329 1 1 253 . 2 1 1 A 24 24 ASP HA H 1792 5.039 5.444 -0.405 1 1 256 . 2 1 1 A 24 24 ASP CA C 1792 52.871 52.733 0.138 1 1 257 . 2 1 1 A 24 24 ASP CB C 1792 44.696 44.342 0.354 1 1 258 . 2 1 1 A 24 24 ASP N N 1792 127.481 126.198 1.283 1 1 259 . 2 1 1 A 25 25 LEU H H 1793 8.372 8.953 -0.581 1 1 260 . 2 1 1 A 25 25 LEU HA H 1793 4.336 5.136 -0.800 1 1 270 . 2 1 1 A 25 25 LEU CA C 1793 54.860 53.303 1.557 1 1 271 . 2 1 1 A 25 25 LEU CB C 1793 47.575 46.467 1.108 1 1 274 . 2 1 1 A 25 25 LEU N N 1793 123.241 125.014 -1.773 1 1 275 . 2 1 1 A 26 26 VAL H H 1794 8.489 8.955 -0.466 1 1 276 . 2 1 1 A 26 26 VAL HA H 1794 4.903 5.108 -0.205 1 1 284 . 2 1 1 A 26 26 VAL CA C 1794 61.669 59.762 1.907 1 1 285 . 2 1 1 A 26 26 VAL CB C 1794 32.458 35.259 -2.801 1 1 288 . 2 1 1 A 26 26 VAL N N 1794 128.849 121.000 7.849 1 1 289 . 2 1 1 A 27 27 ILE H H 1795 9.101 9.105 -0.004 1 1 290 . 2 1 1 A 27 27 ILE HA H 1795 4.701 4.566 0.135 1 1 300 . 2 1 1 A 27 27 ILE CA C 1795 57.433 57.433 0.000 1 1 301 . 2 1 1 A 27 27 ILE CB C 1795 41.865 41.508 0.357 1 1 305 . 2 1 1 A 27 27 ILE N N 1795 127.511 128.053 -0.542 1 1 306 . 2 1 1 A 28 28 PRO HA H 1796 4.838 4.764 0.074 1 1 313 . 2 1 1 A 28 28 PRO CA C 1796 62.406 62.363 0.043 1 1 314 . 2 1 1 A 28 28 PRO CB C 1796 30.684 28.826 1.858 1 1 317 . 2 1 1 A 29 29 PHE H H 1797 8.255 8.737 -0.482 1 1 318 . 2 1 1 A 29 29 PHE HA H 1797 4.151 5.166 -1.015 1 1 326 . 2 1 1 A 29 29 PHE CA C 1797 60.405 56.742 3.663 1 1 327 . 2 1 1 A 29 29 PHE CB C 1797 41.395 42.924 -1.529 1 1 331 . 2 1 1 A 29 29 PHE N N 1797 128.572 122.946 5.626 1 1 332 . 2 1 1 A 30 30 THR H H 1798 7.433 8.074 -0.641 1 1 333 . 2 1 1 A 30 30 THR HA H 1798 4.108 4.801 -0.693 1 1 338 . 2 1 1 A 30 30 THR CA C 1798 61.473 61.254 0.219 1 1 339 . 2 1 1 A 30 30 THR CB C 1798 69.324 70.283 -0.959 1 1 341 . 2 1 1 A 30 30 THR N N 1798 123.124 119.414 3.710 1 1 342 . 2 1 1 A 31 31 ILE H H 1799 8.402 8.907 -0.505 1 1 343 . 2 1 1 A 31 31 ILE HA H 1799 3.653 4.479 -0.826 1 1 353 . 2 1 1 A 31 31 ILE CA C 1799 61.802 60.773 1.029 1 1 354 . 2 1 1 A 31 31 ILE CB C 1799 38.548 38.818 -0.270 1 1 358 . 2 1 1 A 31 31 ILE N N 1799 128.616 127.266 1.350 1 1 359 . 2 1 1 A 32 32 LYS H H 1800 7.742 9.064 -1.322 1 1 360 . 2 1 1 A 32 32 LYS HA H 1800 4.558 4.474 0.084 1 1 365 . 2 1 1 A 32 32 LYS CA C 1800 56.566 57.234 -0.668 1 1 366 . 2 1 1 A 32 32 LYS CB C 1800 31.982 33.797 -1.815 1 1 368 . 2 1 1 A 32 32 LYS N N 1800 128.656 128.658 -0.002 1 1 369 . 2 1 1 A 33 33 LYS HA H 1801 4.531 4.967 -0.436 1 1 378 . 2 1 1 A 33 33 LYS CA C 1801 56.310 54.708 1.602 1 1 379 . 2 1 1 A 33 33 LYS CB C 1801 33.027 35.976 -2.949 1 1 383 . 2 1 1 A 34 34 GLY H H 1802 8.088 8.391 -0.303 1 1 384 . 2 1 1 A 34 34 GLY HA2 H 1802 4.159 4.177 -0.018 1 1 385 . 2 1 1 A 34 34 GLY HA3 H 1802 3.712 4.294 -0.582 1 1 386 . 2 1 1 A 34 34 GLY CA C 1802 45.302 44.672 0.630 1 1 387 . 2 1 1 A 34 34 GLY N N 1802 110.338 109.231 1.107 1 1 388 . 2 1 1 A 35 35 GLU H H 1803 8.219 8.180 0.039 1 1 389 . 2 1 1 A 35 35 GLU HA H 1803 4.692 4.882 -0.190 1 1 394 . 2 1 1 A 35 35 GLU CA C 1803 55.160 55.209 -0.049 1 1 395 . 2 1 1 A 35 35 GLU CB C 1803 32.407 34.002 -1.595 1 1 397 . 2 1 1 A 35 35 GLU N N 1803 119.576 120.665 -1.089 1 1 398 . 2 1 1 A 36 36 ILE H H 1804 8.869 8.807 0.062 1 1 399 . 2 1 1 A 36 36 ILE HA H 1804 5.468 5.099 0.369 1 1 409 . 2 1 1 A 36 36 ILE CA C 1804 58.861 58.746 0.115 1 1 410 . 2 1 1 A 36 36 ILE CB C 1804 41.007 41.645 -0.638 1 1 414 . 2 1 1 A 36 36 ILE N N 1804 128.141 124.879 3.262 1 1 415 . 2 1 1 A 37 37 THR H H 1805 9.075 8.858 0.217 1 1 416 . 2 1 1 A 37 37 THR HA H 1805 4.703 5.023 -0.320 1 1 421 . 2 1 1 A 37 37 THR CA C 1805 59.932 59.955 -0.023 1 1 422 . 2 1 1 A 37 37 THR CB C 1805 72.441 72.386 0.055 1 1 424 . 2 1 1 A 37 37 THR N N 1805 119.846 116.864 2.982 1 1 425 . 2 1 1 A 38 38 GLY H H 1806 8.468 8.375 0.093 1 1 426 . 2 1 1 A 38 38 GLY HA2 H 1806 5.076 4.239 0.837 1 1 427 . 2 1 1 A 38 38 GLY HA3 H 1806 3.503 4.247 -0.744 1 1 428 . 2 1 1 A 38 38 GLY CA C 1806 45.593 45.807 -0.214 1 1 429 . 2 1 1 A 38 38 GLY N N 1806 107.815 108.579 -0.764 1 1 430 . 2 1 1 A 39 39 GLU H H 1807 8.519 8.653 -0.134 1 1 431 . 2 1 1 A 39 39 GLU HA H 1807 4.713 5.053 -0.340 1 1 436 . 2 1 1 A 39 39 GLU CA C 1807 56.936 55.632 1.304 1 1 437 . 2 1 1 A 39 39 GLU CB C 1807 34.937 34.003 0.934 1 1 439 . 2 1 1 A 39 39 GLU N N 1807 120.173 119.693 0.480 1 1 440 . 2 1 1 A 40 40 VAL H H 1808 9.156 9.309 -0.153 1 1 441 . 2 1 1 A 40 40 VAL HA H 1808 4.778 4.798 -0.020 1 1 449 . 2 1 1 A 40 40 VAL CA C 1808 60.574 61.005 -0.431 1 1 450 . 2 1 1 A 40 40 VAL CB C 1808 34.168 33.911 0.257 1 1 452 . 2 1 1 A 40 40 VAL N N 1808 126.330 126.351 -0.021 1 1 453 . 2 1 1 A 41 41 ARG H H 1809 9.044 9.144 -0.100 1 1 454 . 2 1 1 A 41 41 ARG HA H 1809 4.778 4.926 -0.148 1 1 462 . 2 1 1 A 41 41 ARG CA C 1809 55.317 54.005 1.312 1 1 463 . 2 1 1 A 41 41 ARG CB C 1809 31.940 32.925 -0.985 1 1 466 . 2 1 1 A 41 41 ARG N N 1809 127.098 126.350 0.748 1 1 468 . 2 1 1 A 42 42 MET H H 1810 8.264 8.880 -0.616 1 1 469 . 2 1 1 A 42 42 MET HA H 1810 4.050 4.383 -0.333 1 1 477 . 2 1 1 A 42 42 MET CA C 1810 53.716 53.955 -0.239 1 1 478 . 2 1 1 A 42 42 MET CB C 1810 32.779 32.661 0.118 1 1 481 . 2 1 1 A 42 42 MET N N 1810 123.461 122.894 0.567 1 1 482 . 2 1 1 A 43 43 PRO HA H 1811 4.179 4.369 -0.190 1 1 489 . 2 1 1 A 43 43 PRO CA C 1811 66.422 64.112 2.310 1 1 490 . 2 1 1 A 43 43 PRO CB C 1811 31.462 31.683 -0.221 1 1 493 . 2 1 1 A 44 44 SER H H 1812 8.860 7.699 1.161 1 1 494 . 2 1 1 A 44 44 SER HA H 1812 5.516 4.221 1.295 1 1 497 . 2 1 1 A 44 44 SER CA C 1812 59.937 58.784 1.153 1 1 498 . 2 1 1 A 44 44 SER CB C 1812 62.755 63.934 -1.179 1 1 499 . 2 1 1 A 44 44 SER N N 1812 112.267 109.953 2.314 1 1 500 . 2 1 1 A 45 45 GLY H H 1813 8.368 8.002 0.366 1 1 501 . 2 1 1 A 45 45 GLY HA2 H 1813 4.461 3.876 0.585 1 1 502 . 2 1 1 A 45 45 GLY HA3 H 1813 3.569 3.886 -0.317 1 1 503 . 2 1 1 A 45 45 GLY CA C 1813 44.525 45.114 -0.589 1 1 504 . 2 1 1 A 45 45 GLY N N 1813 112.727 111.095 1.632 1 1 505 . 2 1 1 A 46 46 LYS H H 1814 7.126 7.265 -0.139 1 1 506 . 2 1 1 A 46 46 LYS HA H 1814 4.206 4.335 -0.129 1 1 515 . 2 1 1 A 46 46 LYS CA C 1814 57.460 56.528 0.932 1 1 516 . 2 1 1 A 46 46 LYS CB C 1814 33.453 33.834 -0.381 1 1 520 . 2 1 1 A 46 46 LYS N N 1814 122.101 120.561 1.540 1 1 521 . 2 1 1 A 47 47 VAL H H 1815 8.056 8.459 -0.403 1 1 522 . 2 1 1 A 47 47 VAL HA H 1815 5.400 4.992 0.408 1 1 530 . 2 1 1 A 47 47 VAL CA C 1815 60.048 60.404 -0.356 1 1 531 . 2 1 1 A 47 47 VAL CB C 1815 35.044 35.908 -0.864 1 1 534 . 2 1 1 A 47 47 VAL N N 1815 118.680 120.916 -2.236 1 1 535 . 2 1 1 A 48 48 ALA H H 1816 9.110 8.785 0.325 1 1 536 . 2 1 1 A 48 48 ALA HA H 1816 4.804 4.980 -0.176 1 1 540 . 2 1 1 A 48 48 ALA CA C 1816 50.808 51.209 -0.401 1 1 541 . 2 1 1 A 48 48 ALA CB C 1816 24.108 24.229 -0.121 1 1 542 . 2 1 1 A 48 48 ALA N N 1816 128.274 126.873 1.401 1 1 543 . 2 1 1 A 49 49 GLN H H 1817 8.725 8.491 0.234 1 1 544 . 2 1 1 A 49 49 GLN HA H 1817 5.069 4.842 0.227 1 1 551 . 2 1 1 A 49 49 GLN CA C 1817 53.524 52.228 1.296 1 1 552 . 2 1 1 A 49 49 GLN CB C 1817 30.432 29.827 0.605 1 1 554 . 2 1 1 A 49 49 GLN N N 1817 120.102 117.870 2.232 1 1 556 . 2 1 1 A 50 50 PRO HA H 1818 5.136 4.772 0.364 1 1 563 . 2 1 1 A 50 50 PRO CA C 1818 61.966 62.394 -0.428 1 1 564 . 2 1 1 A 50 50 PRO CB C 1818 32.722 32.869 -0.147 1 1 567 . 2 1 1 A 51 51 THR H H 1819 9.072 8.471 0.601 1 1 568 . 2 1 1 A 51 51 THR HA H 1819 4.566 5.038 -0.472 1 1 573 . 2 1 1 A 51 51 THR CA C 1819 62.695 60.699 1.996 1 1 574 . 2 1 1 A 51 51 THR CB C 1819 70.056 70.612 -0.556 1 1 576 . 2 1 1 A 51 51 THR N N 1819 117.512 113.210 4.302 1 1 577 . 2 1 1 A 52 52 ILE H H 1820 8.900 9.306 -0.406 1 1 578 . 2 1 1 A 52 52 ILE HA H 1820 4.905 4.948 -0.043 1 1 588 . 2 1 1 A 52 52 ILE CA C 1820 60.869 59.755 1.114 1 1 589 . 2 1 1 A 52 52 ILE CB C 1820 39.670 40.089 -0.419 1 1 593 . 2 1 1 A 52 52 ILE N N 1820 129.513 128.481 1.032 1 1 594 . 2 1 1 A 53 53 THR H H 1821 9.200 9.539 -0.339 1 1 595 . 2 1 1 A 53 53 THR HA H 1821 4.541 4.920 -0.379 1 1 600 . 2 1 1 A 53 53 THR CA C 1821 61.084 61.906 -0.822 1 1 601 . 2 1 1 A 53 53 THR CB C 1821 71.410 70.975 0.435 1 1 603 . 2 1 1 A 53 53 THR N N 1821 125.271 124.199 1.072 1 1 604 . 2 1 1 A 54 54 ASP H H 1822 8.918 8.699 0.219 1 1 605 . 2 1 1 A 54 54 ASP HA H 1822 4.756 4.802 -0.046 1 1 608 . 2 1 1 A 54 54 ASP CA C 1822 53.906 53.960 -0.054 1 1 609 . 2 1 1 A 54 54 ASP CB C 1822 41.443 41.097 0.346 1 1 610 . 2 1 1 A 54 54 ASP N N 1822 126.647 126.555 0.092 1 1 611 . 2 1 1 A 55 55 ASN H H 1823 8.342 8.631 -0.289 1 1 612 . 2 1 1 A 55 55 ASN HA H 1823 4.704 4.651 0.053 1 1 617 . 2 1 1 A 55 55 ASN CA C 1823 54.421 53.145 1.276 1 1 618 . 2 1 1 A 55 55 ASN CB C 1823 38.557 38.726 -0.169 1 1 619 . 2 1 1 A 55 55 ASN N N 1823 126.271 124.340 1.931 1 1 621 . 2 1 1 A 56 56 LYS H H 1824 9.232 7.762 1.470 1 1 622 . 2 1 1 A 56 56 LYS HA H 1824 4.099 3.971 0.128 1 1 631 . 2 1 1 A 56 56 LYS CA C 1824 58.015 58.004 0.011 1 1 632 . 2 1 1 A 56 56 LYS CB C 1824 28.691 30.327 -1.636 1 1 636 . 2 1 1 A 56 56 LYS N N 1824 115.352 115.251 0.101 1 1 637 . 2 1 1 A 57 57 ASP H H 1825 7.905 8.048 -0.143 1 1 638 . 2 1 1 A 57 57 ASP HA H 1825 4.791 4.781 0.010 1 1 641 . 2 1 1 A 57 57 ASP CA C 1825 52.401 53.778 -1.377 1 1 642 . 2 1 1 A 57 57 ASP CB C 1825 41.166 41.084 0.082 1 1 643 . 2 1 1 A 57 57 ASP N N 1825 119.741 118.603 1.138 1 1 644 . 2 1 1 A 58 58 GLY H H 1826 8.930 8.969 -0.039 1 1 645 . 2 1 1 A 58 58 GLY HA2 H 1826 4.265 3.870 0.395 1 1 646 . 2 1 1 A 58 58 GLY HA3 H 1826 3.712 3.882 -0.170 1 1 647 . 2 1 1 A 58 58 GLY CA C 1826 44.870 45.657 -0.787 1 1 648 . 2 1 1 A 58 58 GLY N N 1826 109.578 108.377 1.201 1 1 649 . 2 1 1 A 59 59 THR H H 1827 8.004 7.651 0.353 1 1 650 . 2 1 1 A 59 59 THR HA H 1827 5.394 5.084 0.310 1 1 655 . 2 1 1 A 59 59 THR CA C 1827 60.262 59.273 0.989 1 1 656 . 2 1 1 A 59 59 THR CB C 1827 73.892 72.514 1.378 1 1 658 . 2 1 1 A 59 59 THR N N 1827 112.179 110.214 1.965 1 1 659 . 2 1 1 A 60 60 VAL H H 1828 8.822 9.280 -0.458 1 1 660 . 2 1 1 A 60 60 VAL HA H 1828 5.124 4.937 0.187 1 1 668 . 2 1 1 A 60 60 VAL CA C 1828 59.430 59.445 -0.015 1 1 669 . 2 1 1 A 60 60 VAL CB C 1828 35.088 34.740 0.348 1 1 672 . 2 1 1 A 60 60 VAL N N 1828 115.300 116.382 -1.082 1 1 673 . 2 1 1 A 61 61 THR H H 1829 9.115 8.795 0.320 1 1 674 . 2 1 1 A 61 61 THR HA H 1829 5.128 5.051 0.077 1 1 679 . 2 1 1 A 61 61 THR CA C 1829 61.934 61.870 0.064 1 1 680 . 2 1 1 A 61 61 THR CB C 1829 70.561 70.619 -0.058 1 1 682 . 2 1 1 A 61 61 THR N N 1829 121.210 119.531 1.679 1 1 683 . 2 1 1 A 62 62 VAL H H 1830 9.530 9.253 0.277 1 1 684 . 2 1 1 A 62 62 VAL HA H 1830 4.803 4.973 -0.170 1 1 692 . 2 1 1 A 62 62 VAL CA C 1830 60.580 60.674 -0.094 1 1 693 . 2 1 1 A 62 62 VAL CB C 1830 33.747 34.478 -0.731 1 1 696 . 2 1 1 A 62 62 VAL N N 1830 129.896 125.737 4.159 1 1 697 . 2 1 1 A 63 63 ARG H H 1831 8.879 9.031 -0.152 1 1 698 . 2 1 1 A 63 63 ARG HA H 1831 5.282 5.094 0.188 1 1 705 . 2 1 1 A 63 63 ARG CA C 1831 54.759 54.036 0.723 1 1 706 . 2 1 1 A 63 63 ARG CB C 1831 34.410 34.319 0.091 1 1 709 . 2 1 1 A 63 63 ARG N N 1831 125.701 125.827 -0.126 1 1 710 . 2 1 1 A 64 64 TYR H H 1832 8.878 8.720 0.158 1 1 711 . 2 1 1 A 64 64 TYR HA H 1832 4.888 4.921 -0.033 1 1 718 . 2 1 1 A 64 64 TYR CA C 1832 57.694 57.829 -0.135 1 1 719 . 2 1 1 A 64 64 TYR CB C 1832 42.389 42.028 0.361 1 1 722 . 2 1 1 A 64 64 TYR N N 1832 122.731 123.446 -0.715 1 1 723 . 2 1 1 A 65 65 ALA H H 1833 7.925 8.179 -0.254 1 1 724 . 2 1 1 A 65 65 ALA HA H 1833 4.736 4.417 0.319 1 1 728 . 2 1 1 A 65 65 ALA CA C 1833 47.938 49.513 -1.575 1 1 729 . 2 1 1 A 65 65 ALA CB C 1833 18.320 19.578 -1.258 1 1 730 . 2 1 1 A 65 65 ALA N N 1833 135.415 128.931 6.484 1 1 731 . 2 1 1 A 66 66 PRO HA H 1834 4.198 4.539 -0.341 1 1 738 . 2 1 1 A 66 66 PRO CA C 1834 62.701 62.173 0.528 1 1 739 . 2 1 1 A 66 66 PRO CB C 1834 34.445 32.440 2.005 1 1 742 . 2 1 1 A 67 67 SER H H 1835 9.019 8.945 0.074 1 1 743 . 2 1 1 A 67 67 SER HA H 1835 4.555 4.720 -0.165 1 1 746 . 2 1 1 A 67 67 SER CA C 1835 57.320 57.976 -0.656 1 1 747 . 2 1 1 A 67 67 SER CB C 1835 64.778 64.731 0.047 1 1 748 . 2 1 1 A 67 67 SER N N 1835 112.422 115.823 -3.401 1 1 749 . 2 1 1 A 68 68 GLU H H 1836 7.625 7.594 0.031 1 1 750 . 2 1 1 A 68 68 GLU HA H 1836 4.513 4.644 -0.131 1 1 755 . 2 1 1 A 68 68 GLU CA C 1836 54.777 55.902 -1.125 1 1 756 . 2 1 1 A 68 68 GLU CB C 1836 33.981 33.704 0.277 1 1 758 . 2 1 1 A 68 68 GLU N N 1836 123.025 120.702 2.323 1 1 759 . 2 1 1 A 69 69 ALA H H 1837 8.133 8.496 -0.363 1 1 760 . 2 1 1 A 69 69 ALA HA H 1837 4.088 4.286 -0.198 1 1 764 . 2 1 1 A 69 69 ALA CA C 1837 51.070 51.919 -0.849 1 1 765 . 2 1 1 A 69 69 ALA CB C 1837 19.665 20.100 -0.435 1 1 766 . 2 1 1 A 69 69 ALA N N 1837 122.311 126.605 -4.294 1 1 767 . 2 1 1 A 70 70 GLY H H 1838 9.120 8.119 1.001 1 1 768 . 2 1 1 A 70 70 GLY HA2 H 1838 4.453 3.567 0.886 1 1 769 . 2 1 1 A 70 70 GLY HA3 H 1838 2.953 3.919 -0.966 1 1 770 . 2 1 1 A 70 70 GLY CA C 1838 43.362 43.527 -0.165 1 1 771 . 2 1 1 A 70 70 GLY N N 1838 107.031 105.977 1.054 1 1 772 . 2 1 1 A 71 71 LEU H H 1839 9.096 8.205 0.891 1 1 773 . 2 1 1 A 71 71 LEU HA H 1839 4.336 4.460 -0.124 1 1 783 . 2 1 1 A 71 71 LEU CA C 1839 56.657 54.700 1.957 1 1 784 . 2 1 1 A 71 71 LEU CB C 1839 42.032 42.881 -0.849 1 1 788 . 2 1 1 A 71 71 LEU N N 1839 127.931 121.717 6.214 1 1 789 . 2 1 1 A 72 72 HIS H H 1840 9.359 9.389 -0.030 1 1 790 . 2 1 1 A 72 72 HIS HA H 1840 4.595 5.188 -0.593 1 1 796 . 2 1 1 A 72 72 HIS CA C 1840 54.539 54.105 0.434 1 1 797 . 2 1 1 A 72 72 HIS CB C 1840 31.421 33.817 -2.396 1 1 800 . 2 1 1 A 72 72 HIS N N 1840 128.527 125.675 2.852 1 1 802 . 2 1 1 A 73 73 GLU H H 1841 7.925 8.881 -0.956 1 1 803 . 2 1 1 A 73 73 GLU HA H 1841 5.142 5.391 -0.249 1 1 808 . 2 1 1 A 73 73 GLU CA C 1841 54.381 55.074 -0.693 1 1 809 . 2 1 1 A 73 73 GLU CB C 1841 34.043 33.944 0.099 1 1 811 . 2 1 1 A 73 73 GLU N N 1841 119.347 118.617 0.730 1 1 812 . 2 1 1 A 74 74 MET H H 1842 9.383 9.013 0.370 1 1 813 . 2 1 1 A 74 74 MET HA H 1842 5.548 5.248 0.300 1 1 821 . 2 1 1 A 74 74 MET CA C 1842 53.859 54.337 -0.478 1 1 822 . 2 1 1 A 74 74 MET CB C 1842 38.571 36.704 1.867 1 1 825 . 2 1 1 A 74 74 MET N N 1842 124.747 120.511 4.236 1 1 826 . 2 1 1 A 75 75 ASP H H 1843 9.005 9.160 -0.155 1 1 827 . 2 1 1 A 75 75 ASP HA H 1843 5.277 5.502 -0.225 1 1 830 . 2 1 1 A 75 75 ASP CA C 1843 52.774 52.889 -0.115 1 1 831 . 2 1 1 A 75 75 ASP CB C 1843 43.493 43.201 0.292 1 1 832 . 2 1 1 A 75 75 ASP N N 1843 128.148 125.319 2.829 1 1 833 . 2 1 1 A 76 76 ILE H H 1844 9.434 8.650 0.784 1 1 834 . 2 1 1 A 76 76 ILE HA H 1844 4.672 4.817 -0.145 1 1 844 . 2 1 1 A 76 76 ILE CA C 1844 60.715 59.801 0.914 1 1 845 . 2 1 1 A 76 76 ILE CB C 1844 39.470 40.812 -1.342 1 1 849 . 2 1 1 A 76 76 ILE N N 1844 124.097 123.202 0.895 1 1 850 . 2 1 1 A 77 77 ARG H H 1845 8.888 9.049 -0.161 1 1 851 . 2 1 1 A 77 77 ARG HA H 1845 5.050 4.934 0.116 1 1 859 . 2 1 1 A 77 77 ARG CA C 1845 53.780 54.139 -0.359 1 1 860 . 2 1 1 A 77 77 ARG CB C 1845 34.564 33.682 0.882 1 1 863 . 2 1 1 A 77 77 ARG N N 1845 124.944 124.347 0.597 1 1 865 . 2 1 1 A 78 78 TYR H H 1846 8.974 9.068 -0.094 1 1 866 . 2 1 1 A 78 78 TYR HA H 1846 5.151 4.941 0.210 1 1 873 . 2 1 1 A 78 78 TYR CA C 1846 55.909 57.498 -1.589 1 1 874 . 2 1 1 A 78 78 TYR CB C 1846 41.732 40.334 1.398 1 1 877 . 2 1 1 A 78 78 TYR N N 1846 121.774 124.875 -3.101 1 1 878 . 2 1 1 A 79 79 ASP H H 1847 9.026 9.347 -0.321 1 1 879 . 2 1 1 A 79 79 ASP HA H 1847 4.127 4.247 -0.120 1 1 882 . 2 1 1 A 79 79 ASP CA C 1847 55.808 55.103 0.705 1 1 883 . 2 1 1 A 79 79 ASP CB C 1847 39.181 39.618 -0.437 1 1 884 . 2 1 1 A 79 79 ASP N N 1847 131.304 128.006 3.298 1 1 885 . 2 1 1 A 80 80 ASN H H 1848 8.608 8.441 0.167 1 1 886 . 2 1 1 A 80 80 ASN HA H 1848 3.990 4.361 -0.371 1 1 891 . 2 1 1 A 80 80 ASN CA C 1848 55.149 54.645 0.504 1 1 892 . 2 1 1 A 80 80 ASN CB C 1848 38.470 38.880 -0.410 1 1 893 . 2 1 1 A 80 80 ASN N N 1848 108.490 115.021 -6.531 1 1 895 . 2 1 1 A 81 81 MET H H 1849 7.820 7.954 -0.134 1 1 896 . 2 1 1 A 81 81 MET HA H 1849 4.819 4.865 -0.046 1 1 904 . 2 1 1 A 81 81 MET CA C 1849 53.852 53.965 -0.113 1 1 905 . 2 1 1 A 81 81 MET CB C 1849 34.665 33.504 1.161 1 1 908 . 2 1 1 A 81 81 MET N N 1849 121.878 119.730 2.148 1 1 909 . 2 1 1 A 82 82 HIS H H 1850 8.575 8.758 -0.183 1 1 910 . 2 1 1 A 82 82 HIS HA H 1850 4.539 4.678 -0.139 1 1 915 . 2 1 1 A 82 82 HIS CA C 1850 58.819 57.277 1.542 1 1 916 . 2 1 1 A 82 82 HIS CB C 1850 32.419 30.582 1.837 1 1 919 . 2 1 1 A 82 82 HIS N N 1850 124.291 120.816 3.475 1 1 920 . 2 1 1 A 83 83 ILE H H 1851 8.333 8.148 0.185 1 1 921 . 2 1 1 A 83 83 ILE HA H 1851 4.608 4.356 0.252 1 1 931 . 2 1 1 A 83 83 ILE CA C 1851 60.727 59.423 1.304 1 1 932 . 2 1 1 A 83 83 ILE CB C 1851 35.928 37.635 -1.707 1 1 936 . 2 1 1 A 83 83 ILE N N 1851 120.786 120.975 -0.189 1 1 937 . 2 1 1 A 84 84 PRO HA H 1852 4.426 4.341 0.085 1 1 944 . 2 1 1 A 84 84 PRO CA C 1852 65.249 63.837 1.412 1 1 945 . 2 1 1 A 84 84 PRO CB C 1852 31.120 31.432 -0.312 1 1 948 . 2 1 1 A 85 85 GLY H H 1853 8.498 8.974 -0.476 1 1 949 . 2 1 1 A 85 85 GLY HA2 H 1853 4.284 4.106 0.178 1 1 950 . 2 1 1 A 85 85 GLY HA3 H 1853 3.397 4.115 -0.718 1 1 951 . 2 1 1 A 85 85 GLY CA C 1853 44.913 45.267 -0.354 1 1 952 . 2 1 1 A 85 85 GLY N N 1853 114.093 113.605 0.488 1 1 953 . 2 1 1 A 86 86 SER H H 1854 7.823 7.967 -0.144 1 1 954 . 2 1 1 A 86 86 SER HA H 1854 4.834 4.756 0.078 1 1 957 . 2 1 1 A 86 86 SER CA C 1854 55.628 55.664 -0.036 1 1 958 . 2 1 1 A 86 86 SER CB C 1854 63.063 64.076 -1.013 1 1 959 . 2 1 1 A 86 86 SER N N 1854 112.722 117.834 -5.112 1 1 960 . 2 1 1 A 87 87 PRO HA H 1855 5.681 4.827 0.854 1 1 967 . 2 1 1 A 87 87 PRO CA C 1855 63.079 62.735 0.344 1 1 968 . 2 1 1 A 87 87 PRO CB C 1855 34.406 32.574 1.832 1 1 971 . 2 1 1 A 88 88 LEU H H 1856 9.168 8.814 0.354 1 1 972 . 2 1 1 A 88 88 LEU HA H 1856 4.909 5.065 -0.156 1 1 982 . 2 1 1 A 88 88 LEU CA C 1856 53.839 53.562 0.277 1 1 983 . 2 1 1 A 88 88 LEU CB C 1856 45.558 45.126 0.432 1 1 987 . 2 1 1 A 88 88 LEU N N 1856 122.495 121.467 1.028 1 1 988 . 2 1 1 A 89 89 GLN H H 1857 9.583 8.779 0.804 1 1 989 . 2 1 1 A 89 89 GLN HA H 1857 5.508 5.255 0.253 1 1 996 . 2 1 1 A 89 89 GLN CA C 1857 54.609 55.064 -0.455 1 1 997 . 2 1 1 A 89 89 GLN CB C 1857 32.840 32.348 0.492 1 1 999 . 2 1 1 A 89 89 GLN N N 1857 119.151 121.285 -2.134 1 1 1001 . 2 1 1 A 90 90 PHE H H 1858 8.600 8.900 -0.300 1 1 1002 . 2 1 1 A 90 90 PHE HA H 1858 5.095 5.128 -0.033 1 1 1010 . 2 1 1 A 90 90 PHE CA C 1858 56.161 56.306 -0.145 1 1 1011 . 2 1 1 A 90 90 PHE CB C 1858 41.411 40.468 0.943 1 1 1015 . 2 1 1 A 90 90 PHE N N 1858 118.242 120.169 -1.927 1 1 1016 . 2 1 1 A 91 91 TYR H H 1859 9.892 8.816 1.076 1 1 1017 . 2 1 1 A 91 91 TYR HA H 1859 4.790 5.021 -0.231 1 1 1024 . 2 1 1 A 91 91 TYR CA C 1859 58.205 55.942 2.263 1 1 1025 . 2 1 1 A 91 91 TYR CB C 1859 40.867 41.886 -1.019 1 1 1028 . 2 1 1 A 91 91 TYR N N 1859 127.393 121.818 5.575 1 1 1029 . 2 1 1 A 92 92 VAL H H 1860 8.072 8.371 -0.299 1 1 1030 . 2 1 1 A 92 92 VAL HA H 1860 4.377 4.694 -0.317 1 1 1038 . 2 1 1 A 92 92 VAL CA C 1860 62.583 60.548 2.035 1 1 1039 . 2 1 1 A 92 92 VAL CB C 1860 33.609 33.500 0.109 1 1 1042 . 2 1 1 A 92 92 VAL N N 1860 132.007 126.283 5.724 1 1 1043 . 2 1 1 A 93 93 ASP H H 1861 8.438 8.526 -0.088 1 1 1044 . 2 1 1 A 93 93 ASP HA H 1861 5.024 4.796 0.228 1 1 1047 . 2 1 1 A 93 93 ASP CA C 1861 50.678 53.407 -2.729 1 1 1048 . 2 1 1 A 93 93 ASP CB C 1861 46.086 45.134 0.952 1 1 1049 . 2 1 1 A 93 93 ASP N N 1861 130.459 125.048 5.411 1 1 1050 . 2 1 1 A 94 94 TYR H H 1862 9.674 8.666 1.008 1 1 1051 . 2 1 1 A 94 94 TYR HA H 1862 4.606 4.491 0.115 1 1 1058 . 2 1 1 A 94 94 TYR CA C 1862 58.983 59.179 -0.196 1 1 1059 . 2 1 1 A 94 94 TYR CB C 1862 39.727 38.764 0.963 1 1 1062 . 2 1 1 A 94 94 TYR N N 1862 120.069 122.196 -2.127 1 1 1063 . 2 1 1 A 95 95 VAL H H 1863 8.371 8.971 -0.600 1 1 1064 . 2 1 1 A 95 95 VAL HA H 1863 3.654 3.993 -0.339 1 1 1072 . 2 1 1 A 95 95 VAL CA C 1863 64.922 64.562 0.360 1 1 1073 . 2 1 1 A 95 95 VAL CB C 1863 32.270 31.951 0.319 1 1 1076 . 2 1 1 A 95 95 VAL N N 1863 121.770 125.592 -3.822 1 1 1077 . 2 1 1 A 96 96 ASN H H 1864 8.729 7.819 0.910 1 1 1078 . 2 1 1 A 96 96 ASN HA H 1864 4.901 4.663 0.238 1 1 1083 . 2 1 1 A 96 96 ASN CA C 1864 52.652 55.486 -2.834 1 1 1084 . 2 1 1 A 96 96 ASN CB C 1864 38.160 38.815 -0.655 1 1 1085 . 2 1 1 A 96 96 ASN N N 1864 120.006 118.777 1.229 1 1 1087 . 2 1 1 A 97 97 CYS H H 1865 7.875 7.435 0.440 1 1 1088 . 2 1 1 A 97 97 CYS HA H 1865 4.575 4.345 0.230 1 1 1091 . 2 1 1 A 97 97 CYS CA C 1865 57.009 59.277 -2.268 1 1 1092 . 2 1 1 A 97 97 CYS CB C 1865 29.845 28.519 1.326 1 1 1093 . 2 1 1 A 97 97 CYS N N 1865 117.023 118.935 -1.912 1 1 1094 . 2 1 1 A 98 98 GLY HA2 H 1866 4.045 3.897 0.148 1 1 1095 . 2 1 1 A 98 98 GLY HA3 H 1866 3.866 3.910 -0.044 1 1 1096 . 2 1 1 A 98 98 GLY CA C 1866 46.078 45.444 0.634 1 1 1097 . 2 1 1 A 99 99 HIS H H 1867 7.144 7.576 -0.432 1 1 1098 . 2 1 1 A 99 99 HIS HA H 1867 4.940 4.511 0.429 1 1 1103 . 2 1 1 A 99 99 HIS CA C 1867 53.843 55.914 -2.071 1 1 1104 . 2 1 1 A 99 99 HIS CB C 1867 31.584 30.758 0.826 1 1 1107 . 2 1 1 A 99 99 HIS N N 1867 115.591 117.421 -1.830 1 1 1108 . 2 1 1 A 100 100 VAL H H 1868 8.434 8.418 0.016 1 1 1109 . 2 1 1 A 100 100 VAL HA H 1868 4.143 4.353 -0.210 1 1 1117 . 2 1 1 A 100 100 VAL CA C 1868 63.974 62.883 1.091 1 1 1118 . 2 1 1 A 100 100 VAL CB C 1868 31.525 32.391 -0.866 1 1 1121 . 2 1 1 A 100 100 VAL N N 1868 122.851 120.810 2.041 1 1 1122 . 2 1 1 A 101 101 THR H H 1869 7.869 8.332 -0.463 1 1 1123 . 2 1 1 A 101 101 THR HA H 1869 5.217 4.830 0.387 1 1 1128 . 2 1 1 A 101 101 THR CA C 1869 59.495 60.836 -1.341 1 1 1129 . 2 1 1 A 101 101 THR CB C 1869 72.402 71.189 1.213 1 1 1131 . 2 1 1 A 101 101 THR N N 1869 118.578 119.203 -0.625 1 1 1132 . 2 1 1 A 102 102 ALA H H 1870 8.512 9.129 -0.617 1 1 1133 . 2 1 1 A 102 102 ALA HA H 1870 5.687 5.646 0.041 1 1 1137 . 2 1 1 A 102 102 ALA CA C 1870 50.497 50.210 0.287 1 1 1138 . 2 1 1 A 102 102 ALA CB C 1870 23.128 22.508 0.620 1 1 1139 . 2 1 1 A 102 102 ALA N N 1870 125.193 128.903 -3.710 1 1 1140 . 2 1 1 A 103 103 TYR H H 1871 8.753 8.703 0.050 1 1 1141 . 2 1 1 A 103 103 TYR HA H 1871 5.019 5.138 -0.119 1 1 1148 . 2 1 1 A 103 103 TYR CA C 1871 56.303 56.115 0.188 1 1 1149 . 2 1 1 A 103 103 TYR CB C 1871 39.347 41.053 -1.706 1 1 1152 . 2 1 1 A 103 103 TYR N N 1871 119.968 116.715 3.253 1 1 1153 . 2 1 1 A 104 104 GLY H H 1872 9.006 8.587 0.419 1 1 1154 . 2 1 1 A 104 104 GLY HA2 H 1872 5.326 4.293 1.033 1 1 1155 . 2 1 1 A 104 104 GLY HA3 H 1872 4.226 4.329 -0.103 1 1 1156 . 2 1 1 A 104 104 GLY CA C 1872 44.624 44.451 0.173 1 1 1157 . 2 1 1 A 104 104 GLY N N 1872 109.622 106.902 2.720 1 1 1158 . 2 1 1 A 105 105 PRO HA H 1873 4.450 4.461 -0.011 1 1 1165 . 2 1 1 A 105 105 PRO CA C 1873 66.676 65.039 1.637 1 1 1166 . 2 1 1 A 105 105 PRO CB C 1873 32.425 32.117 0.308 1 1 1169 . 2 1 1 A 106 106 GLY H H 1874 9.251 8.631 0.620 1 1 1170 . 2 1 1 A 106 106 GLY HA2 H 1874 4.600 3.893 0.707 1 1 1171 . 2 1 1 A 106 106 GLY HA3 H 1874 3.521 4.113 -0.592 1 1 1172 . 2 1 1 A 106 106 GLY CA C 1874 46.454 47.058 -0.604 1 1 1173 . 2 1 1 A 106 106 GLY N N 1874 105.282 105.519 -0.237 1 1 1174 . 2 1 1 A 107 107 LEU H H 1875 7.161 7.906 -0.745 1 1 1175 . 2 1 1 A 107 107 LEU HA H 1875 4.062 3.973 0.089 1 1 1185 . 2 1 1 A 107 107 LEU CA C 1875 55.592 56.192 -0.600 1 1 1186 . 2 1 1 A 107 107 LEU CB C 1875 41.516 40.613 0.903 1 1 1190 . 2 1 1 A 107 107 LEU N N 1875 117.141 119.363 -2.222 1 1 1191 . 2 1 1 A 108 108 THR H H 1876 8.298 7.898 0.400 1 1 1192 . 2 1 1 A 108 108 THR HA H 1876 5.038 4.468 0.570 1 1 1197 . 2 1 1 A 108 108 THR CA C 1876 64.551 63.726 0.825 1 1 1198 . 2 1 1 A 108 108 THR CB C 1876 72.706 70.806 1.900 1 1 1200 . 2 1 1 A 108 108 THR N N 1876 114.411 112.176 2.235 1 1 1201 . 2 1 1 A 109 109 HIS H H 1877 9.030 7.895 1.135 1 1 1202 . 2 1 1 A 109 109 HIS HA H 1877 5.854 5.022 0.832 1 1 1207 . 2 1 1 A 109 109 HIS CA C 1877 56.127 55.366 0.761 1 1 1208 . 2 1 1 A 109 109 HIS CB C 1877 36.258 32.901 3.357 1 1 1211 . 2 1 1 A 109 109 HIS N N 1877 125.809 117.106 8.703 1 1 1212 . 2 1 1 A 110 110 GLY H H 1878 7.497 8.055 -0.558 1 1 1213 . 2 1 1 A 110 110 GLY HA2 H 1878 4.075 4.096 -0.021 1 1 1214 . 2 1 1 A 110 110 GLY HA3 H 1878 3.512 4.101 -0.589 1 1 1215 . 2 1 1 A 110 110 GLY CA C 1878 44.559 44.214 0.345 1 1 1216 . 2 1 1 A 110 110 GLY N N 1878 111.907 111.210 0.697 1 1 1217 . 2 1 1 A 111 111 VAL H H 1879 8.776 8.264 0.512 1 1 1218 . 2 1 1 A 111 111 VAL HA H 1879 4.741 4.665 0.076 1 1 1226 . 2 1 1 A 111 111 VAL CA C 1879 60.188 60.538 -0.350 1 1 1227 . 2 1 1 A 111 111 VAL CB C 1879 35.130 35.639 -0.509 1 1 1230 . 2 1 1 A 111 111 VAL N N 1879 119.617 119.818 -0.201 1 1 1231 . 2 1 1 A 112 112 VAL H H 1880 7.841 8.715 -0.874 1 1 1232 . 2 1 1 A 112 112 VAL HA H 1880 3.343 3.924 -0.581 1 1 1240 . 2 1 1 A 112 112 VAL CA C 1880 63.553 62.690 0.863 1 1 1241 . 2 1 1 A 112 112 VAL CB C 1880 32.257 31.571 0.686 1 1 1243 . 2 1 1 A 112 112 VAL N N 1880 122.070 126.148 -4.078 1 1 1244 . 2 1 1 A 113 113 ASN H H 1881 8.822 9.110 -0.288 1 1 1245 . 2 1 1 A 113 113 ASN HA H 1881 4.079 4.326 -0.247 1 1 1250 . 2 1 1 A 113 113 ASN CA C 1881 55.459 54.779 0.680 1 1 1251 . 2 1 1 A 113 113 ASN CB C 1881 37.330 37.188 0.142 1 1 1252 . 2 1 1 A 113 113 ASN N N 1881 115.063 117.874 -2.811 1 1 1254 . 2 1 1 A 114 114 LYS H H 1882 8.073 7.517 0.556 1 1 1255 . 2 1 1 A 114 114 LYS HA H 1882 4.818 4.648 0.170 1 1 1260 . 2 1 1 A 114 114 LYS CA C 1882 53.039 53.211 -0.172 1 1 1261 . 2 1 1 A 114 114 LYS CB C 1882 34.020 33.012 1.008 1 1 1263 . 2 1 1 A 114 114 LYS N N 1882 121.439 118.941 2.498 1 1 1264 . 2 1 1 A 115 115 PRO HA H 1883 4.409 4.716 -0.307 1 1 1271 . 2 1 1 A 115 115 PRO CA C 1883 63.121 62.447 0.674 1 1 1272 . 2 1 1 A 115 115 PRO CB C 1883 31.515 31.679 -0.164 1 1 1275 . 2 1 1 A 116 116 ALA H H 1884 8.868 8.111 0.757 1 1 1276 . 2 1 1 A 116 116 ALA HA H 1884 4.804 4.962 -0.158 1 1 1280 . 2 1 1 A 116 116 ALA CA C 1884 50.620 50.384 0.236 1 1 1281 . 2 1 1 A 116 116 ALA CB C 1884 19.426 20.409 -0.983 1 1 1282 . 2 1 1 A 116 116 ALA N N 1884 132.329 126.171 6.158 1 1 1283 . 2 1 1 A 117 117 THR H H 1885 8.433 8.861 -0.428 1 1 1284 . 2 1 1 A 117 117 THR HA H 1885 5.747 5.518 0.229 1 1 1289 . 2 1 1 A 117 117 THR CA C 1885 60.364 59.390 0.974 1 1 1290 . 2 1 1 A 117 117 THR CB C 1885 72.204 72.016 0.188 1 1 1292 . 2 1 1 A 117 117 THR N N 1885 113.428 111.475 1.953 1 1 1293 . 2 1 1 A 118 118 PHE H H 1886 9.069 8.486 0.583 1 1 1294 . 2 1 1 A 118 118 PHE HA H 1886 5.123 5.214 -0.091 1 1 1301 . 2 1 1 A 118 118 PHE CA C 1886 57.059 55.987 1.072 1 1 1302 . 2 1 1 A 118 118 PHE CB C 1886 39.994 41.040 -1.046 1 1 1305 . 2 1 1 A 118 118 PHE N N 1886 119.166 117.864 1.302 1 1 1306 . 2 1 1 A 119 119 THR H H 1887 9.451 8.889 0.562 1 1 1307 . 2 1 1 A 119 119 THR HA H 1887 5.097 5.235 -0.138 1 1 1312 . 2 1 1 A 119 119 THR CA C 1887 62.050 61.297 0.753 1 1 1313 . 2 1 1 A 119 119 THR CB C 1887 71.696 71.888 -0.192 1 1 1315 . 2 1 1 A 119 119 THR N N 1887 119.436 114.376 5.060 1 1 1316 . 2 1 1 A 120 120 VAL H H 1888 8.812 9.389 -0.577 1 1 1317 . 2 1 1 A 120 120 VAL HA H 1888 4.807 4.552 0.255 1 1 1325 . 2 1 1 A 120 120 VAL CA C 1888 61.140 60.951 0.189 1 1 1326 . 2 1 1 A 120 120 VAL CB C 1888 34.059 34.214 -0.155 1 1 1329 . 2 1 1 A 120 120 VAL N N 1888 124.304 126.148 -1.844 1 1 1330 . 2 1 1 A 121 121 ASN H H 1889 9.291 9.216 0.075 1 1 1331 . 2 1 1 A 121 121 ASN HA H 1889 5.177 5.248 -0.071 1 1 1336 . 2 1 1 A 121 121 ASN CA C 1889 52.470 52.618 -0.148 1 1 1337 . 2 1 1 A 121 121 ASN CB C 1889 39.766 40.385 -0.619 1 1 1338 . 2 1 1 A 121 121 ASN N N 1889 128.674 125.805 2.869 1 1 1340 . 2 1 1 A 122 122 THR H H 1890 8.553 8.701 -0.148 1 1 1341 . 2 1 1 A 122 122 THR HA H 1890 4.236 4.934 -0.698 1 1 1346 . 2 1 1 A 122 122 THR CA C 1890 61.062 61.156 -0.094 1 1 1347 . 2 1 1 A 122 122 THR CB C 1890 68.437 69.646 -1.209 1 1 1349 . 2 1 1 A 122 122 THR N N 1890 116.203 113.544 2.659 1 1 1350 . 2 1 1 A 123 123 LYS H H 1891 8.210 7.996 0.214 1 1 1351 . 2 1 1 A 123 123 LYS HA H 1891 4.019 4.019 0.000 1 1 1360 . 2 1 1 A 123 123 LYS CA C 1891 58.646 59.534 -0.888 1 1 1361 . 2 1 1 A 123 123 LYS CB C 1891 31.868 32.192 -0.324 1 1 1365 . 2 1 1 A 123 123 LYS N N 1891 124.070 122.449 1.621 1 1 1366 . 2 1 1 A 124 124 ASP H H 1892 8.596 7.905 0.691 1 1 1367 . 2 1 1 A 124 124 ASP HA H 1892 4.638 4.947 -0.309 1 1 1370 . 2 1 1 A 124 124 ASP CA C 1892 54.928 52.831 2.097 1 1 1371 . 2 1 1 A 124 124 ASP CB C 1892 40.725 41.609 -0.884 1 1 1372 . 2 1 1 A 124 124 ASP N N 1892 119.838 118.028 1.810 1 1 1373 . 2 1 1 A 125 125 ALA H H 1893 7.792 7.815 -0.023 1 1 1374 . 2 1 1 A 125 125 ALA HA H 1893 4.248 4.071 0.177 1 1 1378 . 2 1 1 A 125 125 ALA CA C 1893 52.852 53.305 -0.453 1 1 1379 . 2 1 1 A 125 125 ALA CB C 1893 20.199 19.190 1.009 1 1 1380 . 2 1 1 A 125 125 ALA N N 1893 122.999 122.440 0.559 1 1 1381 . 2 1 1 A 126 126 GLY H H 1894 8.214 7.689 0.525 1 1 1382 . 2 1 1 A 126 126 GLY HA2 H 1894 4.183 3.948 0.235 1 1 1383 . 2 1 1 A 126 126 GLY HA3 H 1894 3.993 3.992 0.001 1 1 1384 . 2 1 1 A 126 126 GLY CA C 1894 44.725 44.620 0.105 1 1 1385 . 2 1 1 A 126 126 GLY N N 1894 108.359 104.118 4.241 1 1 1386 . 2 1 1 A 127 127 GLU H H 1895 8.633 8.439 0.194 1 1 1387 . 2 1 1 A 127 127 GLU HA H 1895 4.318 4.585 -0.267 1 1 1392 . 2 1 1 A 127 127 GLU CA C 1895 57.280 56.926 0.354 1 1 1393 . 2 1 1 A 127 127 GLU CB C 1895 30.434 30.901 -0.467 1 1 1395 . 2 1 1 A 127 127 GLU N N 1895 122.934 120.467 2.467 1 1 1396 . 2 1 1 A 128 128 GLY H H 1896 8.351 8.653 -0.302 1 1 1397 . 2 1 1 A 128 128 GLY HA2 H 1896 3.853 4.046 -0.193 1 1 1398 . 2 1 1 A 128 128 GLY HA3 H 1896 3.853 4.055 -0.202 1 1 1399 . 2 1 1 A 128 128 GLY CA C 1896 45.766 45.491 0.275 1 1 1400 . 2 1 1 A 128 128 GLY N N 1896 111.048 113.868 -2.820 1 1 1401 . 2 1 1 A 129 129 GLY H H 1897 7.580 8.188 -0.608 1 1 1402 . 2 1 1 A 129 129 GLY HA2 H 1897 4.170 4.057 0.113 1 1 1403 . 2 1 1 A 129 129 GLY HA3 H 1897 3.463 4.080 -0.617 1 1 1404 . 2 1 1 A 129 129 GLY CA C 1897 44.670 45.174 -0.504 1 1 1405 . 2 1 1 A 129 129 GLY N N 1897 106.306 109.352 -3.046 1 1 1406 . 2 1 1 A 130 130 LEU H H 1898 8.416 8.284 0.132 1 1 1407 . 2 1 1 A 130 130 LEU HA H 1898 5.077 4.246 0.831 1 1 1417 . 2 1 1 A 130 130 LEU CA C 1898 54.526 54.204 0.322 1 1 1418 . 2 1 1 A 130 130 LEU CB C 1898 44.499 42.628 1.871 1 1 1422 . 2 1 1 A 130 130 LEU N N 1898 126.737 124.965 1.772 1 1 1423 . 2 1 1 A 131 131 SER H H 1899 9.254 9.274 -0.020 1 1 1424 . 2 1 1 A 131 131 SER HA H 1899 4.803 5.462 -0.659 1 1 1427 . 2 1 1 A 131 131 SER CA C 1899 57.293 57.173 0.120 1 1 1428 . 2 1 1 A 131 131 SER CB C 1899 65.376 66.514 -1.138 1 1 1429 . 2 1 1 A 131 131 SER N N 1899 123.028 124.395 -1.367 1 1 1430 . 2 1 1 A 132 132 LEU H H 1900 8.410 8.537 -0.127 1 1 1431 . 2 1 1 A 132 132 LEU HA H 1900 5.452 4.967 0.485 1 1 1441 . 2 1 1 A 132 132 LEU CA C 1900 53.045 54.435 -1.390 1 1 1442 . 2 1 1 A 132 132 LEU CB C 1900 46.982 46.029 0.953 1 1 1446 . 2 1 1 A 132 132 LEU N N 1900 126.218 123.064 3.154 1 1 1447 . 2 1 1 A 133 133 ALA H H 1901 8.708 8.579 0.129 1 1 1448 . 2 1 1 A 133 133 ALA HA H 1901 4.591 4.922 -0.331 1 1 1452 . 2 1 1 A 133 133 ALA CA C 1901 52.140 51.399 0.741 1 1 1453 . 2 1 1 A 133 133 ALA CB C 1901 22.653 23.829 -1.176 1 1 1454 . 2 1 1 A 133 133 ALA N N 1901 124.744 125.820 -1.076 1 1 1455 . 2 1 1 A 134 134 ILE H H 1902 8.641 8.544 0.097 1 1 1456 . 2 1 1 A 134 134 ILE HA H 1902 5.256 5.008 0.248 1 1 1466 . 2 1 1 A 134 134 ILE CA C 1902 59.873 59.875 -0.002 1 1 1467 . 2 1 1 A 134 134 ILE CB C 1902 41.214 41.830 -0.616 1 1 1471 . 2 1 1 A 134 134 ILE N N 1902 121.132 120.000 1.132 1 1 1472 . 2 1 1 A 135 135 GLU H H 1903 9.294 9.032 0.262 1 1 1473 . 2 1 1 A 135 135 GLU HA H 1903 4.869 5.080 -0.211 1 1 1478 . 2 1 1 A 135 135 GLU CA C 1903 54.307 54.868 -0.561 1 1 1479 . 2 1 1 A 135 135 GLU CB C 1903 32.474 31.729 0.745 1 1 1481 . 2 1 1 A 135 135 GLU N N 1903 129.644 125.854 3.790 1 1 1482 . 2 1 1 A 136 136 GLY H H 1904 8.347 8.567 -0.220 1 1 1483 . 2 1 1 A 136 136 GLY HA2 H 1904 4.005 3.728 0.277 1 1 1484 . 2 1 1 A 136 136 GLY HA3 H 1904 3.629 3.889 -0.260 1 1 1485 . 2 1 1 A 136 136 GLY CA C 1904 45.530 43.558 1.972 1 1 1486 . 2 1 1 A 136 136 GLY N N 1904 112.326 112.305 0.021 1 1 1487 . 2 1 1 A 137 137 PRO HA H 1905 4.268 4.323 -0.055 1 1 1494 . 2 1 1 A 137 137 PRO CA C 1905 64.189 64.102 0.087 1 1 1495 . 2 1 1 A 137 137 PRO CB C 1905 32.482 31.964 0.518 1 1 1498 . 2 1 1 A 138 138 SER H H 1906 7.060 7.330 -0.270 1 1 1499 . 2 1 1 A 138 138 SER HA H 1906 4.603 4.790 -0.187 1 1 1502 . 2 1 1 A 138 138 SER CA C 1906 56.433 56.617 -0.184 1 1 1503 . 2 1 1 A 138 138 SER CB C 1906 66.672 65.944 0.728 1 1 1504 . 2 1 1 A 138 138 SER N N 1906 109.100 111.583 -2.483 1 1 1505 . 2 1 1 A 139 139 LYS H H 1907 8.479 8.302 0.177 1 1 1506 . 2 1 1 A 139 139 LYS HA H 1907 4.413 4.370 0.043 1 1 1515 . 2 1 1 A 139 139 LYS CA C 1907 56.638 56.886 -0.248 1 1 1516 . 2 1 1 A 139 139 LYS CB C 1907 31.873 32.808 -0.935 1 1 1520 . 2 1 1 A 139 139 LYS N N 1907 124.545 125.868 -1.323 1 1 1521 . 2 1 1 A 140 140 ALA H H 1908 8.358 8.593 -0.235 1 1 1522 . 2 1 1 A 140 140 ALA HA H 1908 4.706 4.694 0.012 1 1 1526 . 2 1 1 A 140 140 ALA CA C 1908 51.081 51.802 -0.721 1 1 1527 . 2 1 1 A 140 140 ALA CB C 1908 20.724 19.621 1.103 1 1 1528 . 2 1 1 A 140 140 ALA N N 1908 131.020 129.512 1.508 1 1 1529 . 2 1 1 A 141 141 GLU H H 1909 8.625 8.273 0.352 1 1 1530 . 2 1 1 A 141 141 GLU HA H 1909 4.248 4.896 -0.648 1 1 1535 . 2 1 1 A 141 141 GLU CA C 1909 56.991 56.036 0.955 1 1 1536 . 2 1 1 A 141 141 GLU CB C 1909 30.453 31.357 -0.904 1 1 1538 . 2 1 1 A 141 141 GLU N N 1909 124.862 121.317 3.545 1 1 1539 . 2 1 1 A 142 142 ILE H H 1910 8.588 8.752 -0.164 1 1 1540 . 2 1 1 A 142 142 ILE HA H 1910 4.871 5.166 -0.295 1 1 1550 . 2 1 1 A 142 142 ILE CA C 1910 60.733 59.906 0.827 1 1 1551 . 2 1 1 A 142 142 ILE CB C 1910 41.494 41.807 -0.313 1 1 1555 . 2 1 1 A 142 142 ILE N N 1910 126.220 124.454 1.766 1 1 1556 . 2 1 1 A 143 143 SER H H 1911 9.269 8.970 0.299 1 1 1557 . 2 1 1 A 143 143 SER HA H 1911 4.804 5.416 -0.612 1 1 1560 . 2 1 1 A 143 143 SER CA C 1911 56.988 57.218 -0.230 1 1 1561 . 2 1 1 A 143 143 SER CB C 1911 65.172 66.132 -0.960 1 1 1562 . 2 1 1 A 143 143 SER N N 1911 124.083 122.605 1.478 1 1 1563 . 2 1 1 A 144 144 CYS H H 1912 8.773 8.993 -0.220 1 1 1564 . 2 1 1 A 144 144 CYS HA H 1912 5.200 5.200 0.000 1 1 1567 . 2 1 1 A 144 144 CYS CA C 1912 57.256 55.939 1.317 1 1 1568 . 2 1 1 A 144 144 CYS CB C 1912 29.137 30.366 -1.229 1 1 1569 . 2 1 1 A 144 144 CYS N N 1912 125.729 118.716 7.013 1 1 1570 . 2 1 1 A 145 145 THR H H 1913 8.976 8.898 0.078 1 1 1571 . 2 1 1 A 145 145 THR HA H 1913 4.510 4.940 -0.430 1 1 1576 . 2 1 1 A 145 145 THR CA C 1913 61.388 61.513 -0.125 1 1 1577 . 2 1 1 A 145 145 THR CB C 1913 71.558 71.726 -0.168 1 1 1579 . 2 1 1 A 145 145 THR N N 1913 124.914 117.363 7.551 1 1 1580 . 2 1 1 A 146 146 ASP H H 1914 8.843 8.829 0.014 1 1 1581 . 2 1 1 A 146 146 ASP HA H 1914 4.842 4.723 0.119 1 1 1584 . 2 1 1 A 146 146 ASP CA C 1914 54.307 54.609 -0.302 1 1 1585 . 2 1 1 A 146 146 ASP CB C 1914 41.262 40.608 0.654 1 1 1586 . 2 1 1 A 146 146 ASP N N 1914 128.084 126.877 1.207 1 1 1587 . 2 1 1 A 147 147 ASN H H 1915 8.700 8.919 -0.219 1 1 1588 . 2 1 1 A 147 147 ASN HA H 1915 4.798 4.741 0.057 1 1 1593 . 2 1 1 A 147 147 ASN CA C 1915 54.283 53.019 1.264 1 1 1594 . 2 1 1 A 147 147 ASN CB C 1915 38.986 39.504 -0.518 1 1 1595 . 2 1 1 A 147 147 ASN N N 1915 125.720 122.666 3.054 1 1 1597 . 2 1 1 A 148 148 GLN HA H 1916 4.057 4.044 0.013 1 1 1602 . 2 1 1 A 148 148 GLN CA C 1916 57.839 57.566 0.273 1 1 1603 . 2 1 1 A 148 148 GLN CB C 1916 26.281 26.844 -0.563 1 1 1605 . 2 1 1 A 149 149 ASP H H 1917 7.892 8.081 -0.189 1 1 1606 . 2 1 1 A 149 149 ASP HA H 1917 4.755 4.729 0.026 1 1 1609 . 2 1 1 A 149 149 ASP CA C 1917 52.659 54.116 -1.457 1 1 1610 . 2 1 1 A 149 149 ASP CB C 1917 41.111 41.274 -0.163 1 1 1611 . 2 1 1 A 149 149 ASP N N 1917 118.769 118.834 -0.065 1 1 1612 . 2 1 1 A 150 150 GLY H H 1918 8.673 8.280 0.393 1 1 1613 . 2 1 1 A 150 150 GLY HA2 H 1918 4.358 4.079 0.279 1 1 1614 . 2 1 1 A 150 150 GLY HA3 H 1918 3.700 4.085 -0.385 1 1 1615 . 2 1 1 A 150 150 GLY CA C 1918 45.319 45.104 0.215 1 1 1616 . 2 1 1 A 150 150 GLY N N 1918 110.464 107.675 2.789 1 1 1617 . 2 1 1 A 151 151 THR H H 1919 8.154 7.587 0.567 1 1 1618 . 2 1 1 A 151 151 THR HA H 1919 4.109 5.175 -1.066 1 1 1623 . 2 1 1 A 151 151 THR CA C 1919 60.041 59.830 0.211 1 1 1624 . 2 1 1 A 151 151 THR CB C 1919 73.422 72.711 0.711 1 1 1626 . 2 1 1 A 151 151 THR N N 1919 111.043 109.803 1.240 1 1 1627 . 2 1 1 A 152 152 CYS H H 1920 9.088 9.382 -0.294 1 1 1628 . 2 1 1 A 152 152 CYS HA H 1920 5.362 5.407 -0.045 1 1 1631 . 2 1 1 A 152 152 CYS CA C 1920 56.990 57.326 -0.336 1 1 1632 . 2 1 1 A 152 152 CYS CB C 1920 30.740 31.109 -0.369 1 1 1633 . 2 1 1 A 152 152 CYS N N 1920 118.508 121.295 -2.787 1 1 1634 . 2 1 1 A 153 153 SER H H 1921 9.102 8.906 0.196 1 1 1635 . 2 1 1 A 153 153 SER HA H 1921 4.865 4.920 -0.055 1 1 1638 . 2 1 1 A 153 153 SER CA C 1921 58.023 57.128 0.895 1 1 1639 . 2 1 1 A 153 153 SER CB C 1921 64.133 64.504 -0.371 1 1 1640 . 2 1 1 A 153 153 SER N N 1921 122.048 119.618 2.430 1 1 1641 . 2 1 1 A 154 154 VAL H H 1922 8.983 8.592 0.391 1 1 1642 . 2 1 1 A 154 154 VAL HA H 1922 4.608 4.760 -0.152 1 1 1650 . 2 1 1 A 154 154 VAL CA C 1922 60.575 59.703 0.872 1 1 1651 . 2 1 1 A 154 154 VAL CB C 1922 32.710 34.901 -2.191 1 1 1654 . 2 1 1 A 154 154 VAL N N 1922 130.262 124.236 6.026 1 1 1655 . 2 1 1 A 155 155 SER H H 1923 8.737 8.725 0.012 1 1 1656 . 2 1 1 A 155 155 SER HA H 1923 5.680 5.443 0.237 1 1 1659 . 2 1 1 A 155 155 SER CA C 1923 55.991 56.419 -0.428 1 1 1660 . 2 1 1 A 155 155 SER CB C 1923 66.306 65.341 0.965 1 1 1661 . 2 1 1 A 155 155 SER N N 1923 121.504 121.326 0.178 1 1 1662 . 2 1 1 A 156 156 TYR H H 1924 9.061 8.960 0.101 1 1 1663 . 2 1 1 A 156 156 TYR HA H 1924 5.790 5.659 0.131 1 1 1671 . 2 1 1 A 156 156 TYR CA C 1924 55.118 55.731 -0.613 1 1 1672 . 2 1 1 A 156 156 TYR CB C 1924 42.344 42.134 0.210 1 1 1675 . 2 1 1 A 156 156 TYR N N 1924 121.858 121.557 0.301 1 1 1676 . 2 1 1 A 157 157 LEU H H 1925 7.505 9.285 -1.780 1 1 1677 . 2 1 1 A 157 157 LEU HA H 1925 4.996 4.776 0.220 1 1 1687 . 2 1 1 A 157 157 LEU CA C 1925 50.476 51.259 -0.783 1 1 1688 . 2 1 1 A 157 157 LEU CB C 1925 43.334 43.400 -0.066 1 1 1692 . 2 1 1 A 157 157 LEU N N 1925 123.272 121.518 1.754 1 1 1693 . 2 1 1 A 158 158 PRO HA H 1926 4.691 4.926 -0.235 1 1 1700 . 2 1 1 A 158 158 PRO CA C 1926 61.808 62.399 -0.591 1 1 1701 . 2 1 1 A 158 158 PRO CB C 1926 32.551 32.899 -0.348 1 1 1704 . 2 1 1 A 159 159 VAL H H 1927 8.388 8.225 0.163 1 1 1705 . 2 1 1 A 159 159 VAL HA H 1927 4.510 4.490 0.020 1 1 1713 . 2 1 1 A 159 159 VAL CA C 1927 61.778 61.439 0.339 1 1 1714 . 2 1 1 A 159 159 VAL CB C 1927 32.432 33.826 -1.394 1 1 1717 . 2 1 1 A 159 159 VAL N N 1927 115.680 117.114 -1.434 1 1 1718 . 2 1 1 A 160 160 LEU H H 1928 6.931 7.320 -0.389 1 1 1719 . 2 1 1 A 160 160 LEU HA H 1928 4.931 5.065 -0.134 1 1 1729 . 2 1 1 A 160 160 LEU CA C 1928 51.971 51.379 0.592 1 1 1730 . 2 1 1 A 160 160 LEU CB C 1928 45.905 44.407 1.498 1 1 1734 . 2 1 1 A 160 160 LEU N N 1928 120.258 118.096 2.162 1 1 1735 . 2 1 1 A 161 161 PRO HA H 1929 4.317 4.889 -0.572 1 1 1742 . 2 1 1 A 161 161 PRO CA C 1929 62.809 63.136 -0.327 1 1 1743 . 2 1 1 A 161 161 PRO CB C 1929 32.662 32.252 0.410 1 1 1746 . 2 1 1 A 162 162 GLY H H 1930 8.916 7.941 0.975 1 1 1747 . 2 1 1 A 162 162 GLY HA2 H 1930 4.461 4.225 0.236 1 1 1748 . 2 1 1 A 162 162 GLY HA3 H 1930 3.852 4.235 -0.383 1 1 1749 . 2 1 1 A 162 162 GLY CA C 1930 44.496 45.315 -0.819 1 1 1750 . 2 1 1 A 162 162 GLY N N 1930 107.609 108.081 -0.472 1 1 1751 . 2 1 1 A 163 163 ASP H H 1931 8.245 8.589 -0.344 1 1 1752 . 2 1 1 A 163 163 ASP HA H 1931 5.565 5.600 -0.035 1 1 1755 . 2 1 1 A 163 163 ASP CA C 1931 53.628 53.287 0.341 1 1 1756 . 2 1 1 A 163 163 ASP CB C 1931 41.058 42.542 -1.484 1 1 1757 . 2 1 1 A 163 163 ASP N N 1931 121.979 118.376 3.603 1 1 1758 . 2 1 1 A 164 164 TYR H H 1932 9.606 9.468 0.138 1 1 1759 . 2 1 1 A 164 164 TYR HA H 1932 4.896 5.110 -0.214 1 1 1767 . 2 1 1 A 164 164 TYR CA C 1932 56.955 56.604 0.351 1 1 1768 . 2 1 1 A 164 164 TYR CB C 1932 40.339 41.386 -1.047 1 1 1771 . 2 1 1 A 164 164 TYR N N 1932 125.257 122.061 3.196 1 1 1772 . 2 1 1 A 165 165 SER H H 1933 9.095 9.308 -0.213 1 1 1773 . 2 1 1 A 165 165 SER HA H 1933 5.500 5.188 0.312 1 1 1776 . 2 1 1 A 165 165 SER CA C 1933 56.509 58.217 -1.708 1 1 1777 . 2 1 1 A 165 165 SER CB C 1933 64.486 63.924 0.562 1 1 1778 . 2 1 1 A 165 165 SER N N 1933 119.162 120.202 -1.040 1 1 1779 . 2 1 1 A 166 166 ILE H H 1934 9.598 9.386 0.212 1 1 1780 . 2 1 1 A 166 166 ILE HA H 1934 4.541 4.816 -0.275 1 1 1790 . 2 1 1 A 166 166 ILE CA C 1934 61.080 60.107 0.973 1 1 1791 . 2 1 1 A 166 166 ILE CB C 1934 39.282 38.997 0.285 1 1 1795 . 2 1 1 A 166 166 ILE N N 1934 128.701 128.365 0.336 1 1 1796 . 2 1 1 A 167 167 LEU H H 1935 9.359 9.364 -0.005 1 1 1797 . 2 1 1 A 167 167 LEU HA H 1935 4.779 5.210 -0.431 1 1 1807 . 2 1 1 A 167 167 LEU CA C 1935 55.921 53.374 2.547 1 1 1808 . 2 1 1 A 167 167 LEU CB C 1935 42.473 44.851 -2.378 1 1 1811 . 2 1 1 A 167 167 LEU N N 1935 131.315 130.444 0.871 1 1 1812 . 2 1 1 A 168 168 VAL H H 1936 9.425 9.015 0.410 1 1 1813 . 2 1 1 A 168 168 VAL HA H 1936 4.617 4.800 -0.183 1 1 1821 . 2 1 1 A 168 168 VAL CA C 1936 61.418 60.937 0.481 1 1 1822 . 2 1 1 A 168 168 VAL CB C 1936 33.616 34.831 -1.215 1 1 1824 . 2 1 1 A 168 168 VAL N N 1936 126.961 126.162 0.799 1 1 1825 . 2 1 1 A 169 169 LYS H H 1937 8.643 8.318 0.325 1 1 1826 . 2 1 1 A 169 169 LYS HA H 1937 5.067 4.891 0.176 1 1 1835 . 2 1 1 A 169 169 LYS CA C 1937 53.949 55.487 -1.538 1 1 1836 . 2 1 1 A 169 169 LYS CB C 1937 36.691 36.105 0.586 1 1 1840 . 2 1 1 A 169 169 LYS N N 1937 124.773 127.344 -2.571 1 1 1841 . 2 1 1 A 170 170 TYR H H 1938 8.877 9.261 -0.384 1 1 1842 . 2 1 1 A 170 170 TYR HA H 1938 5.137 5.002 0.135 1 1 1849 . 2 1 1 A 170 170 TYR CA C 1938 57.034 57.521 -0.487 1 1 1850 . 2 1 1 A 170 170 TYR CB C 1938 42.105 41.867 0.238 1 1 1853 . 2 1 1 A 170 170 TYR N N 1938 122.371 126.882 -4.511 1 1 1854 . 2 1 1 A 171 171 ASN H H 1939 8.933 9.793 -0.860 1 1 1855 . 2 1 1 A 171 171 ASN HA H 1939 4.405 4.523 -0.118 1 1 1860 . 2 1 1 A 171 171 ASN CA C 1939 54.512 54.280 0.232 1 1 1861 . 2 1 1 A 171 171 ASN CB C 1939 37.025 37.309 -0.284 1 1 1862 . 2 1 1 A 171 171 ASN N N 1939 129.922 126.517 3.405 1 1 1864 . 2 1 1 A 172 172 GLU H H 1940 8.857 8.791 0.066 1 1 1865 . 2 1 1 A 172 172 GLU HA H 1940 3.511 4.082 -0.571 1 1 1870 . 2 1 1 A 172 172 GLU CA C 1940 57.910 57.706 0.204 1 1 1871 . 2 1 1 A 172 172 GLU CB C 1940 27.139 27.528 -0.389 1 1 1873 . 2 1 1 A 172 172 GLU N N 1940 107.943 116.241 -8.298 1 1 1874 . 2 1 1 A 173 173 GLN H H 1941 7.544 7.591 -0.047 1 1 1875 . 2 1 1 A 173 173 GLN HA H 1941 4.749 4.754 -0.005 1 1 1882 . 2 1 1 A 173 173 GLN CA C 1941 53.770 54.789 -1.019 1 1 1883 . 2 1 1 A 173 173 GLN CB C 1941 31.078 30.749 0.329 1 1 1885 . 2 1 1 A 173 173 GLN N N 1941 119.865 120.393 -0.528 1 1 1887 . 2 1 1 A 174 174 HIS H H 1942 8.848 8.763 0.085 1 1 1888 . 2 1 1 A 174 174 HIS HA H 1942 4.513 4.693 -0.180 1 1 1893 . 2 1 1 A 174 174 HIS CA C 1942 58.893 57.078 1.815 1 1 1894 . 2 1 1 A 174 174 HIS CB C 1942 32.196 30.352 1.844 1 1 1897 . 2 1 1 A 174 174 HIS N N 1942 126.437 122.107 4.330 1 1 1898 . 2 1 1 A 175 175 VAL H H 1943 8.483 8.398 0.085 1 1 1899 . 2 1 1 A 175 175 VAL HA H 1943 4.643 4.278 0.365 1 1 1907 . 2 1 1 A 175 175 VAL CA C 1943 60.025 60.931 -0.906 1 1 1908 . 2 1 1 A 175 175 VAL CB C 1943 29.439 32.020 -2.581 1 1 1911 . 2 1 1 A 175 175 VAL N N 1943 121.671 121.105 0.566 1 1 1912 . 2 1 1 A 176 176 PRO HA H 1944 4.045 3.992 0.053 1 1 1919 . 2 1 1 A 176 176 PRO CA C 1944 64.943 64.014 0.929 1 1 1920 . 2 1 1 A 176 176 PRO CB C 1944 31.120 31.114 0.006 1 1 1923 . 2 1 1 A 177 177 GLY H H 1945 7.579 8.292 -0.713 1 1 1924 . 2 1 1 A 177 177 GLY HA2 H 1945 3.210 3.346 -0.136 1 1 1925 . 2 1 1 A 177 177 GLY HA3 H 1945 2.311 3.620 -1.309 1 1 1926 . 2 1 1 A 177 177 GLY CA C 1945 44.184 44.591 -0.407 1 1 1927 . 2 1 1 A 177 177 GLY N N 1945 113.696 112.440 1.256 1 1 1928 . 2 1 1 A 178 178 SER H H 1946 7.469 7.422 0.047 1 1 1929 . 2 1 1 A 178 178 SER HA H 1946 4.023 3.656 0.367 1 1 1932 . 2 1 1 A 178 178 SER CA C 1946 54.593 55.005 -0.412 1 1 1933 . 2 1 1 A 178 178 SER CB C 1946 62.282 63.602 -1.320 1 1 1934 . 2 1 1 A 178 178 SER N N 1946 113.219 116.497 -3.278 1 1 1935 . 2 1 1 A 179 179 PRO HA H 1947 5.314 4.782 0.532 1 1 1942 . 2 1 1 A 179 179 PRO CA C 1947 62.198 62.392 -0.194 1 1 1943 . 2 1 1 A 179 179 PRO CB C 1947 33.923 32.837 1.086 1 1 1946 . 2 1 1 A 180 180 PHE H H 1948 9.395 8.519 0.876 1 1 1947 . 2 1 1 A 180 180 PHE HA H 1948 4.706 4.898 -0.192 1 1 1955 . 2 1 1 A 180 180 PHE CA C 1948 57.298 57.607 -0.309 1 1 1956 . 2 1 1 A 180 180 PHE CB C 1948 41.116 40.202 0.914 1 1 1960 . 2 1 1 A 180 180 PHE N N 1948 127.510 120.910 6.600 1 1 1961 . 2 1 1 A 181 181 THR H H 1949 9.111 8.852 0.259 1 1 1962 . 2 1 1 A 181 181 THR HA H 1949 5.091 5.136 -0.045 1 1 1967 . 2 1 1 A 181 181 THR CA C 1949 62.668 61.208 1.460 1 1 1968 . 2 1 1 A 181 181 THR CB C 1949 70.354 71.283 -0.929 1 1 1970 . 2 1 1 A 181 181 THR N N 1949 120.325 115.012 5.313 1 1 1971 . 2 1 1 A 182 182 ALA H H 1950 8.992 9.388 -0.396 1 1 1972 . 2 1 1 A 182 182 ALA HA H 1950 4.521 4.962 -0.441 1 1 1976 . 2 1 1 A 182 182 ALA CA C 1950 50.080 51.203 -1.123 1 1 1977 . 2 1 1 A 182 182 ALA CB C 1950 21.717 20.617 1.100 1 1 1978 . 2 1 1 A 182 182 ALA N N 1950 130.794 130.543 0.251 1 1 1979 . 2 1 1 A 183 183 ARG H H 1951 7.764 8.345 -0.581 1 1 1980 . 2 1 1 A 183 183 ARG HA H 1951 5.001 5.308 -0.307 1 1 1988 . 2 1 1 A 183 183 ARG CA C 1951 55.116 54.690 0.426 1 1 1989 . 2 1 1 A 183 183 ARG CB C 1951 30.631 33.741 -3.110 1 1 1992 . 2 1 1 A 183 183 ARG N N 1951 121.920 121.779 0.141 1 1 1994 . 2 1 1 A 184 184 VAL H H 1952 9.121 9.535 -0.414 1 1 1995 . 2 1 1 A 184 184 VAL HA H 1952 4.865 4.775 0.090 1 1 2003 . 2 1 1 A 184 184 VAL CA C 1952 60.375 61.177 -0.802 1 1 2004 . 2 1 1 A 184 184 VAL CB C 1952 32.179 33.907 -1.728 1 1 2007 . 2 1 1 A 184 184 VAL N N 1952 125.421 127.512 -2.091 1 1 2008 . 2 1 1 A 185 185 THR H H 1953 8.799 8.806 -0.007 1 1 2009 . 2 1 1 A 185 185 THR HA H 1953 4.829 5.237 -0.408 1 1 2014 . 2 1 1 A 185 185 THR CA C 1953 60.316 59.929 0.387 1 1 2015 . 2 1 1 A 185 185 THR CB C 1953 70.825 71.506 -0.681 1 1 2017 . 2 1 1 A 185 185 THR N N 1953 121.794 118.077 3.717 1 1 2018 . 2 1 1 A 186 186 GLY H H 1954 8.586 8.750 -0.164 1 1 2019 . 2 1 1 A 186 186 GLY HA2 H 1954 4.261 4.115 0.146 1 1 2020 . 2 1 1 A 186 186 GLY HA3 H 1954 4.033 4.123 -0.090 1 1 2021 . 2 1 1 A 186 186 GLY CA C 1954 45.038 45.300 -0.262 1 1 2022 . 2 1 1 A 186 186 GLY N N 1954 107.588 108.639 -1.051 1 1 2023 . 2 1 1 A 187 187 ASP H H 1955 8.386 9.189 -0.803 1 1 2024 . 2 1 1 A 187 187 ASP HA H 1955 4.772 4.725 0.047 1 1 2027 . 2 1 1 A 187 187 ASP CA C 1955 53.909 55.901 -1.992 1 1 2028 . 2 1 1 A 187 187 ASP CB C 1955 41.510 41.619 -0.109 1 1 2029 . 2 1 1 A 187 187 ASP N N 1955 121.829 125.551 -3.722 1 1 4 . 3 1 1 A 2 2 ALA HA H -2 4.368 3.948 0.420 1 1 8 . 3 1 1 A 2 2 ALA CA C -2 52.604 54.334 -1.730 1 1 9 . 3 1 1 A 2 2 ALA CB C -2 19.551 17.113 2.438 1 1 32 . 3 1 1 A 5 5 PRO HA H 1773 4.433 4.612 -0.179 1 1 39 . 3 1 1 A 5 5 PRO CA C 1773 63.017 62.333 0.684 1 1 40 . 3 1 1 A 5 5 PRO CB C 1773 32.155 33.234 -1.079 1 1 43 . 3 1 1 A 6 6 GLU H H 1774 8.495 8.682 -0.187 1 1 44 . 3 1 1 A 6 6 GLU HA H 1774 4.242 4.941 -0.699 1 1 49 . 3 1 1 A 6 6 GLU CA C 1774 56.735 54.539 2.196 1 1 50 . 3 1 1 A 6 6 GLU CB C 1774 30.401 33.414 -3.013 1 1 52 . 3 1 1 A 6 6 GLU N N 1774 122.494 117.093 5.401 1 1 53 . 3 1 1 A 7 7 ARG H H 1775 8.275 8.489 -0.214 1 1 54 . 3 1 1 A 7 7 ARG HA H 1775 4.648 4.362 0.286 1 1 61 . 3 1 1 A 7 7 ARG CA C 1775 53.827 54.224 -0.397 1 1 62 . 3 1 1 A 7 7 ARG CB C 1775 30.417 30.806 -0.389 1 1 65 . 3 1 1 A 7 7 ARG N N 1775 124.017 123.367 0.650 1 1 66 . 3 1 1 A 8 8 PRO HA H 1776 4.433 4.722 -0.289 1 1 73 . 3 1 1 A 8 8 PRO CA C 1776 63.036 62.398 0.638 1 1 74 . 3 1 1 A 8 8 PRO CB C 1776 32.201 33.212 -1.011 1 1 77 . 3 1 1 A 9 9 LEU H H 1777 8.349 8.575 -0.226 1 1 78 . 3 1 1 A 9 9 LEU HA H 1777 4.365 4.030 0.335 1 1 88 . 3 1 1 A 9 9 LEU CA C 1777 55.275 55.994 -0.719 1 1 89 . 3 1 1 A 9 9 LEU CB C 1777 42.376 41.488 0.888 1 1 93 . 3 1 1 A 9 9 LEU N N 1777 123.820 121.451 2.369 1 1 94 . 3 1 1 A 10 10 VAL H H 1778 7.989 7.909 0.080 1 1 95 . 3 1 1 A 10 10 VAL HA H 1778 4.182 3.975 0.207 1 1 103 . 3 1 1 A 10 10 VAL CA C 1778 62.141 64.654 -2.513 1 1 104 . 3 1 1 A 10 10 VAL CB C 1778 33.175 31.314 1.861 1 1 106 . 3 1 1 A 10 10 VAL N N 1778 121.714 119.601 2.113 1 1 107 . 3 1 1 A 11 11 GLY H H 1779 8.450 8.165 0.285 1 1 108 . 3 1 1 A 11 11 GLY HA2 H 1779 4.002 3.979 0.023 1 1 109 . 3 1 1 A 11 11 GLY HA3 H 1779 4.002 3.980 0.022 1 1 110 . 3 1 1 A 11 11 GLY CA C 1779 45.297 45.539 -0.242 1 1 111 . 3 1 1 A 11 11 GLY N N 1779 113.826 110.408 3.418 1 1 112 . 3 1 1 A 12 12 VAL H H 1780 8.013 7.475 0.538 1 1 113 . 3 1 1 A 12 12 VAL HA H 1780 4.136 4.171 -0.035 1 1 121 . 3 1 1 A 12 12 VAL CA C 1780 62.466 61.855 0.611 1 1 122 . 3 1 1 A 12 12 VAL CB C 1780 32.752 32.595 0.157 1 1 125 . 3 1 1 A 12 12 VAL N N 1780 120.109 118.978 1.131 1 1 126 . 3 1 1 A 13 13 ASN H H 1781 8.528 8.738 -0.210 1 1 127 . 3 1 1 A 13 13 ASN HA H 1781 4.712 4.584 0.128 1 1 132 . 3 1 1 A 13 13 ASN CA C 1781 53.485 54.746 -1.261 1 1 133 . 3 1 1 A 13 13 ASN CB C 1781 38.996 38.895 0.101 1 1 134 . 3 1 1 A 13 13 ASN N N 1781 122.648 122.428 0.220 1 1 136 . 3 1 1 A 14 14 GLY H H 1782 8.283 8.620 -0.337 1 1 137 . 3 1 1 A 14 14 GLY HA2 H 1782 3.929 4.097 -0.168 1 1 138 . 3 1 1 A 14 14 GLY HA3 H 1782 3.929 4.099 -0.170 1 1 139 . 3 1 1 A 14 14 GLY CA C 1782 45.531 43.902 1.629 1 1 140 . 3 1 1 A 14 14 GLY N N 1782 110.229 111.458 -1.229 1 1 141 . 3 1 1 A 15 15 LEU H H 1783 7.925 8.451 -0.526 1 1 142 . 3 1 1 A 15 15 LEU HA H 1783 4.340 4.625 -0.285 1 1 152 . 3 1 1 A 15 15 LEU CA C 1783 55.045 55.347 -0.302 1 1 153 . 3 1 1 A 15 15 LEU CB C 1783 42.682 42.294 0.388 1 1 157 . 3 1 1 A 15 15 LEU N N 1783 122.626 122.390 0.236 1 1 158 . 3 1 1 A 16 16 ASP H H 1784 8.360 8.517 -0.157 1 1 159 . 3 1 1 A 16 16 ASP HA H 1784 4.747 5.021 -0.274 1 1 162 . 3 1 1 A 16 16 ASP CA C 1784 53.939 52.977 0.962 1 1 163 . 3 1 1 A 16 16 ASP CB C 1784 41.150 44.247 -3.097 1 1 164 . 3 1 1 A 16 16 ASP N N 1784 122.868 121.527 1.341 1 1 165 . 3 1 1 A 17 17 VAL H H 1785 8.201 8.772 -0.571 1 1 166 . 3 1 1 A 17 17 VAL HA H 1785 4.237 3.894 0.343 1 1 174 . 3 1 1 A 17 17 VAL CA C 1785 62.881 65.383 -2.502 1 1 175 . 3 1 1 A 17 17 VAL CB C 1785 31.967 31.511 0.456 1 1 178 . 3 1 1 A 17 17 VAL N N 1785 121.110 121.288 -0.178 1 1 179 . 3 1 1 A 18 18 THR H H 1786 8.291 7.765 0.526 1 1 180 . 3 1 1 A 18 18 THR HA H 1786 4.466 3.986 0.480 1 1 185 . 3 1 1 A 18 18 THR CA C 1786 62.388 64.775 -2.387 1 1 186 . 3 1 1 A 18 18 THR CB C 1786 69.719 68.978 0.741 1 1 188 . 3 1 1 A 18 18 THR N N 1786 115.267 117.216 -1.949 1 1 189 . 3 1 1 A 19 19 SER H H 1787 8.148 7.970 0.178 1 1 190 . 3 1 1 A 19 19 SER HA H 1787 4.542 4.539 0.003 1 1 193 . 3 1 1 A 19 19 SER CA C 1787 59.096 58.757 0.339 1 1 194 . 3 1 1 A 19 19 SER CB C 1787 63.993 64.262 -0.269 1 1 195 . 3 1 1 A 19 19 SER N N 1787 118.576 114.519 4.057 1 1 196 . 3 1 1 A 20 20 LEU H H 1788 8.263 7.273 0.990 1 1 197 . 3 1 1 A 20 20 LEU HA H 1788 4.243 4.346 -0.103 1 1 207 . 3 1 1 A 20 20 LEU CA C 1788 54.087 54.179 -0.092 1 1 208 . 3 1 1 A 20 20 LEU CB C 1788 43.006 42.609 0.397 1 1 212 . 3 1 1 A 20 20 LEU N N 1788 125.834 123.443 2.391 1 1 213 . 3 1 1 A 21 21 ARG H H 1789 8.191 8.189 0.002 1 1 214 . 3 1 1 A 21 21 ARG HA H 1789 4.080 4.181 -0.101 1 1 222 . 3 1 1 A 21 21 ARG CA C 1789 54.894 54.228 0.666 1 1 223 . 3 1 1 A 21 21 ARG CB C 1789 30.881 31.047 -0.166 1 1 226 . 3 1 1 A 21 21 ARG N N 1789 127.213 123.073 4.140 1 1 228 . 3 1 1 A 22 22 PRO HA H 1790 4.441 4.695 -0.254 1 1 233 . 3 1 1 A 22 22 PRO CA C 1790 62.882 62.499 0.383 1 1 234 . 3 1 1 A 22 22 PRO CB C 1790 32.204 33.071 -0.867 1 1 237 . 3 1 1 A 23 23 PHE H H 1791 8.336 8.693 -0.357 1 1 238 . 3 1 1 A 23 23 PHE HA H 1791 4.701 5.162 -0.461 1 1 246 . 3 1 1 A 23 23 PHE CA C 1791 57.504 56.613 0.891 1 1 247 . 3 1 1 A 23 23 PHE CB C 1791 42.192 42.315 -0.123 1 1 251 . 3 1 1 A 23 23 PHE N N 1791 122.145 124.223 -2.078 1 1 252 . 3 1 1 A 24 24 ASP H H 1792 6.954 8.634 -1.680 1 1 253 . 3 1 1 A 24 24 ASP HA H 1792 5.039 5.135 -0.096 1 1 256 . 3 1 1 A 24 24 ASP CA C 1792 52.871 52.306 0.565 1 1 257 . 3 1 1 A 24 24 ASP CB C 1792 44.696 44.613 0.083 1 1 258 . 3 1 1 A 24 24 ASP N N 1792 127.481 125.330 2.151 1 1 259 . 3 1 1 A 25 25 LEU H H 1793 8.372 8.702 -0.330 1 1 260 . 3 1 1 A 25 25 LEU HA H 1793 4.336 4.938 -0.602 1 1 270 . 3 1 1 A 25 25 LEU CA C 1793 54.860 53.184 1.676 1 1 271 . 3 1 1 A 25 25 LEU CB C 1793 47.575 46.104 1.471 1 1 274 . 3 1 1 A 25 25 LEU N N 1793 123.241 121.879 1.362 1 1 275 . 3 1 1 A 26 26 VAL H H 1794 8.489 9.031 -0.542 1 1 276 . 3 1 1 A 26 26 VAL HA H 1794 4.903 5.170 -0.267 1 1 284 . 3 1 1 A 26 26 VAL CA C 1794 61.669 59.594 2.075 1 1 285 . 3 1 1 A 26 26 VAL CB C 1794 32.458 34.630 -2.172 1 1 288 . 3 1 1 A 26 26 VAL N N 1794 128.849 122.023 6.826 1 1 289 . 3 1 1 A 27 27 ILE H H 1795 9.101 9.227 -0.126 1 1 290 . 3 1 1 A 27 27 ILE HA H 1795 4.701 4.400 0.301 1 1 300 . 3 1 1 A 27 27 ILE CA C 1795 57.433 57.478 -0.045 1 1 301 . 3 1 1 A 27 27 ILE CB C 1795 41.865 41.670 0.195 1 1 305 . 3 1 1 A 27 27 ILE N N 1795 127.511 128.199 -0.688 1 1 306 . 3 1 1 A 28 28 PRO HA H 1796 4.838 4.596 0.242 1 1 313 . 3 1 1 A 28 28 PRO CA C 1796 62.406 63.386 -0.980 1 1 314 . 3 1 1 A 28 28 PRO CB C 1796 30.684 30.811 -0.127 1 1 317 . 3 1 1 A 29 29 PHE H H 1797 8.255 7.961 0.294 1 1 318 . 3 1 1 A 29 29 PHE HA H 1797 4.151 4.700 -0.549 1 1 326 . 3 1 1 A 29 29 PHE CA C 1797 60.405 58.658 1.747 1 1 327 . 3 1 1 A 29 29 PHE CB C 1797 41.395 40.365 1.030 1 1 331 . 3 1 1 A 29 29 PHE N N 1797 128.572 121.840 6.732 1 1 332 . 3 1 1 A 30 30 THR H H 1798 7.433 7.627 -0.194 1 1 333 . 3 1 1 A 30 30 THR HA H 1798 4.108 4.606 -0.498 1 1 338 . 3 1 1 A 30 30 THR CA C 1798 61.473 60.984 0.489 1 1 339 . 3 1 1 A 30 30 THR CB C 1798 69.324 70.724 -1.400 1 1 341 . 3 1 1 A 30 30 THR N N 1798 123.124 119.509 3.615 1 1 342 . 3 1 1 A 31 31 ILE H H 1799 8.402 8.607 -0.205 1 1 343 . 3 1 1 A 31 31 ILE HA H 1799 3.653 4.181 -0.528 1 1 353 . 3 1 1 A 31 31 ILE CA C 1799 61.802 61.012 0.790 1 1 354 . 3 1 1 A 31 31 ILE CB C 1799 38.548 37.736 0.812 1 1 358 . 3 1 1 A 31 31 ILE N N 1799 128.616 127.424 1.192 1 1 359 . 3 1 1 A 32 32 LYS H H 1800 7.742 8.708 -0.966 1 1 360 . 3 1 1 A 32 32 LYS HA H 1800 4.558 4.773 -0.215 1 1 365 . 3 1 1 A 32 32 LYS CA C 1800 56.566 53.923 2.643 1 1 366 . 3 1 1 A 32 32 LYS CB C 1800 31.982 33.209 -1.227 1 1 368 . 3 1 1 A 32 32 LYS N N 1800 128.656 123.819 4.837 1 1 369 . 3 1 1 A 33 33 LYS HA H 1801 4.531 4.769 -0.238 1 1 378 . 3 1 1 A 33 33 LYS CA C 1801 56.310 56.754 -0.444 1 1 379 . 3 1 1 A 33 33 LYS CB C 1801 33.027 33.422 -0.395 1 1 383 . 3 1 1 A 34 34 GLY H H 1802 8.088 8.574 -0.486 1 1 384 . 3 1 1 A 34 34 GLY HA2 H 1802 4.159 4.142 0.017 1 1 385 . 3 1 1 A 34 34 GLY HA3 H 1802 3.712 4.253 -0.541 1 1 386 . 3 1 1 A 34 34 GLY CA C 1802 45.302 44.491 0.811 1 1 387 . 3 1 1 A 34 34 GLY N N 1802 110.338 112.813 -2.475 1 1 388 . 3 1 1 A 35 35 GLU H H 1803 8.219 8.068 0.151 1 1 389 . 3 1 1 A 35 35 GLU HA H 1803 4.692 4.921 -0.229 1 1 394 . 3 1 1 A 35 35 GLU CA C 1803 55.160 55.047 0.113 1 1 395 . 3 1 1 A 35 35 GLU CB C 1803 32.407 34.160 -1.753 1 1 397 . 3 1 1 A 35 35 GLU N N 1803 119.576 120.655 -1.079 1 1 398 . 3 1 1 A 36 36 ILE H H 1804 8.869 8.791 0.078 1 1 399 . 3 1 1 A 36 36 ILE HA H 1804 5.468 5.099 0.369 1 1 409 . 3 1 1 A 36 36 ILE CA C 1804 58.861 58.698 0.163 1 1 410 . 3 1 1 A 36 36 ILE CB C 1804 41.007 41.362 -0.355 1 1 414 . 3 1 1 A 36 36 ILE N N 1804 128.141 124.877 3.264 1 1 415 . 3 1 1 A 37 37 THR H H 1805 9.075 8.794 0.281 1 1 416 . 3 1 1 A 37 37 THR HA H 1805 4.703 5.124 -0.421 1 1 421 . 3 1 1 A 37 37 THR CA C 1805 59.932 59.793 0.139 1 1 422 . 3 1 1 A 37 37 THR CB C 1805 72.441 72.345 0.096 1 1 424 . 3 1 1 A 37 37 THR N N 1805 119.846 117.163 2.683 1 1 425 . 3 1 1 A 38 38 GLY H H 1806 8.468 8.307 0.161 1 1 426 . 3 1 1 A 38 38 GLY HA2 H 1806 5.076 4.283 0.793 1 1 427 . 3 1 1 A 38 38 GLY HA3 H 1806 3.503 4.309 -0.806 1 1 428 . 3 1 1 A 38 38 GLY CA C 1806 45.593 45.002 0.591 1 1 429 . 3 1 1 A 38 38 GLY N N 1806 107.815 108.382 -0.567 1 1 430 . 3 1 1 A 39 39 GLU H H 1807 8.519 8.654 -0.135 1 1 431 . 3 1 1 A 39 39 GLU HA H 1807 4.713 5.131 -0.418 1 1 436 . 3 1 1 A 39 39 GLU CA C 1807 56.936 55.525 1.411 1 1 437 . 3 1 1 A 39 39 GLU CB C 1807 34.937 33.803 1.134 1 1 439 . 3 1 1 A 39 39 GLU N N 1807 120.173 119.694 0.479 1 1 440 . 3 1 1 A 40 40 VAL H H 1808 9.156 9.378 -0.222 1 1 441 . 3 1 1 A 40 40 VAL HA H 1808 4.778 4.749 0.029 1 1 449 . 3 1 1 A 40 40 VAL CA C 1808 60.574 60.995 -0.421 1 1 450 . 3 1 1 A 40 40 VAL CB C 1808 34.168 33.711 0.457 1 1 452 . 3 1 1 A 40 40 VAL N N 1808 126.330 127.062 -0.732 1 1 453 . 3 1 1 A 41 41 ARG H H 1809 9.044 9.160 -0.116 1 1 454 . 3 1 1 A 41 41 ARG HA H 1809 4.778 4.929 -0.151 1 1 462 . 3 1 1 A 41 41 ARG CA C 1809 55.317 54.107 1.210 1 1 463 . 3 1 1 A 41 41 ARG CB C 1809 31.940 32.502 -0.562 1 1 466 . 3 1 1 A 41 41 ARG N N 1809 127.098 126.257 0.841 1 1 468 . 3 1 1 A 42 42 MET H H 1810 8.264 8.880 -0.616 1 1 469 . 3 1 1 A 42 42 MET HA H 1810 4.050 4.539 -0.489 1 1 477 . 3 1 1 A 42 42 MET CA C 1810 53.716 54.305 -0.589 1 1 478 . 3 1 1 A 42 42 MET CB C 1810 32.779 32.806 -0.027 1 1 481 . 3 1 1 A 42 42 MET N N 1810 123.461 123.298 0.163 1 1 482 . 3 1 1 A 43 43 PRO HA H 1811 4.179 4.357 -0.178 1 1 489 . 3 1 1 A 43 43 PRO CA C 1811 66.422 64.053 2.369 1 1 490 . 3 1 1 A 43 43 PRO CB C 1811 31.462 31.649 -0.187 1 1 493 . 3 1 1 A 44 44 SER H H 1812 8.860 7.686 1.174 1 1 494 . 3 1 1 A 44 44 SER HA H 1812 5.516 4.461 1.055 1 1 497 . 3 1 1 A 44 44 SER CA C 1812 59.937 58.343 1.594 1 1 498 . 3 1 1 A 44 44 SER CB C 1812 62.755 63.588 -0.833 1 1 499 . 3 1 1 A 44 44 SER N N 1812 112.267 111.880 0.387 1 1 500 . 3 1 1 A 45 45 GLY H H 1813 8.368 9.014 -0.646 1 1 501 . 3 1 1 A 45 45 GLY HA2 H 1813 4.461 3.883 0.578 1 1 502 . 3 1 1 A 45 45 GLY HA3 H 1813 3.569 3.892 -0.323 1 1 503 . 3 1 1 A 45 45 GLY CA C 1813 44.525 46.537 -2.012 1 1 504 . 3 1 1 A 45 45 GLY N N 1813 112.727 109.708 3.019 1 1 505 . 3 1 1 A 46 46 LYS H H 1814 7.126 7.408 -0.282 1 1 506 . 3 1 1 A 46 46 LYS HA H 1814 4.206 4.956 -0.750 1 1 515 . 3 1 1 A 46 46 LYS CA C 1814 57.460 54.313 3.147 1 1 516 . 3 1 1 A 46 46 LYS CB C 1814 33.453 36.674 -3.221 1 1 520 . 3 1 1 A 46 46 LYS N N 1814 122.101 114.783 7.318 1 1 521 . 3 1 1 A 47 47 VAL H H 1815 8.056 8.645 -0.589 1 1 522 . 3 1 1 A 47 47 VAL HA H 1815 5.400 5.148 0.252 1 1 530 . 3 1 1 A 47 47 VAL CA C 1815 60.048 59.361 0.687 1 1 531 . 3 1 1 A 47 47 VAL CB C 1815 35.044 36.152 -1.108 1 1 534 . 3 1 1 A 47 47 VAL N N 1815 118.680 115.426 3.254 1 1 535 . 3 1 1 A 48 48 ALA H H 1816 9.110 8.530 0.580 1 1 536 . 3 1 1 A 48 48 ALA HA H 1816 4.804 4.891 -0.087 1 1 540 . 3 1 1 A 48 48 ALA CA C 1816 50.808 51.235 -0.427 1 1 541 . 3 1 1 A 48 48 ALA CB C 1816 24.108 23.923 0.185 1 1 542 . 3 1 1 A 48 48 ALA N N 1816 128.274 123.984 4.290 1 1 543 . 3 1 1 A 49 49 GLN H H 1817 8.725 8.559 0.166 1 1 544 . 3 1 1 A 49 49 GLN HA H 1817 5.069 4.848 0.221 1 1 551 . 3 1 1 A 49 49 GLN CA C 1817 53.524 52.222 1.302 1 1 552 . 3 1 1 A 49 49 GLN CB C 1817 30.432 29.795 0.637 1 1 554 . 3 1 1 A 49 49 GLN N N 1817 120.102 117.952 2.150 1 1 556 . 3 1 1 A 50 50 PRO HA H 1818 5.136 4.856 0.280 1 1 563 . 3 1 1 A 50 50 PRO CA C 1818 61.966 62.429 -0.463 1 1 564 . 3 1 1 A 50 50 PRO CB C 1818 32.722 32.831 -0.109 1 1 567 . 3 1 1 A 51 51 THR H H 1819 9.072 8.754 0.318 1 1 568 . 3 1 1 A 51 51 THR HA H 1819 4.566 4.900 -0.334 1 1 573 . 3 1 1 A 51 51 THR CA C 1819 62.695 61.078 1.617 1 1 574 . 3 1 1 A 51 51 THR CB C 1819 70.056 70.033 0.023 1 1 576 . 3 1 1 A 51 51 THR N N 1819 117.512 113.308 4.204 1 1 577 . 3 1 1 A 52 52 ILE H H 1820 8.900 9.254 -0.354 1 1 578 . 3 1 1 A 52 52 ILE HA H 1820 4.905 5.023 -0.118 1 1 588 . 3 1 1 A 52 52 ILE CA C 1820 60.869 59.845 1.024 1 1 589 . 3 1 1 A 52 52 ILE CB C 1820 39.670 39.710 -0.040 1 1 593 . 3 1 1 A 52 52 ILE N N 1820 129.513 128.584 0.929 1 1 594 . 3 1 1 A 53 53 THR H H 1821 9.200 9.019 0.181 1 1 595 . 3 1 1 A 53 53 THR HA H 1821 4.541 4.770 -0.229 1 1 600 . 3 1 1 A 53 53 THR CA C 1821 61.084 61.402 -0.318 1 1 601 . 3 1 1 A 53 53 THR CB C 1821 71.410 72.089 -0.679 1 1 603 . 3 1 1 A 53 53 THR N N 1821 125.271 122.424 2.847 1 1 604 . 3 1 1 A 54 54 ASP H H 1822 8.918 8.844 0.074 1 1 605 . 3 1 1 A 54 54 ASP HA H 1822 4.756 4.804 -0.048 1 1 608 . 3 1 1 A 54 54 ASP CA C 1822 53.906 53.858 0.048 1 1 609 . 3 1 1 A 54 54 ASP CB C 1822 41.443 41.523 -0.080 1 1 610 . 3 1 1 A 54 54 ASP N N 1822 126.647 125.922 0.725 1 1 611 . 3 1 1 A 55 55 ASN H H 1823 8.342 8.863 -0.521 1 1 612 . 3 1 1 A 55 55 ASN HA H 1823 4.704 4.739 -0.035 1 1 617 . 3 1 1 A 55 55 ASN CA C 1823 54.421 52.909 1.512 1 1 618 . 3 1 1 A 55 55 ASN CB C 1823 38.557 38.900 -0.343 1 1 619 . 3 1 1 A 55 55 ASN N N 1823 126.271 119.840 6.431 1 1 621 . 3 1 1 A 56 56 LYS H H 1824 9.232 7.954 1.278 1 1 622 . 3 1 1 A 56 56 LYS HA H 1824 4.099 3.984 0.115 1 1 631 . 3 1 1 A 56 56 LYS CA C 1824 58.015 57.452 0.563 1 1 632 . 3 1 1 A 56 56 LYS CB C 1824 28.691 31.263 -2.572 1 1 636 . 3 1 1 A 56 56 LYS N N 1824 115.352 117.216 -1.864 1 1 637 . 3 1 1 A 57 57 ASP H H 1825 7.905 8.035 -0.130 1 1 638 . 3 1 1 A 57 57 ASP HA H 1825 4.791 4.850 -0.059 1 1 641 . 3 1 1 A 57 57 ASP CA C 1825 52.401 53.263 -0.862 1 1 642 . 3 1 1 A 57 57 ASP CB C 1825 41.166 41.133 0.033 1 1 643 . 3 1 1 A 57 57 ASP N N 1825 119.741 119.204 0.537 1 1 644 . 3 1 1 A 58 58 GLY H H 1826 8.930 8.742 0.188 1 1 645 . 3 1 1 A 58 58 GLY HA2 H 1826 4.265 3.828 0.437 1 1 646 . 3 1 1 A 58 58 GLY HA3 H 1826 3.712 3.853 -0.141 1 1 647 . 3 1 1 A 58 58 GLY CA C 1826 44.870 45.758 -0.888 1 1 648 . 3 1 1 A 58 58 GLY N N 1826 109.578 108.296 1.282 1 1 649 . 3 1 1 A 59 59 THR H H 1827 8.004 7.585 0.419 1 1 650 . 3 1 1 A 59 59 THR HA H 1827 5.394 4.965 0.429 1 1 655 . 3 1 1 A 59 59 THR CA C 1827 60.262 59.251 1.011 1 1 656 . 3 1 1 A 59 59 THR CB C 1827 73.892 72.776 1.116 1 1 658 . 3 1 1 A 59 59 THR N N 1827 112.179 109.975 2.204 1 1 659 . 3 1 1 A 60 60 VAL H H 1828 8.822 9.272 -0.450 1 1 660 . 3 1 1 A 60 60 VAL HA H 1828 5.124 4.918 0.206 1 1 668 . 3 1 1 A 60 60 VAL CA C 1828 59.430 59.201 0.229 1 1 669 . 3 1 1 A 60 60 VAL CB C 1828 35.088 35.044 0.044 1 1 672 . 3 1 1 A 60 60 VAL N N 1828 115.300 116.946 -1.646 1 1 673 . 3 1 1 A 61 61 THR H H 1829 9.115 9.008 0.107 1 1 674 . 3 1 1 A 61 61 THR HA H 1829 5.128 5.055 0.073 1 1 679 . 3 1 1 A 61 61 THR CA C 1829 61.934 61.923 0.011 1 1 680 . 3 1 1 A 61 61 THR CB C 1829 70.561 70.601 -0.040 1 1 682 . 3 1 1 A 61 61 THR N N 1829 121.210 119.367 1.843 1 1 683 . 3 1 1 A 62 62 VAL H H 1830 9.530 9.211 0.319 1 1 684 . 3 1 1 A 62 62 VAL HA H 1830 4.803 5.066 -0.263 1 1 692 . 3 1 1 A 62 62 VAL CA C 1830 60.580 60.626 -0.046 1 1 693 . 3 1 1 A 62 62 VAL CB C 1830 33.747 34.426 -0.679 1 1 696 . 3 1 1 A 62 62 VAL N N 1830 129.896 125.689 4.207 1 1 697 . 3 1 1 A 63 63 ARG H H 1831 8.879 9.134 -0.255 1 1 698 . 3 1 1 A 63 63 ARG HA H 1831 5.282 4.945 0.337 1 1 705 . 3 1 1 A 63 63 ARG CA C 1831 54.759 54.005 0.754 1 1 706 . 3 1 1 A 63 63 ARG CB C 1831 34.410 34.151 0.259 1 1 709 . 3 1 1 A 63 63 ARG N N 1831 125.701 126.031 -0.330 1 1 710 . 3 1 1 A 64 64 TYR H H 1832 8.878 8.679 0.199 1 1 711 . 3 1 1 A 64 64 TYR HA H 1832 4.888 4.946 -0.058 1 1 718 . 3 1 1 A 64 64 TYR CA C 1832 57.694 57.995 -0.301 1 1 719 . 3 1 1 A 64 64 TYR CB C 1832 42.389 41.982 0.407 1 1 722 . 3 1 1 A 64 64 TYR N N 1832 122.731 123.513 -0.782 1 1 723 . 3 1 1 A 65 65 ALA H H 1833 7.925 8.230 -0.305 1 1 724 . 3 1 1 A 65 65 ALA HA H 1833 4.736 4.420 0.316 1 1 728 . 3 1 1 A 65 65 ALA CA C 1833 47.938 49.491 -1.553 1 1 729 . 3 1 1 A 65 65 ALA CB C 1833 18.320 19.579 -1.259 1 1 730 . 3 1 1 A 65 65 ALA N N 1833 135.415 129.498 5.917 1 1 731 . 3 1 1 A 66 66 PRO HA H 1834 4.198 4.513 -0.315 1 1 738 . 3 1 1 A 66 66 PRO CA C 1834 62.701 62.384 0.317 1 1 739 . 3 1 1 A 66 66 PRO CB C 1834 34.445 32.725 1.720 1 1 742 . 3 1 1 A 67 67 SER H H 1835 9.019 8.479 0.540 1 1 743 . 3 1 1 A 67 67 SER HA H 1835 4.555 4.660 -0.105 1 1 746 . 3 1 1 A 67 67 SER CA C 1835 57.320 57.718 -0.398 1 1 747 . 3 1 1 A 67 67 SER CB C 1835 64.778 64.576 0.202 1 1 748 . 3 1 1 A 67 67 SER N N 1835 112.422 113.791 -1.369 1 1 749 . 3 1 1 A 68 68 GLU H H 1836 7.625 7.616 0.009 1 1 750 . 3 1 1 A 68 68 GLU HA H 1836 4.513 4.630 -0.117 1 1 755 . 3 1 1 A 68 68 GLU CA C 1836 54.777 55.884 -1.107 1 1 756 . 3 1 1 A 68 68 GLU CB C 1836 33.981 33.484 0.497 1 1 758 . 3 1 1 A 68 68 GLU N N 1836 123.025 121.151 1.874 1 1 759 . 3 1 1 A 69 69 ALA H H 1837 8.133 8.455 -0.322 1 1 760 . 3 1 1 A 69 69 ALA HA H 1837 4.088 4.356 -0.268 1 1 764 . 3 1 1 A 69 69 ALA CA C 1837 51.070 52.160 -1.090 1 1 765 . 3 1 1 A 69 69 ALA CB C 1837 19.665 20.017 -0.352 1 1 766 . 3 1 1 A 69 69 ALA N N 1837 122.311 126.738 -4.427 1 1 767 . 3 1 1 A 70 70 GLY H H 1838 9.120 8.294 0.826 1 1 768 . 3 1 1 A 70 70 GLY HA2 H 1838 4.453 3.907 0.546 1 1 769 . 3 1 1 A 70 70 GLY HA3 H 1838 2.953 3.975 -1.022 1 1 770 . 3 1 1 A 70 70 GLY CA C 1838 43.362 43.491 -0.129 1 1 771 . 3 1 1 A 70 70 GLY N N 1838 107.031 105.982 1.049 1 1 772 . 3 1 1 A 71 71 LEU H H 1839 9.096 8.258 0.838 1 1 773 . 3 1 1 A 71 71 LEU HA H 1839 4.336 4.631 -0.295 1 1 783 . 3 1 1 A 71 71 LEU CA C 1839 56.657 54.286 2.371 1 1 784 . 3 1 1 A 71 71 LEU CB C 1839 42.032 43.527 -1.495 1 1 788 . 3 1 1 A 71 71 LEU N N 1839 127.931 121.453 6.478 1 1 789 . 3 1 1 A 72 72 HIS H H 1840 9.359 9.251 0.108 1 1 790 . 3 1 1 A 72 72 HIS HA H 1840 4.595 4.969 -0.374 1 1 796 . 3 1 1 A 72 72 HIS CA C 1840 54.539 53.740 0.799 1 1 797 . 3 1 1 A 72 72 HIS CB C 1840 31.421 33.852 -2.431 1 1 800 . 3 1 1 A 72 72 HIS N N 1840 128.527 124.872 3.655 1 1 802 . 3 1 1 A 73 73 GLU H H 1841 7.925 8.609 -0.684 1 1 803 . 3 1 1 A 73 73 GLU HA H 1841 5.142 5.317 -0.175 1 1 808 . 3 1 1 A 73 73 GLU CA C 1841 54.381 54.595 -0.214 1 1 809 . 3 1 1 A 73 73 GLU CB C 1841 34.043 34.165 -0.122 1 1 811 . 3 1 1 A 73 73 GLU N N 1841 119.347 118.339 1.008 1 1 812 . 3 1 1 A 74 74 MET H H 1842 9.383 9.015 0.368 1 1 813 . 3 1 1 A 74 74 MET HA H 1842 5.548 5.157 0.391 1 1 821 . 3 1 1 A 74 74 MET CA C 1842 53.859 54.501 -0.642 1 1 822 . 3 1 1 A 74 74 MET CB C 1842 38.571 36.200 2.371 1 1 825 . 3 1 1 A 74 74 MET N N 1842 124.747 120.117 4.630 1 1 826 . 3 1 1 A 75 75 ASP H H 1843 9.005 9.427 -0.422 1 1 827 . 3 1 1 A 75 75 ASP HA H 1843 5.277 5.556 -0.279 1 1 830 . 3 1 1 A 75 75 ASP CA C 1843 52.774 52.750 0.024 1 1 831 . 3 1 1 A 75 75 ASP CB C 1843 43.493 44.187 -0.694 1 1 832 . 3 1 1 A 75 75 ASP N N 1843 128.148 125.431 2.717 1 1 833 . 3 1 1 A 76 76 ILE H H 1844 9.434 8.906 0.528 1 1 834 . 3 1 1 A 76 76 ILE HA H 1844 4.672 4.798 -0.126 1 1 844 . 3 1 1 A 76 76 ILE CA C 1844 60.715 59.917 0.798 1 1 845 . 3 1 1 A 76 76 ILE CB C 1844 39.470 41.117 -1.647 1 1 849 . 3 1 1 A 76 76 ILE N N 1844 124.097 122.196 1.901 1 1 850 . 3 1 1 A 77 77 ARG H H 1845 8.888 9.051 -0.163 1 1 851 . 3 1 1 A 77 77 ARG HA H 1845 5.050 4.812 0.238 1 1 859 . 3 1 1 A 77 77 ARG CA C 1845 53.780 54.119 -0.339 1 1 860 . 3 1 1 A 77 77 ARG CB C 1845 34.564 33.620 0.944 1 1 863 . 3 1 1 A 77 77 ARG N N 1845 124.944 124.385 0.559 1 1 865 . 3 1 1 A 78 78 TYR H H 1846 8.974 9.188 -0.214 1 1 866 . 3 1 1 A 78 78 TYR HA H 1846 5.151 4.914 0.237 1 1 873 . 3 1 1 A 78 78 TYR CA C 1846 55.909 57.592 -1.683 1 1 874 . 3 1 1 A 78 78 TYR CB C 1846 41.732 40.817 0.915 1 1 877 . 3 1 1 A 78 78 TYR N N 1846 121.774 124.124 -2.350 1 1 878 . 3 1 1 A 79 79 ASP H H 1847 9.026 9.230 -0.204 1 1 879 . 3 1 1 A 79 79 ASP HA H 1847 4.127 4.218 -0.091 1 1 882 . 3 1 1 A 79 79 ASP CA C 1847 55.808 55.126 0.682 1 1 883 . 3 1 1 A 79 79 ASP CB C 1847 39.181 39.604 -0.423 1 1 884 . 3 1 1 A 79 79 ASP N N 1847 131.304 128.010 3.294 1 1 885 . 3 1 1 A 80 80 ASN H H 1848 8.608 8.340 0.268 1 1 886 . 3 1 1 A 80 80 ASN HA H 1848 3.990 4.376 -0.386 1 1 891 . 3 1 1 A 80 80 ASN CA C 1848 55.149 54.668 0.481 1 1 892 . 3 1 1 A 80 80 ASN CB C 1848 38.470 38.599 -0.129 1 1 893 . 3 1 1 A 80 80 ASN N N 1848 108.490 114.972 -6.482 1 1 895 . 3 1 1 A 81 81 MET H H 1849 7.820 7.961 -0.141 1 1 896 . 3 1 1 A 81 81 MET HA H 1849 4.819 4.923 -0.104 1 1 904 . 3 1 1 A 81 81 MET CA C 1849 53.852 54.450 -0.598 1 1 905 . 3 1 1 A 81 81 MET CB C 1849 34.665 34.910 -0.245 1 1 908 . 3 1 1 A 81 81 MET N N 1849 121.878 119.756 2.122 1 1 909 . 3 1 1 A 82 82 HIS H H 1850 8.575 8.747 -0.172 1 1 910 . 3 1 1 A 82 82 HIS HA H 1850 4.539 4.652 -0.113 1 1 915 . 3 1 1 A 82 82 HIS CA C 1850 58.819 57.338 1.481 1 1 916 . 3 1 1 A 82 82 HIS CB C 1850 32.419 30.578 1.841 1 1 919 . 3 1 1 A 82 82 HIS N N 1850 124.291 124.630 -0.339 1 1 920 . 3 1 1 A 83 83 ILE H H 1851 8.333 8.041 0.292 1 1 921 . 3 1 1 A 83 83 ILE HA H 1851 4.608 4.323 0.285 1 1 931 . 3 1 1 A 83 83 ILE CA C 1851 60.727 59.291 1.436 1 1 932 . 3 1 1 A 83 83 ILE CB C 1851 35.928 37.486 -1.558 1 1 936 . 3 1 1 A 83 83 ILE N N 1851 120.786 120.889 -0.103 1 1 937 . 3 1 1 A 84 84 PRO HA H 1852 4.426 4.329 0.097 1 1 944 . 3 1 1 A 84 84 PRO CA C 1852 65.249 64.043 1.206 1 1 945 . 3 1 1 A 84 84 PRO CB C 1852 31.120 31.459 -0.339 1 1 948 . 3 1 1 A 85 85 GLY H H 1853 8.498 8.994 -0.496 1 1 949 . 3 1 1 A 85 85 GLY HA2 H 1853 4.284 4.076 0.208 1 1 950 . 3 1 1 A 85 85 GLY HA3 H 1853 3.397 4.117 -0.720 1 1 951 . 3 1 1 A 85 85 GLY CA C 1853 44.913 45.244 -0.331 1 1 952 . 3 1 1 A 85 85 GLY N N 1853 114.093 113.737 0.356 1 1 953 . 3 1 1 A 86 86 SER H H 1854 7.823 8.002 -0.179 1 1 954 . 3 1 1 A 86 86 SER HA H 1854 4.834 4.766 0.068 1 1 957 . 3 1 1 A 86 86 SER CA C 1854 55.628 55.651 -0.023 1 1 958 . 3 1 1 A 86 86 SER CB C 1854 63.063 64.170 -1.107 1 1 959 . 3 1 1 A 86 86 SER N N 1854 112.722 117.894 -5.172 1 1 960 . 3 1 1 A 87 87 PRO HA H 1855 5.681 4.822 0.859 1 1 967 . 3 1 1 A 87 87 PRO CA C 1855 63.079 62.468 0.611 1 1 968 . 3 1 1 A 87 87 PRO CB C 1855 34.406 32.814 1.592 1 1 971 . 3 1 1 A 88 88 LEU H H 1856 9.168 8.856 0.312 1 1 972 . 3 1 1 A 88 88 LEU HA H 1856 4.909 5.200 -0.291 1 1 982 . 3 1 1 A 88 88 LEU CA C 1856 53.839 53.284 0.555 1 1 983 . 3 1 1 A 88 88 LEU CB C 1856 45.558 45.862 -0.304 1 1 987 . 3 1 1 A 88 88 LEU N N 1856 122.495 121.127 1.368 1 1 988 . 3 1 1 A 89 89 GLN H H 1857 9.583 8.857 0.726 1 1 989 . 3 1 1 A 89 89 GLN HA H 1857 5.508 5.602 -0.094 1 1 996 . 3 1 1 A 89 89 GLN CA C 1857 54.609 54.603 0.006 1 1 997 . 3 1 1 A 89 89 GLN CB C 1857 32.840 33.125 -0.285 1 1 999 . 3 1 1 A 89 89 GLN N N 1857 119.151 121.517 -2.366 1 1 1001 . 3 1 1 A 90 90 PHE H H 1858 8.600 8.776 -0.176 1 1 1002 . 3 1 1 A 90 90 PHE HA H 1858 5.095 5.120 -0.025 1 1 1010 . 3 1 1 A 90 90 PHE CA C 1858 56.161 55.988 0.173 1 1 1011 . 3 1 1 A 90 90 PHE CB C 1858 41.411 40.951 0.460 1 1 1015 . 3 1 1 A 90 90 PHE N N 1858 118.242 120.250 -2.008 1 1 1016 . 3 1 1 A 91 91 TYR H H 1859 9.892 8.916 0.976 1 1 1017 . 3 1 1 A 91 91 TYR HA H 1859 4.790 5.269 -0.479 1 1 1024 . 3 1 1 A 91 91 TYR CA C 1859 58.205 56.451 1.754 1 1 1025 . 3 1 1 A 91 91 TYR CB C 1859 40.867 41.893 -1.026 1 1 1028 . 3 1 1 A 91 91 TYR N N 1859 127.393 122.561 4.832 1 1 1029 . 3 1 1 A 92 92 VAL H H 1860 8.072 8.101 -0.029 1 1 1030 . 3 1 1 A 92 92 VAL HA H 1860 4.377 4.915 -0.538 1 1 1038 . 3 1 1 A 92 92 VAL CA C 1860 62.583 60.442 2.141 1 1 1039 . 3 1 1 A 92 92 VAL CB C 1860 33.609 34.527 -0.918 1 1 1042 . 3 1 1 A 92 92 VAL N N 1860 132.007 125.264 6.743 1 1 1043 . 3 1 1 A 93 93 ASP H H 1861 8.438 9.024 -0.586 1 1 1044 . 3 1 1 A 93 93 ASP HA H 1861 5.024 5.183 -0.159 1 1 1047 . 3 1 1 A 93 93 ASP CA C 1861 50.678 52.729 -2.051 1 1 1048 . 3 1 1 A 93 93 ASP CB C 1861 46.086 45.143 0.943 1 1 1049 . 3 1 1 A 93 93 ASP N N 1861 130.459 124.108 6.351 1 1 1050 . 3 1 1 A 94 94 TYR H H 1862 9.674 8.746 0.928 1 1 1051 . 3 1 1 A 94 94 TYR HA H 1862 4.606 4.693 -0.087 1 1 1058 . 3 1 1 A 94 94 TYR CA C 1862 58.983 58.758 0.225 1 1 1059 . 3 1 1 A 94 94 TYR CB C 1862 39.727 38.601 1.126 1 1 1062 . 3 1 1 A 94 94 TYR N N 1862 120.069 121.398 -1.329 1 1 1063 . 3 1 1 A 95 95 VAL H H 1863 8.371 9.249 -0.878 1 1 1064 . 3 1 1 A 95 95 VAL HA H 1863 3.654 3.962 -0.308 1 1 1072 . 3 1 1 A 95 95 VAL CA C 1863 64.922 64.917 0.005 1 1 1073 . 3 1 1 A 95 95 VAL CB C 1863 32.270 31.932 0.338 1 1 1076 . 3 1 1 A 95 95 VAL N N 1863 121.770 126.275 -4.505 1 1 1077 . 3 1 1 A 96 96 ASN H H 1864 8.729 8.046 0.683 1 1 1078 . 3 1 1 A 96 96 ASN HA H 1864 4.901 4.621 0.280 1 1 1083 . 3 1 1 A 96 96 ASN CA C 1864 52.652 54.139 -1.487 1 1 1084 . 3 1 1 A 96 96 ASN CB C 1864 38.160 38.529 -0.369 1 1 1085 . 3 1 1 A 96 96 ASN N N 1864 120.006 118.784 1.222 1 1 1087 . 3 1 1 A 97 97 CYS H H 1865 7.875 7.558 0.317 1 1 1088 . 3 1 1 A 97 97 CYS HA H 1865 4.575 4.476 0.099 1 1 1091 . 3 1 1 A 97 97 CYS CA C 1865 57.009 59.867 -2.858 1 1 1092 . 3 1 1 A 97 97 CYS CB C 1865 29.845 28.427 1.418 1 1 1093 . 3 1 1 A 97 97 CYS N N 1865 117.023 117.133 -0.110 1 1 1094 . 3 1 1 A 98 98 GLY HA2 H 1866 4.045 4.011 0.034 1 1 1095 . 3 1 1 A 98 98 GLY HA3 H 1866 3.866 4.026 -0.160 1 1 1096 . 3 1 1 A 98 98 GLY CA C 1866 46.078 45.745 0.333 1 1 1097 . 3 1 1 A 99 99 HIS H H 1867 7.144 8.054 -0.910 1 1 1098 . 3 1 1 A 99 99 HIS HA H 1867 4.940 4.673 0.267 1 1 1103 . 3 1 1 A 99 99 HIS CA C 1867 53.843 55.719 -1.876 1 1 1104 . 3 1 1 A 99 99 HIS CB C 1867 31.584 30.569 1.015 1 1 1107 . 3 1 1 A 99 99 HIS N N 1867 115.591 118.686 -3.095 1 1 1108 . 3 1 1 A 100 100 VAL H H 1868 8.434 8.417 0.017 1 1 1109 . 3 1 1 A 100 100 VAL HA H 1868 4.143 4.199 -0.056 1 1 1117 . 3 1 1 A 100 100 VAL CA C 1868 63.974 63.677 0.297 1 1 1118 . 3 1 1 A 100 100 VAL CB C 1868 31.525 32.025 -0.500 1 1 1121 . 3 1 1 A 100 100 VAL N N 1868 122.851 120.946 1.905 1 1 1122 . 3 1 1 A 101 101 THR H H 1869 7.869 8.157 -0.288 1 1 1123 . 3 1 1 A 101 101 THR HA H 1869 5.217 4.815 0.402 1 1 1128 . 3 1 1 A 101 101 THR CA C 1869 59.495 60.918 -1.423 1 1 1129 . 3 1 1 A 101 101 THR CB C 1869 72.402 70.218 2.184 1 1 1131 . 3 1 1 A 101 101 THR N N 1869 118.578 119.964 -1.386 1 1 1132 . 3 1 1 A 102 102 ALA H H 1870 8.512 8.903 -0.391 1 1 1133 . 3 1 1 A 102 102 ALA HA H 1870 5.687 5.434 0.253 1 1 1137 . 3 1 1 A 102 102 ALA CA C 1870 50.497 50.524 -0.027 1 1 1138 . 3 1 1 A 102 102 ALA CB C 1870 23.128 23.252 -0.124 1 1 1139 . 3 1 1 A 102 102 ALA N N 1870 125.193 125.723 -0.530 1 1 1140 . 3 1 1 A 103 103 TYR H H 1871 8.753 8.775 -0.022 1 1 1141 . 3 1 1 A 103 103 TYR HA H 1871 5.019 5.178 -0.159 1 1 1148 . 3 1 1 A 103 103 TYR CA C 1871 56.303 56.158 0.145 1 1 1149 . 3 1 1 A 103 103 TYR CB C 1871 39.347 41.194 -1.847 1 1 1152 . 3 1 1 A 103 103 TYR N N 1871 119.968 116.771 3.197 1 1 1153 . 3 1 1 A 104 104 GLY H H 1872 9.006 8.632 0.374 1 1 1154 . 3 1 1 A 104 104 GLY HA2 H 1872 5.326 4.327 0.999 1 1 1155 . 3 1 1 A 104 104 GLY HA3 H 1872 4.226 4.344 -0.118 1 1 1156 . 3 1 1 A 104 104 GLY CA C 1872 44.624 44.446 0.178 1 1 1157 . 3 1 1 A 104 104 GLY N N 1872 109.622 106.966 2.656 1 1 1158 . 3 1 1 A 105 105 PRO HA H 1873 4.450 4.466 -0.016 1 1 1165 . 3 1 1 A 105 105 PRO CA C 1873 66.676 65.038 1.638 1 1 1166 . 3 1 1 A 105 105 PRO CB C 1873 32.425 32.113 0.312 1 1 1169 . 3 1 1 A 106 106 GLY H H 1874 9.251 8.608 0.643 1 1 1170 . 3 1 1 A 106 106 GLY HA2 H 1874 4.600 3.921 0.679 1 1 1171 . 3 1 1 A 106 106 GLY HA3 H 1874 3.521 4.146 -0.625 1 1 1172 . 3 1 1 A 106 106 GLY CA C 1874 46.454 47.025 -0.571 1 1 1173 . 3 1 1 A 106 106 GLY N N 1874 105.282 105.516 -0.234 1 1 1174 . 3 1 1 A 107 107 LEU H H 1875 7.161 7.894 -0.733 1 1 1175 . 3 1 1 A 107 107 LEU HA H 1875 4.062 3.950 0.112 1 1 1185 . 3 1 1 A 107 107 LEU CA C 1875 55.592 56.199 -0.607 1 1 1186 . 3 1 1 A 107 107 LEU CB C 1875 41.516 40.677 0.839 1 1 1190 . 3 1 1 A 107 107 LEU N N 1875 117.141 119.252 -2.111 1 1 1191 . 3 1 1 A 108 108 THR H H 1876 8.298 7.960 0.338 1 1 1192 . 3 1 1 A 108 108 THR HA H 1876 5.038 4.500 0.538 1 1 1197 . 3 1 1 A 108 108 THR CA C 1876 64.551 63.835 0.716 1 1 1198 . 3 1 1 A 108 108 THR CB C 1876 72.706 70.950 1.756 1 1 1200 . 3 1 1 A 108 108 THR N N 1876 114.411 112.202 2.209 1 1 1201 . 3 1 1 A 109 109 HIS H H 1877 9.030 7.981 1.049 1 1 1202 . 3 1 1 A 109 109 HIS HA H 1877 5.854 5.050 0.804 1 1 1207 . 3 1 1 A 109 109 HIS CA C 1877 56.127 55.173 0.954 1 1 1208 . 3 1 1 A 109 109 HIS CB C 1877 36.258 33.169 3.089 1 1 1211 . 3 1 1 A 109 109 HIS N N 1877 125.809 117.193 8.616 1 1 1212 . 3 1 1 A 110 110 GLY H H 1878 7.497 7.719 -0.222 1 1 1213 . 3 1 1 A 110 110 GLY HA2 H 1878 4.075 4.066 0.009 1 1 1214 . 3 1 1 A 110 110 GLY HA3 H 1878 3.512 4.087 -0.575 1 1 1215 . 3 1 1 A 110 110 GLY CA C 1878 44.559 44.776 -0.217 1 1 1216 . 3 1 1 A 110 110 GLY N N 1878 111.907 111.108 0.799 1 1 1217 . 3 1 1 A 111 111 VAL H H 1879 8.776 8.241 0.535 1 1 1218 . 3 1 1 A 111 111 VAL HA H 1879 4.741 4.628 0.113 1 1 1226 . 3 1 1 A 111 111 VAL CA C 1879 60.188 60.605 -0.417 1 1 1227 . 3 1 1 A 111 111 VAL CB C 1879 35.130 35.542 -0.412 1 1 1230 . 3 1 1 A 111 111 VAL N N 1879 119.617 119.826 -0.209 1 1 1231 . 3 1 1 A 112 112 VAL H H 1880 7.841 8.626 -0.785 1 1 1232 . 3 1 1 A 112 112 VAL HA H 1880 3.343 3.940 -0.597 1 1 1240 . 3 1 1 A 112 112 VAL CA C 1880 63.553 62.699 0.854 1 1 1241 . 3 1 1 A 112 112 VAL CB C 1880 32.257 31.592 0.665 1 1 1243 . 3 1 1 A 112 112 VAL N N 1880 122.070 126.608 -4.538 1 1 1244 . 3 1 1 A 113 113 ASN H H 1881 8.822 8.900 -0.078 1 1 1245 . 3 1 1 A 113 113 ASN HA H 1881 4.079 4.357 -0.278 1 1 1250 . 3 1 1 A 113 113 ASN CA C 1881 55.459 55.011 0.448 1 1 1251 . 3 1 1 A 113 113 ASN CB C 1881 37.330 37.082 0.248 1 1 1252 . 3 1 1 A 113 113 ASN N N 1881 115.063 117.819 -2.756 1 1 1254 . 3 1 1 A 114 114 LYS H H 1882 8.073 7.455 0.618 1 1 1255 . 3 1 1 A 114 114 LYS HA H 1882 4.818 4.679 0.139 1 1 1260 . 3 1 1 A 114 114 LYS CA C 1882 53.039 52.755 0.284 1 1 1261 . 3 1 1 A 114 114 LYS CB C 1882 34.020 33.196 0.824 1 1 1263 . 3 1 1 A 114 114 LYS N N 1882 121.439 119.271 2.168 1 1 1264 . 3 1 1 A 115 115 PRO HA H 1883 4.409 4.695 -0.286 1 1 1271 . 3 1 1 A 115 115 PRO CA C 1883 63.121 62.655 0.466 1 1 1272 . 3 1 1 A 115 115 PRO CB C 1883 31.515 31.814 -0.299 1 1 1275 . 3 1 1 A 116 116 ALA H H 1884 8.868 8.199 0.669 1 1 1276 . 3 1 1 A 116 116 ALA HA H 1884 4.804 4.946 -0.142 1 1 1280 . 3 1 1 A 116 116 ALA CA C 1884 50.620 50.341 0.279 1 1 1281 . 3 1 1 A 116 116 ALA CB C 1884 19.426 22.244 -2.818 1 1 1282 . 3 1 1 A 116 116 ALA N N 1884 132.329 125.102 7.227 1 1 1283 . 3 1 1 A 117 117 THR H H 1885 8.433 8.714 -0.281 1 1 1284 . 3 1 1 A 117 117 THR HA H 1885 5.747 5.479 0.268 1 1 1289 . 3 1 1 A 117 117 THR CA C 1885 60.364 59.876 0.488 1 1 1290 . 3 1 1 A 117 117 THR CB C 1885 72.204 71.896 0.308 1 1 1292 . 3 1 1 A 117 117 THR N N 1885 113.428 111.302 2.126 1 1 1293 . 3 1 1 A 118 118 PHE H H 1886 9.069 8.550 0.519 1 1 1294 . 3 1 1 A 118 118 PHE HA H 1886 5.123 5.184 -0.061 1 1 1301 . 3 1 1 A 118 118 PHE CA C 1886 57.059 56.051 1.008 1 1 1302 . 3 1 1 A 118 118 PHE CB C 1886 39.994 41.094 -1.100 1 1 1305 . 3 1 1 A 118 118 PHE N N 1886 119.166 117.609 1.557 1 1 1306 . 3 1 1 A 119 119 THR H H 1887 9.451 8.961 0.490 1 1 1307 . 3 1 1 A 119 119 THR HA H 1887 5.097 5.241 -0.144 1 1 1312 . 3 1 1 A 119 119 THR CA C 1887 62.050 61.177 0.873 1 1 1313 . 3 1 1 A 119 119 THR CB C 1887 71.696 72.575 -0.879 1 1 1315 . 3 1 1 A 119 119 THR N N 1887 119.436 114.388 5.048 1 1 1316 . 3 1 1 A 120 120 VAL H H 1888 8.812 9.282 -0.470 1 1 1317 . 3 1 1 A 120 120 VAL HA H 1888 4.807 4.589 0.218 1 1 1325 . 3 1 1 A 120 120 VAL CA C 1888 61.140 60.922 0.218 1 1 1326 . 3 1 1 A 120 120 VAL CB C 1888 34.059 34.176 -0.117 1 1 1329 . 3 1 1 A 120 120 VAL N N 1888 124.304 126.065 -1.761 1 1 1330 . 3 1 1 A 121 121 ASN H H 1889 9.291 9.084 0.207 1 1 1331 . 3 1 1 A 121 121 ASN HA H 1889 5.177 5.306 -0.129 1 1 1336 . 3 1 1 A 121 121 ASN CA C 1889 52.470 52.198 0.272 1 1 1337 . 3 1 1 A 121 121 ASN CB C 1889 39.766 40.398 -0.632 1 1 1338 . 3 1 1 A 121 121 ASN N N 1889 128.674 125.373 3.301 1 1 1340 . 3 1 1 A 122 122 THR H H 1890 8.553 8.384 0.169 1 1 1341 . 3 1 1 A 122 122 THR HA H 1890 4.236 4.930 -0.694 1 1 1346 . 3 1 1 A 122 122 THR CA C 1890 61.062 61.225 -0.163 1 1 1347 . 3 1 1 A 122 122 THR CB C 1890 68.437 69.649 -1.212 1 1 1349 . 3 1 1 A 122 122 THR N N 1890 116.203 113.407 2.796 1 1 1350 . 3 1 1 A 123 123 LYS H H 1891 8.210 7.946 0.264 1 1 1351 . 3 1 1 A 123 123 LYS HA H 1891 4.019 4.055 -0.036 1 1 1360 . 3 1 1 A 123 123 LYS CA C 1891 58.646 59.355 -0.709 1 1 1361 . 3 1 1 A 123 123 LYS CB C 1891 31.868 32.353 -0.485 1 1 1365 . 3 1 1 A 123 123 LYS N N 1891 124.070 122.419 1.651 1 1 1366 . 3 1 1 A 124 124 ASP H H 1892 8.596 7.862 0.734 1 1 1367 . 3 1 1 A 124 124 ASP HA H 1892 4.638 4.937 -0.299 1 1 1370 . 3 1 1 A 124 124 ASP CA C 1892 54.928 52.872 2.056 1 1 1371 . 3 1 1 A 124 124 ASP CB C 1892 40.725 41.351 -0.626 1 1 1372 . 3 1 1 A 124 124 ASP N N 1892 119.838 117.734 2.104 1 1 1373 . 3 1 1 A 125 125 ALA H H 1893 7.792 7.693 0.099 1 1 1374 . 3 1 1 A 125 125 ALA HA H 1893 4.248 4.105 0.143 1 1 1378 . 3 1 1 A 125 125 ALA CA C 1893 52.852 53.146 -0.294 1 1 1379 . 3 1 1 A 125 125 ALA CB C 1893 20.199 19.305 0.894 1 1 1380 . 3 1 1 A 125 125 ALA N N 1893 122.999 122.225 0.774 1 1 1381 . 3 1 1 A 126 126 GLY H H 1894 8.214 7.713 0.501 1 1 1382 . 3 1 1 A 126 126 GLY HA2 H 1894 4.183 3.936 0.247 1 1 1383 . 3 1 1 A 126 126 GLY HA3 H 1894 3.993 3.987 0.006 1 1 1384 . 3 1 1 A 126 126 GLY CA C 1894 44.725 44.637 0.088 1 1 1385 . 3 1 1 A 126 126 GLY N N 1894 108.359 104.165 4.194 1 1 1386 . 3 1 1 A 127 127 GLU H H 1895 8.633 8.383 0.250 1 1 1387 . 3 1 1 A 127 127 GLU HA H 1895 4.318 4.498 -0.180 1 1 1392 . 3 1 1 A 127 127 GLU CA C 1895 57.280 55.883 1.397 1 1 1393 . 3 1 1 A 127 127 GLU CB C 1895 30.434 30.828 -0.394 1 1 1395 . 3 1 1 A 127 127 GLU N N 1895 122.934 119.754 3.180 1 1 1396 . 3 1 1 A 128 128 GLY H H 1896 8.351 8.651 -0.300 1 1 1397 . 3 1 1 A 128 128 GLY HA2 H 1896 3.853 4.013 -0.160 1 1 1398 . 3 1 1 A 128 128 GLY HA3 H 1896 3.853 4.016 -0.163 1 1 1399 . 3 1 1 A 128 128 GLY CA C 1896 45.766 45.182 0.584 1 1 1400 . 3 1 1 A 128 128 GLY N N 1896 111.048 110.856 0.192 1 1 1401 . 3 1 1 A 129 129 GLY H H 1897 7.580 8.652 -1.072 1 1 1402 . 3 1 1 A 129 129 GLY HA2 H 1897 4.170 4.060 0.110 1 1 1403 . 3 1 1 A 129 129 GLY HA3 H 1897 3.463 4.091 -0.628 1 1 1404 . 3 1 1 A 129 129 GLY CA C 1897 44.670 45.464 -0.794 1 1 1405 . 3 1 1 A 129 129 GLY N N 1897 106.306 109.162 -2.856 1 1 1406 . 3 1 1 A 130 130 LEU H H 1898 8.416 8.213 0.203 1 1 1407 . 3 1 1 A 130 130 LEU HA H 1898 5.077 4.162 0.915 1 1 1417 . 3 1 1 A 130 130 LEU CA C 1898 54.526 54.337 0.189 1 1 1418 . 3 1 1 A 130 130 LEU CB C 1898 44.499 42.391 2.108 1 1 1422 . 3 1 1 A 130 130 LEU N N 1898 126.737 125.006 1.731 1 1 1423 . 3 1 1 A 131 131 SER H H 1899 9.254 9.271 -0.017 1 1 1424 . 3 1 1 A 131 131 SER HA H 1899 4.803 5.427 -0.624 1 1 1427 . 3 1 1 A 131 131 SER CA C 1899 57.293 57.180 0.113 1 1 1428 . 3 1 1 A 131 131 SER CB C 1899 65.376 66.759 -1.383 1 1 1429 . 3 1 1 A 131 131 SER N N 1899 123.028 124.588 -1.560 1 1 1430 . 3 1 1 A 132 132 LEU H H 1900 8.410 8.560 -0.150 1 1 1431 . 3 1 1 A 132 132 LEU HA H 1900 5.452 4.968 0.484 1 1 1441 . 3 1 1 A 132 132 LEU CA C 1900 53.045 54.185 -1.140 1 1 1442 . 3 1 1 A 132 132 LEU CB C 1900 46.982 46.014 0.968 1 1 1446 . 3 1 1 A 132 132 LEU N N 1900 126.218 122.961 3.257 1 1 1447 . 3 1 1 A 133 133 ALA H H 1901 8.708 8.519 0.189 1 1 1448 . 3 1 1 A 133 133 ALA HA H 1901 4.591 4.944 -0.353 1 1 1452 . 3 1 1 A 133 133 ALA CA C 1901 52.140 51.424 0.716 1 1 1453 . 3 1 1 A 133 133 ALA CB C 1901 22.653 23.689 -1.036 1 1 1454 . 3 1 1 A 133 133 ALA N N 1901 124.744 125.768 -1.024 1 1 1455 . 3 1 1 A 134 134 ILE H H 1902 8.641 8.497 0.144 1 1 1456 . 3 1 1 A 134 134 ILE HA H 1902 5.256 5.064 0.192 1 1 1466 . 3 1 1 A 134 134 ILE CA C 1902 59.873 60.100 -0.227 1 1 1467 . 3 1 1 A 134 134 ILE CB C 1902 41.214 41.937 -0.723 1 1 1471 . 3 1 1 A 134 134 ILE N N 1902 121.132 120.058 1.074 1 1 1472 . 3 1 1 A 135 135 GLU H H 1903 9.294 8.797 0.497 1 1 1473 . 3 1 1 A 135 135 GLU HA H 1903 4.869 5.221 -0.352 1 1 1478 . 3 1 1 A 135 135 GLU CA C 1903 54.307 54.626 -0.319 1 1 1479 . 3 1 1 A 135 135 GLU CB C 1903 32.474 32.788 -0.314 1 1 1481 . 3 1 1 A 135 135 GLU N N 1903 129.644 125.067 4.577 1 1 1482 . 3 1 1 A 136 136 GLY H H 1904 8.347 8.327 0.020 1 1 1483 . 3 1 1 A 136 136 GLY HA2 H 1904 4.005 3.413 0.592 1 1 1484 . 3 1 1 A 136 136 GLY HA3 H 1904 3.629 3.904 -0.275 1 1 1485 . 3 1 1 A 136 136 GLY CA C 1904 45.530 44.839 0.691 1 1 1486 . 3 1 1 A 136 136 GLY N N 1904 112.326 109.973 2.353 1 1 1487 . 3 1 1 A 137 137 PRO HA H 1905 4.268 4.288 -0.020 1 1 1494 . 3 1 1 A 137 137 PRO CA C 1905 64.189 64.526 -0.337 1 1 1495 . 3 1 1 A 137 137 PRO CB C 1905 32.482 32.084 0.398 1 1 1498 . 3 1 1 A 138 138 SER H H 1906 7.060 7.444 -0.384 1 1 1499 . 3 1 1 A 138 138 SER HA H 1906 4.603 4.903 -0.300 1 1 1502 . 3 1 1 A 138 138 SER CA C 1906 56.433 56.643 -0.210 1 1 1503 . 3 1 1 A 138 138 SER CB C 1906 66.672 65.622 1.050 1 1 1504 . 3 1 1 A 138 138 SER N N 1906 109.100 111.806 -2.706 1 1 1505 . 3 1 1 A 139 139 LYS H H 1907 8.479 8.405 0.074 1 1 1506 . 3 1 1 A 139 139 LYS HA H 1907 4.413 4.438 -0.025 1 1 1515 . 3 1 1 A 139 139 LYS CA C 1907 56.638 56.635 0.003 1 1 1516 . 3 1 1 A 139 139 LYS CB C 1907 31.873 32.903 -1.030 1 1 1520 . 3 1 1 A 139 139 LYS N N 1907 124.545 126.443 -1.898 1 1 1521 . 3 1 1 A 140 140 ALA H H 1908 8.358 8.596 -0.238 1 1 1522 . 3 1 1 A 140 140 ALA HA H 1908 4.706 4.525 0.181 1 1 1526 . 3 1 1 A 140 140 ALA CA C 1908 51.081 52.248 -1.167 1 1 1527 . 3 1 1 A 140 140 ALA CB C 1908 20.724 19.462 1.262 1 1 1528 . 3 1 1 A 140 140 ALA N N 1908 131.020 129.147 1.873 1 1 1529 . 3 1 1 A 141 141 GLU H H 1909 8.625 8.339 0.286 1 1 1530 . 3 1 1 A 141 141 GLU HA H 1909 4.248 4.747 -0.499 1 1 1535 . 3 1 1 A 141 141 GLU CA C 1909 56.991 56.232 0.759 1 1 1536 . 3 1 1 A 141 141 GLU CB C 1909 30.453 30.579 -0.126 1 1 1538 . 3 1 1 A 141 141 GLU N N 1909 124.862 120.839 4.023 1 1 1539 . 3 1 1 A 142 142 ILE H H 1910 8.588 8.661 -0.073 1 1 1540 . 3 1 1 A 142 142 ILE HA H 1910 4.871 5.124 -0.253 1 1 1550 . 3 1 1 A 142 142 ILE CA C 1910 60.733 59.882 0.851 1 1 1551 . 3 1 1 A 142 142 ILE CB C 1910 41.494 41.640 -0.146 1 1 1555 . 3 1 1 A 142 142 ILE N N 1910 126.220 125.360 0.860 1 1 1556 . 3 1 1 A 143 143 SER H H 1911 9.269 9.105 0.164 1 1 1557 . 3 1 1 A 143 143 SER HA H 1911 4.804 5.207 -0.403 1 1 1560 . 3 1 1 A 143 143 SER CA C 1911 56.988 56.979 0.009 1 1 1561 . 3 1 1 A 143 143 SER CB C 1911 65.172 65.875 -0.703 1 1 1562 . 3 1 1 A 143 143 SER N N 1911 124.083 120.643 3.440 1 1 1563 . 3 1 1 A 144 144 CYS H H 1912 8.773 8.796 -0.023 1 1 1564 . 3 1 1 A 144 144 CYS HA H 1912 5.200 5.184 0.016 1 1 1567 . 3 1 1 A 144 144 CYS CA C 1912 57.256 56.439 0.817 1 1 1568 . 3 1 1 A 144 144 CYS CB C 1912 29.137 31.501 -2.364 1 1 1569 . 3 1 1 A 144 144 CYS N N 1912 125.729 120.316 5.413 1 1 1570 . 3 1 1 A 145 145 THR H H 1913 8.976 8.756 0.220 1 1 1571 . 3 1 1 A 145 145 THR HA H 1913 4.510 4.975 -0.465 1 1 1576 . 3 1 1 A 145 145 THR CA C 1913 61.388 61.504 -0.116 1 1 1577 . 3 1 1 A 145 145 THR CB C 1913 71.558 71.849 -0.291 1 1 1579 . 3 1 1 A 145 145 THR N N 1913 124.914 117.471 7.443 1 1 1580 . 3 1 1 A 146 146 ASP H H 1914 8.843 9.073 -0.230 1 1 1581 . 3 1 1 A 146 146 ASP HA H 1914 4.842 4.809 0.033 1 1 1584 . 3 1 1 A 146 146 ASP CA C 1914 54.307 54.352 -0.045 1 1 1585 . 3 1 1 A 146 146 ASP CB C 1914 41.262 42.104 -0.842 1 1 1586 . 3 1 1 A 146 146 ASP N N 1914 128.084 128.515 -0.431 1 1 1587 . 3 1 1 A 147 147 ASN H H 1915 8.700 8.937 -0.237 1 1 1588 . 3 1 1 A 147 147 ASN HA H 1915 4.798 5.102 -0.304 1 1 1593 . 3 1 1 A 147 147 ASN CA C 1915 54.283 52.029 2.254 1 1 1594 . 3 1 1 A 147 147 ASN CB C 1915 38.986 40.840 -1.854 1 1 1595 . 3 1 1 A 147 147 ASN N N 1915 125.720 122.986 2.734 1 1 1597 . 3 1 1 A 148 148 GLN HA H 1916 4.057 3.973 0.084 1 1 1602 . 3 1 1 A 148 148 GLN CA C 1916 57.839 58.132 -0.293 1 1 1603 . 3 1 1 A 148 148 GLN CB C 1916 26.281 28.654 -2.373 1 1 1605 . 3 1 1 A 149 149 ASP H H 1917 7.892 7.981 -0.089 1 1 1606 . 3 1 1 A 149 149 ASP HA H 1917 4.755 4.555 0.200 1 1 1609 . 3 1 1 A 149 149 ASP CA C 1917 52.659 54.241 -1.582 1 1 1610 . 3 1 1 A 149 149 ASP CB C 1917 41.111 40.990 0.121 1 1 1611 . 3 1 1 A 149 149 ASP N N 1917 118.769 116.664 2.105 1 1 1612 . 3 1 1 A 150 150 GLY H H 1918 8.673 8.755 -0.082 1 1 1613 . 3 1 1 A 150 150 GLY HA2 H 1918 4.358 3.935 0.423 1 1 1614 . 3 1 1 A 150 150 GLY HA3 H 1918 3.700 3.937 -0.237 1 1 1615 . 3 1 1 A 150 150 GLY CA C 1918 45.319 45.826 -0.507 1 1 1616 . 3 1 1 A 150 150 GLY N N 1918 110.464 107.039 3.425 1 1 1617 . 3 1 1 A 151 151 THR H H 1919 8.154 7.568 0.586 1 1 1618 . 3 1 1 A 151 151 THR HA H 1919 4.109 5.035 -0.926 1 1 1623 . 3 1 1 A 151 151 THR CA C 1919 60.041 59.581 0.460 1 1 1624 . 3 1 1 A 151 151 THR CB C 1919 73.422 72.730 0.692 1 1 1626 . 3 1 1 A 151 151 THR N N 1919 111.043 109.572 1.471 1 1 1627 . 3 1 1 A 152 152 CYS H H 1920 9.088 9.368 -0.280 1 1 1628 . 3 1 1 A 152 152 CYS HA H 1920 5.362 5.499 -0.137 1 1 1631 . 3 1 1 A 152 152 CYS CA C 1920 56.990 57.101 -0.111 1 1 1632 . 3 1 1 A 152 152 CYS CB C 1920 30.740 29.675 1.065 1 1 1633 . 3 1 1 A 152 152 CYS N N 1920 118.508 121.179 -2.671 1 1 1634 . 3 1 1 A 153 153 SER H H 1921 9.102 8.877 0.225 1 1 1635 . 3 1 1 A 153 153 SER HA H 1921 4.865 4.897 -0.032 1 1 1638 . 3 1 1 A 153 153 SER CA C 1921 58.023 57.441 0.582 1 1 1639 . 3 1 1 A 153 153 SER CB C 1921 64.133 64.448 -0.315 1 1 1640 . 3 1 1 A 153 153 SER N N 1921 122.048 119.913 2.135 1 1 1641 . 3 1 1 A 154 154 VAL H H 1922 8.983 8.682 0.301 1 1 1642 . 3 1 1 A 154 154 VAL HA H 1922 4.608 4.761 -0.153 1 1 1650 . 3 1 1 A 154 154 VAL CA C 1922 60.575 59.731 0.844 1 1 1651 . 3 1 1 A 154 154 VAL CB C 1922 32.710 34.877 -2.167 1 1 1654 . 3 1 1 A 154 154 VAL N N 1922 130.262 125.016 5.246 1 1 1655 . 3 1 1 A 155 155 SER H H 1923 8.737 8.734 0.003 1 1 1656 . 3 1 1 A 155 155 SER HA H 1923 5.680 5.549 0.131 1 1 1659 . 3 1 1 A 155 155 SER CA C 1923 55.991 56.753 -0.762 1 1 1660 . 3 1 1 A 155 155 SER CB C 1923 66.306 65.934 0.372 1 1 1661 . 3 1 1 A 155 155 SER N N 1923 121.504 122.965 -1.461 1 1 1662 . 3 1 1 A 156 156 TYR H H 1924 9.061 9.020 0.041 1 1 1663 . 3 1 1 A 156 156 TYR HA H 1924 5.790 5.599 0.191 1 1 1671 . 3 1 1 A 156 156 TYR CA C 1924 55.118 55.834 -0.716 1 1 1672 . 3 1 1 A 156 156 TYR CB C 1924 42.344 41.826 0.518 1 1 1675 . 3 1 1 A 156 156 TYR N N 1924 121.858 120.675 1.183 1 1 1676 . 3 1 1 A 157 157 LEU H H 1925 7.505 9.310 -1.805 1 1 1677 . 3 1 1 A 157 157 LEU HA H 1925 4.996 4.736 0.260 1 1 1687 . 3 1 1 A 157 157 LEU CA C 1925 50.476 51.134 -0.658 1 1 1688 . 3 1 1 A 157 157 LEU CB C 1925 43.334 43.364 -0.030 1 1 1692 . 3 1 1 A 157 157 LEU N N 1925 123.272 121.396 1.876 1 1 1693 . 3 1 1 A 158 158 PRO HA H 1926 4.691 4.964 -0.273 1 1 1700 . 3 1 1 A 158 158 PRO CA C 1926 61.808 62.347 -0.539 1 1 1701 . 3 1 1 A 158 158 PRO CB C 1926 32.551 33.302 -0.751 1 1 1704 . 3 1 1 A 159 159 VAL H H 1927 8.388 8.570 -0.182 1 1 1705 . 3 1 1 A 159 159 VAL HA H 1927 4.510 4.309 0.201 1 1 1713 . 3 1 1 A 159 159 VAL CA C 1927 61.778 62.486 -0.708 1 1 1714 . 3 1 1 A 159 159 VAL CB C 1927 32.432 35.451 -3.019 1 1 1717 . 3 1 1 A 159 159 VAL N N 1927 115.680 120.319 -4.639 1 1 1718 . 3 1 1 A 160 160 LEU H H 1928 6.931 7.777 -0.846 1 1 1719 . 3 1 1 A 160 160 LEU HA H 1928 4.931 4.677 0.254 1 1 1729 . 3 1 1 A 160 160 LEU CA C 1928 51.971 51.943 0.028 1 1 1730 . 3 1 1 A 160 160 LEU CB C 1928 45.905 42.773 3.132 1 1 1734 . 3 1 1 A 160 160 LEU N N 1928 120.258 123.791 -3.533 1 1 1735 . 3 1 1 A 161 161 PRO HA H 1929 4.317 4.841 -0.524 1 1 1742 . 3 1 1 A 161 161 PRO CA C 1929 62.809 62.949 -0.140 1 1 1743 . 3 1 1 A 161 161 PRO CB C 1929 32.662 33.132 -0.470 1 1 1746 . 3 1 1 A 162 162 GLY H H 1930 8.916 8.212 0.704 1 1 1747 . 3 1 1 A 162 162 GLY HA2 H 1930 4.461 4.149 0.312 1 1 1748 . 3 1 1 A 162 162 GLY HA3 H 1930 3.852 4.168 -0.316 1 1 1749 . 3 1 1 A 162 162 GLY CA C 1930 44.496 44.424 0.072 1 1 1750 . 3 1 1 A 162 162 GLY N N 1930 107.609 107.411 0.198 1 1 1751 . 3 1 1 A 163 163 ASP H H 1931 8.245 8.369 -0.124 1 1 1752 . 3 1 1 A 163 163 ASP HA H 1931 5.565 5.545 0.020 1 1 1755 . 3 1 1 A 163 163 ASP CA C 1931 53.628 52.967 0.661 1 1 1756 . 3 1 1 A 163 163 ASP CB C 1931 41.058 43.140 -2.082 1 1 1757 . 3 1 1 A 163 163 ASP N N 1931 121.979 121.311 0.668 1 1 1758 . 3 1 1 A 164 164 TYR H H 1932 9.606 9.667 -0.061 1 1 1759 . 3 1 1 A 164 164 TYR HA H 1932 4.896 5.244 -0.348 1 1 1767 . 3 1 1 A 164 164 TYR CA C 1932 56.955 56.248 0.707 1 1 1768 . 3 1 1 A 164 164 TYR CB C 1932 40.339 41.248 -0.909 1 1 1771 . 3 1 1 A 164 164 TYR N N 1932 125.257 122.366 2.891 1 1 1772 . 3 1 1 A 165 165 SER H H 1933 9.095 9.367 -0.272 1 1 1773 . 3 1 1 A 165 165 SER HA H 1933 5.500 5.098 0.402 1 1 1776 . 3 1 1 A 165 165 SER CA C 1933 56.509 58.140 -1.631 1 1 1777 . 3 1 1 A 165 165 SER CB C 1933 64.486 63.742 0.744 1 1 1778 . 3 1 1 A 165 165 SER N N 1933 119.162 120.300 -1.138 1 1 1779 . 3 1 1 A 166 166 ILE H H 1934 9.598 9.413 0.185 1 1 1780 . 3 1 1 A 166 166 ILE HA H 1934 4.541 4.640 -0.099 1 1 1790 . 3 1 1 A 166 166 ILE CA C 1934 61.080 60.483 0.597 1 1 1791 . 3 1 1 A 166 166 ILE CB C 1934 39.282 38.226 1.056 1 1 1795 . 3 1 1 A 166 166 ILE N N 1934 128.701 127.919 0.782 1 1 1796 . 3 1 1 A 167 167 LEU H H 1935 9.359 9.296 0.063 1 1 1797 . 3 1 1 A 167 167 LEU HA H 1935 4.779 5.029 -0.250 1 1 1807 . 3 1 1 A 167 167 LEU CA C 1935 55.921 53.316 2.605 1 1 1808 . 3 1 1 A 167 167 LEU CB C 1935 42.473 44.632 -2.159 1 1 1811 . 3 1 1 A 167 167 LEU N N 1935 131.315 130.269 1.046 1 1 1812 . 3 1 1 A 168 168 VAL H H 1936 9.425 8.736 0.689 1 1 1813 . 3 1 1 A 168 168 VAL HA H 1936 4.617 4.900 -0.283 1 1 1821 . 3 1 1 A 168 168 VAL CA C 1936 61.418 60.835 0.583 1 1 1822 . 3 1 1 A 168 168 VAL CB C 1936 33.616 34.825 -1.209 1 1 1824 . 3 1 1 A 168 168 VAL N N 1936 126.961 126.121 0.840 1 1 1825 . 3 1 1 A 169 169 LYS H H 1937 8.643 8.167 0.476 1 1 1826 . 3 1 1 A 169 169 LYS HA H 1937 5.067 4.764 0.303 1 1 1835 . 3 1 1 A 169 169 LYS CA C 1937 53.949 55.671 -1.722 1 1 1836 . 3 1 1 A 169 169 LYS CB C 1937 36.691 36.379 0.312 1 1 1840 . 3 1 1 A 169 169 LYS N N 1937 124.773 126.996 -2.223 1 1 1841 . 3 1 1 A 170 170 TYR H H 1938 8.877 9.308 -0.431 1 1 1842 . 3 1 1 A 170 170 TYR HA H 1938 5.137 5.012 0.125 1 1 1849 . 3 1 1 A 170 170 TYR CA C 1938 57.034 57.641 -0.607 1 1 1850 . 3 1 1 A 170 170 TYR CB C 1938 42.105 41.945 0.160 1 1 1853 . 3 1 1 A 170 170 TYR N N 1938 122.371 127.015 -4.644 1 1 1854 . 3 1 1 A 171 171 ASN H H 1939 8.933 9.762 -0.829 1 1 1855 . 3 1 1 A 171 171 ASN HA H 1939 4.405 4.502 -0.097 1 1 1860 . 3 1 1 A 171 171 ASN CA C 1939 54.512 54.283 0.229 1 1 1861 . 3 1 1 A 171 171 ASN CB C 1939 37.025 37.313 -0.288 1 1 1862 . 3 1 1 A 171 171 ASN N N 1939 129.922 126.545 3.377 1 1 1864 . 3 1 1 A 172 172 GLU H H 1940 8.857 8.796 0.061 1 1 1865 . 3 1 1 A 172 172 GLU HA H 1940 3.511 4.076 -0.565 1 1 1870 . 3 1 1 A 172 172 GLU CA C 1940 57.910 57.643 0.267 1 1 1871 . 3 1 1 A 172 172 GLU CB C 1940 27.139 27.480 -0.341 1 1 1873 . 3 1 1 A 172 172 GLU N N 1940 107.943 116.232 -8.289 1 1 1874 . 3 1 1 A 173 173 GLN H H 1941 7.544 7.596 -0.052 1 1 1875 . 3 1 1 A 173 173 GLN HA H 1941 4.749 4.840 -0.091 1 1 1882 . 3 1 1 A 173 173 GLN CA C 1941 53.770 54.269 -0.499 1 1 1883 . 3 1 1 A 173 173 GLN CB C 1941 31.078 31.197 -0.119 1 1 1885 . 3 1 1 A 173 173 GLN N N 1941 119.865 120.276 -0.411 1 1 1887 . 3 1 1 A 174 174 HIS H H 1942 8.848 8.855 -0.007 1 1 1888 . 3 1 1 A 174 174 HIS HA H 1942 4.513 4.745 -0.232 1 1 1893 . 3 1 1 A 174 174 HIS CA C 1942 58.893 56.793 2.100 1 1 1894 . 3 1 1 A 174 174 HIS CB C 1942 32.196 30.407 1.789 1 1 1897 . 3 1 1 A 174 174 HIS N N 1942 126.437 121.968 4.469 1 1 1898 . 3 1 1 A 175 175 VAL H H 1943 8.483 8.046 0.437 1 1 1899 . 3 1 1 A 175 175 VAL HA H 1943 4.643 4.471 0.172 1 1 1907 . 3 1 1 A 175 175 VAL CA C 1943 60.025 60.645 -0.620 1 1 1908 . 3 1 1 A 175 175 VAL CB C 1943 29.439 32.376 -2.937 1 1 1911 . 3 1 1 A 175 175 VAL N N 1943 121.671 119.944 1.727 1 1 1912 . 3 1 1 A 176 176 PRO HA H 1944 4.045 4.230 -0.185 1 1 1919 . 3 1 1 A 176 176 PRO CA C 1944 64.943 64.106 0.837 1 1 1920 . 3 1 1 A 176 176 PRO CB C 1944 31.120 31.466 -0.346 1 1 1923 . 3 1 1 A 177 177 GLY H H 1945 7.579 8.823 -1.244 1 1 1924 . 3 1 1 A 177 177 GLY HA2 H 1945 3.210 3.651 -0.441 1 1 1925 . 3 1 1 A 177 177 GLY HA3 H 1945 2.311 3.925 -1.614 1 1 1926 . 3 1 1 A 177 177 GLY CA C 1945 44.184 44.893 -0.709 1 1 1927 . 3 1 1 A 177 177 GLY N N 1945 113.696 113.238 0.458 1 1 1928 . 3 1 1 A 178 178 SER H H 1946 7.469 7.563 -0.094 1 1 1929 . 3 1 1 A 178 178 SER HA H 1946 4.023 3.211 0.812 1 1 1932 . 3 1 1 A 178 178 SER CA C 1946 54.593 56.247 -1.654 1 1 1933 . 3 1 1 A 178 178 SER CB C 1946 62.282 63.800 -1.518 1 1 1934 . 3 1 1 A 178 178 SER N N 1946 113.219 115.505 -2.286 1 1 1935 . 3 1 1 A 179 179 PRO HA H 1947 5.314 4.490 0.824 1 1 1942 . 3 1 1 A 179 179 PRO CA C 1947 62.198 62.231 -0.033 1 1 1943 . 3 1 1 A 179 179 PRO CB C 1947 33.923 32.107 1.816 1 1 1946 . 3 1 1 A 180 180 PHE H H 1948 9.395 8.482 0.913 1 1 1947 . 3 1 1 A 180 180 PHE HA H 1948 4.706 5.160 -0.454 1 1 1955 . 3 1 1 A 180 180 PHE CA C 1948 57.298 56.562 0.736 1 1 1956 . 3 1 1 A 180 180 PHE CB C 1948 41.116 41.959 -0.843 1 1 1960 . 3 1 1 A 180 180 PHE N N 1948 127.510 118.173 9.337 1 1 1961 . 3 1 1 A 181 181 THR H H 1949 9.111 9.089 0.022 1 1 1962 . 3 1 1 A 181 181 THR HA H 1949 5.091 4.908 0.183 1 1 1967 . 3 1 1 A 181 181 THR CA C 1949 62.668 62.204 0.464 1 1 1968 . 3 1 1 A 181 181 THR CB C 1949 70.354 69.624 0.730 1 1 1970 . 3 1 1 A 181 181 THR N N 1949 120.325 118.562 1.763 1 1 1971 . 3 1 1 A 182 182 ALA H H 1950 8.992 9.454 -0.462 1 1 1972 . 3 1 1 A 182 182 ALA HA H 1950 4.521 5.518 -0.997 1 1 1976 . 3 1 1 A 182 182 ALA CA C 1950 50.080 50.410 -0.330 1 1 1977 . 3 1 1 A 182 182 ALA CB C 1950 21.717 20.576 1.141 1 1 1978 . 3 1 1 A 182 182 ALA N N 1950 130.794 130.430 0.364 1 1 1979 . 3 1 1 A 183 183 ARG H H 1951 7.764 8.577 -0.813 1 1 1980 . 3 1 1 A 183 183 ARG HA H 1951 5.001 4.991 0.010 1 1 1988 . 3 1 1 A 183 183 ARG CA C 1951 55.116 55.190 -0.074 1 1 1989 . 3 1 1 A 183 183 ARG CB C 1951 30.631 32.046 -1.415 1 1 1992 . 3 1 1 A 183 183 ARG N N 1951 121.920 124.214 -2.294 1 1 1994 . 3 1 1 A 184 184 VAL H H 1952 9.121 9.576 -0.455 1 1 1995 . 3 1 1 A 184 184 VAL HA H 1952 4.865 4.765 0.100 1 1 2003 . 3 1 1 A 184 184 VAL CA C 1952 60.375 61.238 -0.863 1 1 2004 . 3 1 1 A 184 184 VAL CB C 1952 32.179 33.803 -1.624 1 1 2007 . 3 1 1 A 184 184 VAL N N 1952 125.421 126.896 -1.475 1 1 2008 . 3 1 1 A 185 185 THR H H 1953 8.799 8.602 0.197 1 1 2009 . 3 1 1 A 185 185 THR HA H 1953 4.829 5.050 -0.221 1 1 2014 . 3 1 1 A 185 185 THR CA C 1953 60.316 60.071 0.245 1 1 2015 . 3 1 1 A 185 185 THR CB C 1953 70.825 70.602 0.223 1 1 2017 . 3 1 1 A 185 185 THR N N 1953 121.794 118.420 3.374 1 1 2018 . 3 1 1 A 186 186 GLY H H 1954 8.586 8.748 -0.162 1 1 2019 . 3 1 1 A 186 186 GLY HA2 H 1954 4.261 3.978 0.283 1 1 2020 . 3 1 1 A 186 186 GLY HA3 H 1954 4.033 3.984 0.049 1 1 2021 . 3 1 1 A 186 186 GLY CA C 1954 45.038 47.095 -2.057 1 1 2022 . 3 1 1 A 186 186 GLY N N 1954 107.588 109.439 -1.851 1 1 2023 . 3 1 1 A 187 187 ASP H H 1955 8.386 7.664 0.722 1 1 2024 . 3 1 1 A 187 187 ASP HA H 1955 4.772 4.463 0.309 1 1 2027 . 3 1 1 A 187 187 ASP CA C 1955 53.909 56.722 -2.813 1 1 2028 . 3 1 1 A 187 187 ASP CB C 1955 41.510 41.123 0.387 1 1 2029 . 3 1 1 A 187 187 ASP N N 1955 121.829 122.072 -0.243 1 1 4 . 4 1 1 A 2 2 ALA HA H -2 4.368 4.353 0.015 1 1 8 . 4 1 1 A 2 2 ALA CA C -2 52.604 51.720 0.884 1 1 9 . 4 1 1 A 2 2 ALA CB C -2 19.551 19.599 -0.048 1 1 32 . 4 1 1 A 5 5 PRO HA H 1773 4.433 4.601 -0.168 1 1 39 . 4 1 1 A 5 5 PRO CA C 1773 63.017 62.380 0.637 1 1 40 . 4 1 1 A 5 5 PRO CB C 1773 32.155 33.353 -1.198 1 1 43 . 4 1 1 A 6 6 GLU H H 1774 8.495 8.755 -0.260 1 1 44 . 4 1 1 A 6 6 GLU HA H 1774 4.242 5.026 -0.784 1 1 49 . 4 1 1 A 6 6 GLU CA C 1774 56.735 54.575 2.160 1 1 50 . 4 1 1 A 6 6 GLU CB C 1774 30.401 33.530 -3.129 1 1 52 . 4 1 1 A 6 6 GLU N N 1774 122.494 117.589 4.905 1 1 53 . 4 1 1 A 7 7 ARG H H 1775 8.275 8.329 -0.054 1 1 54 . 4 1 1 A 7 7 ARG HA H 1775 4.648 4.684 -0.036 1 1 61 . 4 1 1 A 7 7 ARG CA C 1775 53.827 54.135 -0.308 1 1 62 . 4 1 1 A 7 7 ARG CB C 1775 30.417 29.784 0.633 1 1 65 . 4 1 1 A 7 7 ARG N N 1775 124.017 122.594 1.423 1 1 66 . 4 1 1 A 8 8 PRO HA H 1776 4.433 4.753 -0.320 1 1 73 . 4 1 1 A 8 8 PRO CA C 1776 63.036 62.418 0.618 1 1 74 . 4 1 1 A 8 8 PRO CB C 1776 32.201 33.001 -0.800 1 1 77 . 4 1 1 A 9 9 LEU H H 1777 8.349 8.469 -0.120 1 1 78 . 4 1 1 A 9 9 LEU HA H 1777 4.365 5.058 -0.693 1 1 88 . 4 1 1 A 9 9 LEU CA C 1777 55.275 53.005 2.270 1 1 89 . 4 1 1 A 9 9 LEU CB C 1777 42.376 46.280 -3.904 1 1 93 . 4 1 1 A 9 9 LEU N N 1777 123.820 117.920 5.900 1 1 94 . 4 1 1 A 10 10 VAL H H 1778 7.989 8.670 -0.681 1 1 95 . 4 1 1 A 10 10 VAL HA H 1778 4.182 4.348 -0.166 1 1 103 . 4 1 1 A 10 10 VAL CA C 1778 62.141 60.868 1.273 1 1 104 . 4 1 1 A 10 10 VAL CB C 1778 33.175 34.549 -1.374 1 1 106 . 4 1 1 A 10 10 VAL N N 1778 121.714 118.359 3.355 1 1 107 . 4 1 1 A 11 11 GLY H H 1779 8.450 8.773 -0.323 1 1 108 . 4 1 1 A 11 11 GLY HA2 H 1779 4.002 3.818 0.184 1 1 109 . 4 1 1 A 11 11 GLY HA3 H 1779 4.002 3.819 0.183 1 1 110 . 4 1 1 A 11 11 GLY CA C 1779 45.297 46.703 -1.406 1 1 111 . 4 1 1 A 11 11 GLY N N 1779 113.826 115.578 -1.752 1 1 112 . 4 1 1 A 12 12 VAL H H 1780 8.013 7.895 0.118 1 1 113 . 4 1 1 A 12 12 VAL HA H 1780 4.136 4.101 0.035 1 1 121 . 4 1 1 A 12 12 VAL CA C 1780 62.466 61.957 0.509 1 1 122 . 4 1 1 A 12 12 VAL CB C 1780 32.752 32.781 -0.029 1 1 125 . 4 1 1 A 12 12 VAL N N 1780 120.109 119.449 0.660 1 1 126 . 4 1 1 A 13 13 ASN H H 1781 8.528 8.733 -0.205 1 1 127 . 4 1 1 A 13 13 ASN HA H 1781 4.712 4.544 0.168 1 1 132 . 4 1 1 A 13 13 ASN CA C 1781 53.485 55.358 -1.873 1 1 133 . 4 1 1 A 13 13 ASN CB C 1781 38.996 38.506 0.490 1 1 134 . 4 1 1 A 13 13 ASN N N 1781 122.648 120.837 1.811 1 1 136 . 4 1 1 A 14 14 GLY H H 1782 8.283 7.753 0.530 1 1 137 . 4 1 1 A 14 14 GLY HA2 H 1782 3.929 4.068 -0.139 1 1 138 . 4 1 1 A 14 14 GLY HA3 H 1782 3.929 4.070 -0.141 1 1 139 . 4 1 1 A 14 14 GLY CA C 1782 45.531 44.716 0.815 1 1 140 . 4 1 1 A 14 14 GLY N N 1782 110.229 108.087 2.142 1 1 141 . 4 1 1 A 15 15 LEU H H 1783 7.925 8.587 -0.662 1 1 142 . 4 1 1 A 15 15 LEU HA H 1783 4.340 4.402 -0.062 1 1 152 . 4 1 1 A 15 15 LEU CA C 1783 55.045 55.269 -0.224 1 1 153 . 4 1 1 A 15 15 LEU CB C 1783 42.682 42.407 0.275 1 1 157 . 4 1 1 A 15 15 LEU N N 1783 122.626 120.991 1.635 1 1 158 . 4 1 1 A 16 16 ASP H H 1784 8.360 8.951 -0.591 1 1 159 . 4 1 1 A 16 16 ASP HA H 1784 4.747 4.728 0.019 1 1 162 . 4 1 1 A 16 16 ASP CA C 1784 53.939 55.723 -1.784 1 1 163 . 4 1 1 A 16 16 ASP CB C 1784 41.150 43.488 -2.338 1 1 164 . 4 1 1 A 16 16 ASP N N 1784 122.868 122.356 0.512 1 1 165 . 4 1 1 A 17 17 VAL H H 1785 8.201 7.859 0.342 1 1 166 . 4 1 1 A 17 17 VAL HA H 1785 4.237 4.677 -0.440 1 1 174 . 4 1 1 A 17 17 VAL CA C 1785 62.881 59.583 3.298 1 1 175 . 4 1 1 A 17 17 VAL CB C 1785 31.967 34.881 -2.914 1 1 178 . 4 1 1 A 17 17 VAL N N 1785 121.110 113.610 7.500 1 1 179 . 4 1 1 A 18 18 THR H H 1786 8.291 8.799 -0.508 1 1 180 . 4 1 1 A 18 18 THR HA H 1786 4.466 4.697 -0.231 1 1 185 . 4 1 1 A 18 18 THR CA C 1786 62.388 62.893 -0.505 1 1 186 . 4 1 1 A 18 18 THR CB C 1786 69.719 71.940 -2.221 1 1 188 . 4 1 1 A 18 18 THR N N 1786 115.267 118.964 -3.697 1 1 189 . 4 1 1 A 19 19 SER H H 1787 8.148 8.181 -0.033 1 1 190 . 4 1 1 A 19 19 SER HA H 1787 4.542 4.485 0.057 1 1 193 . 4 1 1 A 19 19 SER CA C 1787 59.096 58.791 0.305 1 1 194 . 4 1 1 A 19 19 SER CB C 1787 63.993 61.875 2.118 1 1 195 . 4 1 1 A 19 19 SER N N 1787 118.576 117.253 1.323 1 1 196 . 4 1 1 A 20 20 LEU H H 1788 8.263 7.915 0.348 1 1 197 . 4 1 1 A 20 20 LEU HA H 1788 4.243 4.022 0.221 1 1 207 . 4 1 1 A 20 20 LEU CA C 1788 54.087 55.404 -1.317 1 1 208 . 4 1 1 A 20 20 LEU CB C 1788 43.006 41.972 1.034 1 1 212 . 4 1 1 A 20 20 LEU N N 1788 125.834 126.408 -0.574 1 1 213 . 4 1 1 A 21 21 ARG H H 1789 8.191 8.558 -0.367 1 1 214 . 4 1 1 A 21 21 ARG HA H 1789 4.080 4.303 -0.223 1 1 222 . 4 1 1 A 21 21 ARG CA C 1789 54.894 54.150 0.744 1 1 223 . 4 1 1 A 21 21 ARG CB C 1789 30.881 30.523 0.358 1 1 226 . 4 1 1 A 21 21 ARG N N 1789 127.213 123.712 3.501 1 1 228 . 4 1 1 A 22 22 PRO HA H 1790 4.441 4.638 -0.197 1 1 233 . 4 1 1 A 22 22 PRO CA C 1790 62.882 62.754 0.128 1 1 234 . 4 1 1 A 22 22 PRO CB C 1790 32.204 32.710 -0.506 1 1 237 . 4 1 1 A 23 23 PHE H H 1791 8.336 8.204 0.132 1 1 238 . 4 1 1 A 23 23 PHE HA H 1791 4.701 4.789 -0.088 1 1 246 . 4 1 1 A 23 23 PHE CA C 1791 57.504 57.463 0.041 1 1 247 . 4 1 1 A 23 23 PHE CB C 1791 42.192 40.461 1.731 1 1 251 . 4 1 1 A 23 23 PHE N N 1791 122.145 122.929 -0.784 1 1 252 . 4 1 1 A 24 24 ASP H H 1792 6.954 9.067 -2.113 1 1 253 . 4 1 1 A 24 24 ASP HA H 1792 5.039 5.355 -0.316 1 1 256 . 4 1 1 A 24 24 ASP CA C 1792 52.871 52.272 0.599 1 1 257 . 4 1 1 A 24 24 ASP CB C 1792 44.696 44.452 0.244 1 1 258 . 4 1 1 A 24 24 ASP N N 1792 127.481 126.143 1.338 1 1 259 . 4 1 1 A 25 25 LEU H H 1793 8.372 8.680 -0.308 1 1 260 . 4 1 1 A 25 25 LEU HA H 1793 4.336 4.995 -0.659 1 1 270 . 4 1 1 A 25 25 LEU CA C 1793 54.860 53.312 1.548 1 1 271 . 4 1 1 A 25 25 LEU CB C 1793 47.575 46.385 1.190 1 1 274 . 4 1 1 A 25 25 LEU N N 1793 123.241 121.777 1.464 1 1 275 . 4 1 1 A 26 26 VAL H H 1794 8.489 8.937 -0.448 1 1 276 . 4 1 1 A 26 26 VAL HA H 1794 4.903 5.130 -0.227 1 1 284 . 4 1 1 A 26 26 VAL CA C 1794 61.669 59.549 2.120 1 1 285 . 4 1 1 A 26 26 VAL CB C 1794 32.458 35.153 -2.695 1 1 288 . 4 1 1 A 26 26 VAL N N 1794 128.849 121.258 7.591 1 1 289 . 4 1 1 A 27 27 ILE H H 1795 9.101 9.245 -0.144 1 1 290 . 4 1 1 A 27 27 ILE HA H 1795 4.701 4.561 0.140 1 1 300 . 4 1 1 A 27 27 ILE CA C 1795 57.433 57.511 -0.078 1 1 301 . 4 1 1 A 27 27 ILE CB C 1795 41.865 41.553 0.312 1 1 305 . 4 1 1 A 27 27 ILE N N 1795 127.511 128.171 -0.660 1 1 306 . 4 1 1 A 28 28 PRO HA H 1796 4.838 4.845 -0.007 1 1 313 . 4 1 1 A 28 28 PRO CA C 1796 62.406 62.698 -0.292 1 1 314 . 4 1 1 A 28 28 PRO CB C 1796 30.684 31.572 -0.888 1 1 317 . 4 1 1 A 29 29 PHE H H 1797 8.255 8.387 -0.132 1 1 318 . 4 1 1 A 29 29 PHE HA H 1797 4.151 4.906 -0.755 1 1 326 . 4 1 1 A 29 29 PHE CA C 1797 60.405 58.115 2.290 1 1 327 . 4 1 1 A 29 29 PHE CB C 1797 41.395 42.146 -0.751 1 1 331 . 4 1 1 A 29 29 PHE N N 1797 128.572 122.705 5.867 1 1 332 . 4 1 1 A 30 30 THR H H 1798 7.433 7.710 -0.277 1 1 333 . 4 1 1 A 30 30 THR HA H 1798 4.108 4.959 -0.851 1 1 338 . 4 1 1 A 30 30 THR CA C 1798 61.473 61.078 0.395 1 1 339 . 4 1 1 A 30 30 THR CB C 1798 69.324 71.582 -2.258 1 1 341 . 4 1 1 A 30 30 THR N N 1798 123.124 118.347 4.777 1 1 342 . 4 1 1 A 31 31 ILE H H 1799 8.402 9.150 -0.748 1 1 343 . 4 1 1 A 31 31 ILE HA H 1799 3.653 4.306 -0.653 1 1 353 . 4 1 1 A 31 31 ILE CA C 1799 61.802 61.603 0.199 1 1 354 . 4 1 1 A 31 31 ILE CB C 1799 38.548 37.294 1.254 1 1 358 . 4 1 1 A 31 31 ILE N N 1799 128.616 128.032 0.584 1 1 359 . 4 1 1 A 32 32 LYS H H 1800 7.742 8.601 -0.859 1 1 360 . 4 1 1 A 32 32 LYS HA H 1800 4.558 4.327 0.231 1 1 365 . 4 1 1 A 32 32 LYS CA C 1800 56.566 54.342 2.224 1 1 366 . 4 1 1 A 32 32 LYS CB C 1800 31.982 34.085 -2.103 1 1 368 . 4 1 1 A 32 32 LYS N N 1800 128.656 128.761 -0.105 1 1 369 . 4 1 1 A 33 33 LYS HA H 1801 4.531 4.488 0.043 1 1 378 . 4 1 1 A 33 33 LYS CA C 1801 56.310 57.708 -1.398 1 1 379 . 4 1 1 A 33 33 LYS CB C 1801 33.027 33.098 -0.071 1 1 383 . 4 1 1 A 34 34 GLY H H 1802 8.088 8.559 -0.471 1 1 384 . 4 1 1 A 34 34 GLY HA2 H 1802 4.159 4.139 0.020 1 1 385 . 4 1 1 A 34 34 GLY HA3 H 1802 3.712 4.227 -0.515 1 1 386 . 4 1 1 A 34 34 GLY CA C 1802 45.302 44.550 0.752 1 1 387 . 4 1 1 A 34 34 GLY N N 1802 110.338 112.984 -2.646 1 1 388 . 4 1 1 A 35 35 GLU H H 1803 8.219 8.044 0.175 1 1 389 . 4 1 1 A 35 35 GLU HA H 1803 4.692 4.929 -0.237 1 1 394 . 4 1 1 A 35 35 GLU CA C 1803 55.160 55.246 -0.086 1 1 395 . 4 1 1 A 35 35 GLU CB C 1803 32.407 33.937 -1.530 1 1 397 . 4 1 1 A 35 35 GLU N N 1803 119.576 120.086 -0.510 1 1 398 . 4 1 1 A 36 36 ILE H H 1804 8.869 8.819 0.050 1 1 399 . 4 1 1 A 36 36 ILE HA H 1804 5.468 5.174 0.294 1 1 409 . 4 1 1 A 36 36 ILE CA C 1804 58.861 58.746 0.115 1 1 410 . 4 1 1 A 36 36 ILE CB C 1804 41.007 41.814 -0.807 1 1 414 . 4 1 1 A 36 36 ILE N N 1804 128.141 123.934 4.207 1 1 415 . 4 1 1 A 37 37 THR H H 1805 9.075 8.855 0.220 1 1 416 . 4 1 1 A 37 37 THR HA H 1805 4.703 5.125 -0.422 1 1 421 . 4 1 1 A 37 37 THR CA C 1805 59.932 60.002 -0.070 1 1 422 . 4 1 1 A 37 37 THR CB C 1805 72.441 72.560 -0.119 1 1 424 . 4 1 1 A 37 37 THR N N 1805 119.846 117.234 2.612 1 1 425 . 4 1 1 A 38 38 GLY H H 1806 8.468 8.412 0.056 1 1 426 . 4 1 1 A 38 38 GLY HA2 H 1806 5.076 4.278 0.798 1 1 427 . 4 1 1 A 38 38 GLY HA3 H 1806 3.503 4.283 -0.780 1 1 428 . 4 1 1 A 38 38 GLY CA C 1806 45.593 45.783 -0.190 1 1 429 . 4 1 1 A 38 38 GLY N N 1806 107.815 108.625 -0.810 1 1 430 . 4 1 1 A 39 39 GLU H H 1807 8.519 8.676 -0.157 1 1 431 . 4 1 1 A 39 39 GLU HA H 1807 4.713 5.148 -0.435 1 1 436 . 4 1 1 A 39 39 GLU CA C 1807 56.936 55.534 1.402 1 1 437 . 4 1 1 A 39 39 GLU CB C 1807 34.937 33.871 1.066 1 1 439 . 4 1 1 A 39 39 GLU N N 1807 120.173 119.730 0.443 1 1 440 . 4 1 1 A 40 40 VAL H H 1808 9.156 9.399 -0.243 1 1 441 . 4 1 1 A 40 40 VAL HA H 1808 4.778 4.725 0.053 1 1 449 . 4 1 1 A 40 40 VAL CA C 1808 60.574 61.159 -0.585 1 1 450 . 4 1 1 A 40 40 VAL CB C 1808 34.168 32.830 1.338 1 1 452 . 4 1 1 A 40 40 VAL N N 1808 126.330 127.688 -1.358 1 1 453 . 4 1 1 A 41 41 ARG H H 1809 9.044 9.149 -0.105 1 1 454 . 4 1 1 A 41 41 ARG HA H 1809 4.778 4.983 -0.205 1 1 462 . 4 1 1 A 41 41 ARG CA C 1809 55.317 54.207 1.110 1 1 463 . 4 1 1 A 41 41 ARG CB C 1809 31.940 33.273 -1.333 1 1 466 . 4 1 1 A 41 41 ARG N N 1809 127.098 126.262 0.836 1 1 468 . 4 1 1 A 42 42 MET H H 1810 8.264 8.830 -0.566 1 1 469 . 4 1 1 A 42 42 MET HA H 1810 4.050 4.451 -0.401 1 1 477 . 4 1 1 A 42 42 MET CA C 1810 53.716 53.441 0.275 1 1 478 . 4 1 1 A 42 42 MET CB C 1810 32.779 33.538 -0.759 1 1 481 . 4 1 1 A 42 42 MET N N 1810 123.461 123.252 0.209 1 1 482 . 4 1 1 A 43 43 PRO HA H 1811 4.179 4.154 0.025 1 1 489 . 4 1 1 A 43 43 PRO CA C 1811 66.422 64.730 1.692 1 1 490 . 4 1 1 A 43 43 PRO CB C 1811 31.462 31.721 -0.259 1 1 493 . 4 1 1 A 44 44 SER H H 1812 8.860 7.795 1.065 1 1 494 . 4 1 1 A 44 44 SER HA H 1812 5.516 4.154 1.362 1 1 497 . 4 1 1 A 44 44 SER CA C 1812 59.937 58.790 1.147 1 1 498 . 4 1 1 A 44 44 SER CB C 1812 62.755 63.590 -0.835 1 1 499 . 4 1 1 A 44 44 SER N N 1812 112.267 110.164 2.103 1 1 500 . 4 1 1 A 45 45 GLY H H 1813 8.368 8.073 0.295 1 1 501 . 4 1 1 A 45 45 GLY HA2 H 1813 4.461 3.883 0.578 1 1 502 . 4 1 1 A 45 45 GLY HA3 H 1813 3.569 3.891 -0.322 1 1 503 . 4 1 1 A 45 45 GLY CA C 1813 44.525 45.085 -0.560 1 1 504 . 4 1 1 A 45 45 GLY N N 1813 112.727 111.066 1.661 1 1 505 . 4 1 1 A 46 46 LYS H H 1814 7.126 7.736 -0.610 1 1 506 . 4 1 1 A 46 46 LYS HA H 1814 4.206 4.323 -0.117 1 1 515 . 4 1 1 A 46 46 LYS CA C 1814 57.460 56.561 0.899 1 1 516 . 4 1 1 A 46 46 LYS CB C 1814 33.453 33.754 -0.301 1 1 520 . 4 1 1 A 46 46 LYS N N 1814 122.101 120.655 1.446 1 1 521 . 4 1 1 A 47 47 VAL H H 1815 8.056 8.917 -0.861 1 1 522 . 4 1 1 A 47 47 VAL HA H 1815 5.400 5.131 0.269 1 1 530 . 4 1 1 A 47 47 VAL CA C 1815 60.048 59.453 0.595 1 1 531 . 4 1 1 A 47 47 VAL CB C 1815 35.044 36.190 -1.146 1 1 534 . 4 1 1 A 47 47 VAL N N 1815 118.680 118.312 0.368 1 1 535 . 4 1 1 A 48 48 ALA H H 1816 9.110 8.598 0.512 1 1 536 . 4 1 1 A 48 48 ALA HA H 1816 4.804 4.886 -0.082 1 1 540 . 4 1 1 A 48 48 ALA CA C 1816 50.808 51.283 -0.475 1 1 541 . 4 1 1 A 48 48 ALA CB C 1816 24.108 23.654 0.454 1 1 542 . 4 1 1 A 48 48 ALA N N 1816 128.274 123.646 4.628 1 1 543 . 4 1 1 A 49 49 GLN H H 1817 8.725 8.493 0.232 1 1 544 . 4 1 1 A 49 49 GLN HA H 1817 5.069 4.808 0.261 1 1 551 . 4 1 1 A 49 49 GLN CA C 1817 53.524 52.203 1.321 1 1 552 . 4 1 1 A 49 49 GLN CB C 1817 30.432 30.338 0.094 1 1 554 . 4 1 1 A 49 49 GLN N N 1817 120.102 117.582 2.520 1 1 556 . 4 1 1 A 50 50 PRO HA H 1818 5.136 4.833 0.303 1 1 563 . 4 1 1 A 50 50 PRO CA C 1818 61.966 62.443 -0.477 1 1 564 . 4 1 1 A 50 50 PRO CB C 1818 32.722 32.887 -0.165 1 1 567 . 4 1 1 A 51 51 THR H H 1819 9.072 8.631 0.441 1 1 568 . 4 1 1 A 51 51 THR HA H 1819 4.566 5.062 -0.496 1 1 573 . 4 1 1 A 51 51 THR CA C 1819 62.695 60.829 1.866 1 1 574 . 4 1 1 A 51 51 THR CB C 1819 70.056 70.641 -0.585 1 1 576 . 4 1 1 A 51 51 THR N N 1819 117.512 113.417 4.095 1 1 577 . 4 1 1 A 52 52 ILE H H 1820 8.900 9.219 -0.319 1 1 578 . 4 1 1 A 52 52 ILE HA H 1820 4.905 5.069 -0.164 1 1 588 . 4 1 1 A 52 52 ILE CA C 1820 60.869 59.615 1.254 1 1 589 . 4 1 1 A 52 52 ILE CB C 1820 39.670 40.043 -0.373 1 1 593 . 4 1 1 A 52 52 ILE N N 1820 129.513 128.426 1.087 1 1 594 . 4 1 1 A 53 53 THR H H 1821 9.200 9.194 0.006 1 1 595 . 4 1 1 A 53 53 THR HA H 1821 4.541 4.798 -0.257 1 1 600 . 4 1 1 A 53 53 THR CA C 1821 61.084 61.561 -0.477 1 1 601 . 4 1 1 A 53 53 THR CB C 1821 71.410 72.094 -0.684 1 1 603 . 4 1 1 A 53 53 THR N N 1821 125.271 123.020 2.251 1 1 604 . 4 1 1 A 54 54 ASP H H 1822 8.918 8.760 0.158 1 1 605 . 4 1 1 A 54 54 ASP HA H 1822 4.756 4.819 -0.063 1 1 608 . 4 1 1 A 54 54 ASP CA C 1822 53.906 54.668 -0.762 1 1 609 . 4 1 1 A 54 54 ASP CB C 1822 41.443 41.796 -0.353 1 1 610 . 4 1 1 A 54 54 ASP N N 1822 126.647 126.695 -0.048 1 1 611 . 4 1 1 A 55 55 ASN H H 1823 8.342 8.925 -0.583 1 1 612 . 4 1 1 A 55 55 ASN HA H 1823 4.704 4.662 0.042 1 1 617 . 4 1 1 A 55 55 ASN CA C 1823 54.421 53.016 1.405 1 1 618 . 4 1 1 A 55 55 ASN CB C 1823 38.557 38.701 -0.144 1 1 619 . 4 1 1 A 55 55 ASN N N 1823 126.271 124.315 1.956 1 1 621 . 4 1 1 A 56 56 LYS H H 1824 9.232 7.990 1.242 1 1 622 . 4 1 1 A 56 56 LYS HA H 1824 4.099 4.010 0.089 1 1 631 . 4 1 1 A 56 56 LYS CA C 1824 58.015 57.502 0.513 1 1 632 . 4 1 1 A 56 56 LYS CB C 1824 28.691 29.375 -0.684 1 1 636 . 4 1 1 A 56 56 LYS N N 1824 115.352 115.222 0.130 1 1 637 . 4 1 1 A 57 57 ASP H H 1825 7.905 8.073 -0.168 1 1 638 . 4 1 1 A 57 57 ASP HA H 1825 4.791 4.796 -0.005 1 1 641 . 4 1 1 A 57 57 ASP CA C 1825 52.401 53.710 -1.309 1 1 642 . 4 1 1 A 57 57 ASP CB C 1825 41.166 41.066 0.100 1 1 643 . 4 1 1 A 57 57 ASP N N 1825 119.741 118.980 0.761 1 1 644 . 4 1 1 A 58 58 GLY H H 1826 8.930 8.947 -0.017 1 1 645 . 4 1 1 A 58 58 GLY HA2 H 1826 4.265 3.889 0.376 1 1 646 . 4 1 1 A 58 58 GLY HA3 H 1826 3.712 3.903 -0.191 1 1 647 . 4 1 1 A 58 58 GLY CA C 1826 44.870 45.442 -0.572 1 1 648 . 4 1 1 A 58 58 GLY N N 1826 109.578 108.371 1.207 1 1 649 . 4 1 1 A 59 59 THR H H 1827 8.004 7.653 0.351 1 1 650 . 4 1 1 A 59 59 THR HA H 1827 5.394 5.094 0.300 1 1 655 . 4 1 1 A 59 59 THR CA C 1827 60.262 59.164 1.098 1 1 656 . 4 1 1 A 59 59 THR CB C 1827 73.892 72.587 1.305 1 1 658 . 4 1 1 A 59 59 THR N N 1827 112.179 110.037 2.142 1 1 659 . 4 1 1 A 60 60 VAL H H 1828 8.822 9.292 -0.470 1 1 660 . 4 1 1 A 60 60 VAL HA H 1828 5.124 4.822 0.302 1 1 668 . 4 1 1 A 60 60 VAL CA C 1828 59.430 59.778 -0.348 1 1 669 . 4 1 1 A 60 60 VAL CB C 1828 35.088 34.084 1.004 1 1 672 . 4 1 1 A 60 60 VAL N N 1828 115.300 117.344 -2.044 1 1 673 . 4 1 1 A 61 61 THR H H 1829 9.115 9.018 0.097 1 1 674 . 4 1 1 A 61 61 THR HA H 1829 5.128 5.024 0.104 1 1 679 . 4 1 1 A 61 61 THR CA C 1829 61.934 61.884 0.050 1 1 680 . 4 1 1 A 61 61 THR CB C 1829 70.561 70.507 0.054 1 1 682 . 4 1 1 A 61 61 THR N N 1829 121.210 120.184 1.026 1 1 683 . 4 1 1 A 62 62 VAL H H 1830 9.530 9.170 0.360 1 1 684 . 4 1 1 A 62 62 VAL HA H 1830 4.803 5.036 -0.233 1 1 692 . 4 1 1 A 62 62 VAL CA C 1830 60.580 60.553 0.027 1 1 693 . 4 1 1 A 62 62 VAL CB C 1830 33.747 34.484 -0.737 1 1 696 . 4 1 1 A 62 62 VAL N N 1830 129.896 125.782 4.114 1 1 697 . 4 1 1 A 63 63 ARG H H 1831 8.879 9.107 -0.228 1 1 698 . 4 1 1 A 63 63 ARG HA H 1831 5.282 5.088 0.194 1 1 705 . 4 1 1 A 63 63 ARG CA C 1831 54.759 54.008 0.751 1 1 706 . 4 1 1 A 63 63 ARG CB C 1831 34.410 34.228 0.182 1 1 709 . 4 1 1 A 63 63 ARG N N 1831 125.701 125.793 -0.092 1 1 710 . 4 1 1 A 64 64 TYR H H 1832 8.878 8.816 0.062 1 1 711 . 4 1 1 A 64 64 TYR HA H 1832 4.888 4.967 -0.079 1 1 718 . 4 1 1 A 64 64 TYR CA C 1832 57.694 57.885 -0.191 1 1 719 . 4 1 1 A 64 64 TYR CB C 1832 42.389 42.123 0.266 1 1 722 . 4 1 1 A 64 64 TYR N N 1832 122.731 123.527 -0.796 1 1 723 . 4 1 1 A 65 65 ALA H H 1833 7.925 8.307 -0.382 1 1 724 . 4 1 1 A 65 65 ALA HA H 1833 4.736 4.453 0.283 1 1 728 . 4 1 1 A 65 65 ALA CA C 1833 47.938 49.385 -1.447 1 1 729 . 4 1 1 A 65 65 ALA CB C 1833 18.320 19.649 -1.329 1 1 730 . 4 1 1 A 65 65 ALA N N 1833 135.415 128.788 6.627 1 1 731 . 4 1 1 A 66 66 PRO HA H 1834 4.198 4.543 -0.345 1 1 738 . 4 1 1 A 66 66 PRO CA C 1834 62.701 62.426 0.275 1 1 739 . 4 1 1 A 66 66 PRO CB C 1834 34.445 32.757 1.688 1 1 742 . 4 1 1 A 67 67 SER H H 1835 9.019 8.666 0.353 1 1 743 . 4 1 1 A 67 67 SER HA H 1835 4.555 4.656 -0.101 1 1 746 . 4 1 1 A 67 67 SER CA C 1835 57.320 57.365 -0.045 1 1 747 . 4 1 1 A 67 67 SER CB C 1835 64.778 65.694 -0.916 1 1 748 . 4 1 1 A 67 67 SER N N 1835 112.422 115.691 -3.269 1 1 749 . 4 1 1 A 68 68 GLU H H 1836 7.625 7.636 -0.011 1 1 750 . 4 1 1 A 68 68 GLU HA H 1836 4.513 4.723 -0.210 1 1 755 . 4 1 1 A 68 68 GLU CA C 1836 54.777 54.856 -0.079 1 1 756 . 4 1 1 A 68 68 GLU CB C 1836 33.981 34.173 -0.192 1 1 758 . 4 1 1 A 68 68 GLU N N 1836 123.025 119.202 3.823 1 1 759 . 4 1 1 A 69 69 ALA H H 1837 8.133 8.452 -0.319 1 1 760 . 4 1 1 A 69 69 ALA HA H 1837 4.088 4.314 -0.226 1 1 764 . 4 1 1 A 69 69 ALA CA C 1837 51.070 51.816 -0.746 1 1 765 . 4 1 1 A 69 69 ALA CB C 1837 19.665 19.942 -0.277 1 1 766 . 4 1 1 A 69 69 ALA N N 1837 122.311 124.986 -2.675 1 1 767 . 4 1 1 A 70 70 GLY H H 1838 9.120 7.845 1.275 1 1 768 . 4 1 1 A 70 70 GLY HA2 H 1838 4.453 3.833 0.620 1 1 769 . 4 1 1 A 70 70 GLY HA3 H 1838 2.953 4.011 -1.058 1 1 770 . 4 1 1 A 70 70 GLY CA C 1838 43.362 43.645 -0.283 1 1 771 . 4 1 1 A 70 70 GLY N N 1838 107.031 105.924 1.107 1 1 772 . 4 1 1 A 71 71 LEU H H 1839 9.096 8.307 0.789 1 1 773 . 4 1 1 A 71 71 LEU HA H 1839 4.336 4.533 -0.197 1 1 783 . 4 1 1 A 71 71 LEU CA C 1839 56.657 54.334 2.323 1 1 784 . 4 1 1 A 71 71 LEU CB C 1839 42.032 42.847 -0.815 1 1 788 . 4 1 1 A 71 71 LEU N N 1839 127.931 122.208 5.723 1 1 789 . 4 1 1 A 72 72 HIS H H 1840 9.359 9.289 0.070 1 1 790 . 4 1 1 A 72 72 HIS HA H 1840 4.595 5.089 -0.494 1 1 796 . 4 1 1 A 72 72 HIS CA C 1840 54.539 54.883 -0.344 1 1 797 . 4 1 1 A 72 72 HIS CB C 1840 31.421 32.861 -1.440 1 1 800 . 4 1 1 A 72 72 HIS N N 1840 128.527 126.035 2.492 1 1 802 . 4 1 1 A 73 73 GLU H H 1841 7.925 8.553 -0.628 1 1 803 . 4 1 1 A 73 73 GLU HA H 1841 5.142 5.245 -0.103 1 1 808 . 4 1 1 A 73 73 GLU CA C 1841 54.381 54.959 -0.578 1 1 809 . 4 1 1 A 73 73 GLU CB C 1841 34.043 33.617 0.426 1 1 811 . 4 1 1 A 73 73 GLU N N 1841 119.347 120.774 -1.427 1 1 812 . 4 1 1 A 74 74 MET H H 1842 9.383 9.218 0.165 1 1 813 . 4 1 1 A 74 74 MET HA H 1842 5.548 5.325 0.223 1 1 821 . 4 1 1 A 74 74 MET CA C 1842 53.859 54.253 -0.394 1 1 822 . 4 1 1 A 74 74 MET CB C 1842 38.571 35.729 2.842 1 1 825 . 4 1 1 A 74 74 MET N N 1842 124.747 125.243 -0.496 1 1 826 . 4 1 1 A 75 75 ASP H H 1843 9.005 9.388 -0.383 1 1 827 . 4 1 1 A 75 75 ASP HA H 1843 5.277 5.141 0.136 1 1 830 . 4 1 1 A 75 75 ASP CA C 1843 52.774 53.751 -0.977 1 1 831 . 4 1 1 A 75 75 ASP CB C 1843 43.493 42.546 0.947 1 1 832 . 4 1 1 A 75 75 ASP N N 1843 128.148 127.696 0.452 1 1 833 . 4 1 1 A 76 76 ILE H H 1844 9.434 8.073 1.361 1 1 834 . 4 1 1 A 76 76 ILE HA H 1844 4.672 4.978 -0.306 1 1 844 . 4 1 1 A 76 76 ILE CA C 1844 60.715 59.540 1.175 1 1 845 . 4 1 1 A 76 76 ILE CB C 1844 39.470 41.490 -2.020 1 1 849 . 4 1 1 A 76 76 ILE N N 1844 124.097 125.832 -1.735 1 1 850 . 4 1 1 A 77 77 ARG H H 1845 8.888 8.962 -0.074 1 1 851 . 4 1 1 A 77 77 ARG HA H 1845 5.050 4.939 0.111 1 1 859 . 4 1 1 A 77 77 ARG CA C 1845 53.780 54.439 -0.659 1 1 860 . 4 1 1 A 77 77 ARG CB C 1845 34.564 33.911 0.653 1 1 863 . 4 1 1 A 77 77 ARG N N 1845 124.944 124.111 0.833 1 1 865 . 4 1 1 A 78 78 TYR H H 1846 8.974 9.136 -0.162 1 1 866 . 4 1 1 A 78 78 TYR HA H 1846 5.151 4.947 0.204 1 1 873 . 4 1 1 A 78 78 TYR CA C 1846 55.909 57.563 -1.654 1 1 874 . 4 1 1 A 78 78 TYR CB C 1846 41.732 40.308 1.424 1 1 877 . 4 1 1 A 78 78 TYR N N 1846 121.774 124.149 -2.375 1 1 878 . 4 1 1 A 79 79 ASP H H 1847 9.026 9.298 -0.272 1 1 879 . 4 1 1 A 79 79 ASP HA H 1847 4.127 4.229 -0.102 1 1 882 . 4 1 1 A 79 79 ASP CA C 1847 55.808 55.100 0.708 1 1 883 . 4 1 1 A 79 79 ASP CB C 1847 39.181 39.576 -0.395 1 1 884 . 4 1 1 A 79 79 ASP N N 1847 131.304 127.702 3.602 1 1 885 . 4 1 1 A 80 80 ASN H H 1848 8.608 8.605 0.003 1 1 886 . 4 1 1 A 80 80 ASN HA H 1848 3.990 4.372 -0.382 1 1 891 . 4 1 1 A 80 80 ASN CA C 1848 55.149 54.840 0.309 1 1 892 . 4 1 1 A 80 80 ASN CB C 1848 38.470 37.056 1.414 1 1 893 . 4 1 1 A 80 80 ASN N N 1848 108.490 109.237 -0.747 1 1 895 . 4 1 1 A 81 81 MET H H 1849 7.820 7.983 -0.163 1 1 896 . 4 1 1 A 81 81 MET HA H 1849 4.819 4.923 -0.104 1 1 904 . 4 1 1 A 81 81 MET CA C 1849 53.852 54.169 -0.317 1 1 905 . 4 1 1 A 81 81 MET CB C 1849 34.665 35.296 -0.631 1 1 908 . 4 1 1 A 81 81 MET N N 1849 121.878 118.718 3.160 1 1 909 . 4 1 1 A 82 82 HIS H H 1850 8.575 8.815 -0.240 1 1 910 . 4 1 1 A 82 82 HIS HA H 1850 4.539 4.550 -0.011 1 1 915 . 4 1 1 A 82 82 HIS CA C 1850 58.819 57.572 1.247 1 1 916 . 4 1 1 A 82 82 HIS CB C 1850 32.419 30.425 1.994 1 1 919 . 4 1 1 A 82 82 HIS N N 1850 124.291 124.758 -0.467 1 1 920 . 4 1 1 A 83 83 ILE H H 1851 8.333 8.095 0.238 1 1 921 . 4 1 1 A 83 83 ILE HA H 1851 4.608 4.338 0.270 1 1 931 . 4 1 1 A 83 83 ILE CA C 1851 60.727 59.485 1.242 1 1 932 . 4 1 1 A 83 83 ILE CB C 1851 35.928 37.487 -1.559 1 1 936 . 4 1 1 A 83 83 ILE N N 1851 120.786 121.396 -0.610 1 1 937 . 4 1 1 A 84 84 PRO HA H 1852 4.426 4.325 0.101 1 1 944 . 4 1 1 A 84 84 PRO CA C 1852 65.249 64.186 1.063 1 1 945 . 4 1 1 A 84 84 PRO CB C 1852 31.120 31.551 -0.431 1 1 948 . 4 1 1 A 85 85 GLY H H 1853 8.498 9.105 -0.607 1 1 949 . 4 1 1 A 85 85 GLY HA2 H 1853 4.284 4.095 0.189 1 1 950 . 4 1 1 A 85 85 GLY HA3 H 1853 3.397 4.136 -0.739 1 1 951 . 4 1 1 A 85 85 GLY CA C 1853 44.913 45.243 -0.330 1 1 952 . 4 1 1 A 85 85 GLY N N 1853 114.093 113.675 0.418 1 1 953 . 4 1 1 A 86 86 SER H H 1854 7.823 8.043 -0.220 1 1 954 . 4 1 1 A 86 86 SER HA H 1854 4.834 4.656 0.178 1 1 957 . 4 1 1 A 86 86 SER CA C 1854 55.628 55.658 -0.030 1 1 958 . 4 1 1 A 86 86 SER CB C 1854 63.063 63.807 -0.744 1 1 959 . 4 1 1 A 86 86 SER N N 1854 112.722 117.744 -5.022 1 1 960 . 4 1 1 A 87 87 PRO HA H 1855 5.681 4.640 1.041 1 1 967 . 4 1 1 A 87 87 PRO CA C 1855 63.079 62.407 0.672 1 1 968 . 4 1 1 A 87 87 PRO CB C 1855 34.406 32.552 1.854 1 1 971 . 4 1 1 A 88 88 LEU H H 1856 9.168 8.742 0.426 1 1 972 . 4 1 1 A 88 88 LEU HA H 1856 4.909 5.025 -0.116 1 1 982 . 4 1 1 A 88 88 LEU CA C 1856 53.839 53.709 0.130 1 1 983 . 4 1 1 A 88 88 LEU CB C 1856 45.558 44.428 1.130 1 1 987 . 4 1 1 A 88 88 LEU N N 1856 122.495 121.499 0.996 1 1 988 . 4 1 1 A 89 89 GLN H H 1857 9.583 8.739 0.844 1 1 989 . 4 1 1 A 89 89 GLN HA H 1857 5.508 5.325 0.183 1 1 996 . 4 1 1 A 89 89 GLN CA C 1857 54.609 55.144 -0.535 1 1 997 . 4 1 1 A 89 89 GLN CB C 1857 32.840 32.309 0.531 1 1 999 . 4 1 1 A 89 89 GLN N N 1857 119.151 121.315 -2.164 1 1 1001 . 4 1 1 A 90 90 PHE H H 1858 8.600 8.894 -0.294 1 1 1002 . 4 1 1 A 90 90 PHE HA H 1858 5.095 5.125 -0.030 1 1 1010 . 4 1 1 A 90 90 PHE CA C 1858 56.161 56.370 -0.209 1 1 1011 . 4 1 1 A 90 90 PHE CB C 1858 41.411 40.416 0.995 1 1 1015 . 4 1 1 A 90 90 PHE N N 1858 118.242 120.277 -2.035 1 1 1016 . 4 1 1 A 91 91 TYR H H 1859 9.892 8.833 1.059 1 1 1017 . 4 1 1 A 91 91 TYR HA H 1859 4.790 4.900 -0.110 1 1 1024 . 4 1 1 A 91 91 TYR CA C 1859 58.205 56.771 1.434 1 1 1025 . 4 1 1 A 91 91 TYR CB C 1859 40.867 40.689 0.178 1 1 1028 . 4 1 1 A 91 91 TYR N N 1859 127.393 122.183 5.210 1 1 1029 . 4 1 1 A 92 92 VAL H H 1860 8.072 8.333 -0.261 1 1 1030 . 4 1 1 A 92 92 VAL HA H 1860 4.377 4.337 0.040 1 1 1038 . 4 1 1 A 92 92 VAL CA C 1860 62.583 61.143 1.440 1 1 1039 . 4 1 1 A 92 92 VAL CB C 1860 33.609 32.005 1.604 1 1 1042 . 4 1 1 A 92 92 VAL N N 1860 132.007 126.724 5.283 1 1 1043 . 4 1 1 A 93 93 ASP H H 1861 8.438 8.900 -0.462 1 1 1044 . 4 1 1 A 93 93 ASP HA H 1861 5.024 5.171 -0.147 1 1 1047 . 4 1 1 A 93 93 ASP CA C 1861 50.678 52.088 -1.410 1 1 1048 . 4 1 1 A 93 93 ASP CB C 1861 46.086 43.990 2.096 1 1 1049 . 4 1 1 A 93 93 ASP N N 1861 130.459 124.974 5.485 1 1 1050 . 4 1 1 A 94 94 TYR H H 1862 9.674 8.733 0.941 1 1 1051 . 4 1 1 A 94 94 TYR HA H 1862 4.606 4.554 0.052 1 1 1058 . 4 1 1 A 94 94 TYR CA C 1862 58.983 58.580 0.403 1 1 1059 . 4 1 1 A 94 94 TYR CB C 1862 39.727 38.881 0.846 1 1 1062 . 4 1 1 A 94 94 TYR N N 1862 120.069 120.462 -0.393 1 1 1063 . 4 1 1 A 95 95 VAL H H 1863 8.371 8.921 -0.550 1 1 1064 . 4 1 1 A 95 95 VAL HA H 1863 3.654 3.925 -0.271 1 1 1072 . 4 1 1 A 95 95 VAL CA C 1863 64.922 64.270 0.652 1 1 1073 . 4 1 1 A 95 95 VAL CB C 1863 32.270 32.353 -0.083 1 1 1076 . 4 1 1 A 95 95 VAL N N 1863 121.770 122.672 -0.902 1 1 1077 . 4 1 1 A 96 96 ASN H H 1864 8.729 7.903 0.826 1 1 1078 . 4 1 1 A 96 96 ASN HA H 1864 4.901 5.200 -0.299 1 1 1083 . 4 1 1 A 96 96 ASN CA C 1864 52.652 52.159 0.493 1 1 1084 . 4 1 1 A 96 96 ASN CB C 1864 38.160 42.329 -4.169 1 1 1085 . 4 1 1 A 96 96 ASN N N 1864 120.006 118.284 1.722 1 1 1087 . 4 1 1 A 97 97 CYS H H 1865 7.875 8.597 -0.722 1 1 1088 . 4 1 1 A 97 97 CYS HA H 1865 4.575 4.831 -0.256 1 1 1091 . 4 1 1 A 97 97 CYS CA C 1865 57.009 57.248 -0.239 1 1 1092 . 4 1 1 A 97 97 CYS CB C 1865 29.845 31.086 -1.241 1 1 1093 . 4 1 1 A 97 97 CYS N N 1865 117.023 120.943 -3.920 1 1 1094 . 4 1 1 A 98 98 GLY HA2 H 1866 4.045 3.895 0.150 1 1 1095 . 4 1 1 A 98 98 GLY HA3 H 1866 3.866 3.918 -0.052 1 1 1096 . 4 1 1 A 98 98 GLY CA C 1866 46.078 45.637 0.441 1 1 1097 . 4 1 1 A 99 99 HIS H H 1867 7.144 7.637 -0.493 1 1 1098 . 4 1 1 A 99 99 HIS HA H 1867 4.940 4.585 0.355 1 1 1103 . 4 1 1 A 99 99 HIS CA C 1867 53.843 55.906 -2.063 1 1 1104 . 4 1 1 A 99 99 HIS CB C 1867 31.584 30.816 0.768 1 1 1107 . 4 1 1 A 99 99 HIS N N 1867 115.591 117.845 -2.254 1 1 1108 . 4 1 1 A 100 100 VAL H H 1868 8.434 8.481 -0.047 1 1 1109 . 4 1 1 A 100 100 VAL HA H 1868 4.143 4.166 -0.023 1 1 1117 . 4 1 1 A 100 100 VAL CA C 1868 63.974 63.894 0.080 1 1 1118 . 4 1 1 A 100 100 VAL CB C 1868 31.525 31.896 -0.371 1 1 1121 . 4 1 1 A 100 100 VAL N N 1868 122.851 121.284 1.567 1 1 1122 . 4 1 1 A 101 101 THR H H 1869 7.869 8.679 -0.810 1 1 1123 . 4 1 1 A 101 101 THR HA H 1869 5.217 5.137 0.080 1 1 1128 . 4 1 1 A 101 101 THR CA C 1869 59.495 60.701 -1.206 1 1 1129 . 4 1 1 A 101 101 THR CB C 1869 72.402 71.529 0.873 1 1 1131 . 4 1 1 A 101 101 THR N N 1869 118.578 120.843 -2.265 1 1 1132 . 4 1 1 A 102 102 ALA H H 1870 8.512 8.988 -0.476 1 1 1133 . 4 1 1 A 102 102 ALA HA H 1870 5.687 5.437 0.250 1 1 1137 . 4 1 1 A 102 102 ALA CA C 1870 50.497 50.798 -0.301 1 1 1138 . 4 1 1 A 102 102 ALA CB C 1870 23.128 23.366 -0.238 1 1 1139 . 4 1 1 A 102 102 ALA N N 1870 125.193 126.504 -1.311 1 1 1140 . 4 1 1 A 103 103 TYR H H 1871 8.753 8.832 -0.079 1 1 1141 . 4 1 1 A 103 103 TYR HA H 1871 5.019 5.254 -0.235 1 1 1148 . 4 1 1 A 103 103 TYR CA C 1871 56.303 56.152 0.151 1 1 1149 . 4 1 1 A 103 103 TYR CB C 1871 39.347 41.075 -1.728 1 1 1152 . 4 1 1 A 103 103 TYR N N 1871 119.968 116.854 3.114 1 1 1153 . 4 1 1 A 104 104 GLY H H 1872 9.006 8.643 0.363 1 1 1154 . 4 1 1 A 104 104 GLY HA2 H 1872 5.326 4.339 0.987 1 1 1155 . 4 1 1 A 104 104 GLY HA3 H 1872 4.226 4.369 -0.143 1 1 1156 . 4 1 1 A 104 104 GLY CA C 1872 44.624 44.424 0.200 1 1 1157 . 4 1 1 A 104 104 GLY N N 1872 109.622 106.997 2.625 1 1 1158 . 4 1 1 A 105 105 PRO HA H 1873 4.450 4.475 -0.025 1 1 1165 . 4 1 1 A 105 105 PRO CA C 1873 66.676 64.965 1.711 1 1 1166 . 4 1 1 A 105 105 PRO CB C 1873 32.425 32.094 0.331 1 1 1169 . 4 1 1 A 106 106 GLY H H 1874 9.251 8.697 0.554 1 1 1170 . 4 1 1 A 106 106 GLY HA2 H 1874 4.600 3.891 0.709 1 1 1171 . 4 1 1 A 106 106 GLY HA3 H 1874 3.521 4.121 -0.600 1 1 1172 . 4 1 1 A 106 106 GLY CA C 1874 46.454 47.044 -0.590 1 1 1173 . 4 1 1 A 106 106 GLY N N 1874 105.282 105.605 -0.323 1 1 1174 . 4 1 1 A 107 107 LEU H H 1875 7.161 7.872 -0.711 1 1 1175 . 4 1 1 A 107 107 LEU HA H 1875 4.062 3.911 0.151 1 1 1185 . 4 1 1 A 107 107 LEU CA C 1875 55.592 56.173 -0.581 1 1 1186 . 4 1 1 A 107 107 LEU CB C 1875 41.516 40.667 0.849 1 1 1190 . 4 1 1 A 107 107 LEU N N 1875 117.141 119.239 -2.098 1 1 1191 . 4 1 1 A 108 108 THR H H 1876 8.298 7.831 0.467 1 1 1192 . 4 1 1 A 108 108 THR HA H 1876 5.038 4.635 0.403 1 1 1197 . 4 1 1 A 108 108 THR CA C 1876 64.551 63.738 0.813 1 1 1198 . 4 1 1 A 108 108 THR CB C 1876 72.706 70.794 1.912 1 1 1200 . 4 1 1 A 108 108 THR N N 1876 114.411 112.196 2.215 1 1 1201 . 4 1 1 A 109 109 HIS H H 1877 9.030 7.879 1.151 1 1 1202 . 4 1 1 A 109 109 HIS HA H 1877 5.854 4.996 0.858 1 1 1207 . 4 1 1 A 109 109 HIS CA C 1877 56.127 55.344 0.783 1 1 1208 . 4 1 1 A 109 109 HIS CB C 1877 36.258 32.812 3.446 1 1 1211 . 4 1 1 A 109 109 HIS N N 1877 125.809 116.911 8.898 1 1 1212 . 4 1 1 A 110 110 GLY H H 1878 7.497 7.598 -0.101 1 1 1213 . 4 1 1 A 110 110 GLY HA2 H 1878 4.075 3.944 0.131 1 1 1214 . 4 1 1 A 110 110 GLY HA3 H 1878 3.512 3.992 -0.480 1 1 1215 . 4 1 1 A 110 110 GLY CA C 1878 44.559 45.099 -0.540 1 1 1216 . 4 1 1 A 110 110 GLY N N 1878 111.907 110.200 1.707 1 1 1217 . 4 1 1 A 111 111 VAL H H 1879 8.776 8.383 0.393 1 1 1218 . 4 1 1 A 111 111 VAL HA H 1879 4.741 4.888 -0.147 1 1 1226 . 4 1 1 A 111 111 VAL CA C 1879 60.188 59.857 0.331 1 1 1227 . 4 1 1 A 111 111 VAL CB C 1879 35.130 35.314 -0.184 1 1 1230 . 4 1 1 A 111 111 VAL N N 1879 119.617 117.940 1.677 1 1 1231 . 4 1 1 A 112 112 VAL H H 1880 7.841 8.704 -0.863 1 1 1232 . 4 1 1 A 112 112 VAL HA H 1880 3.343 3.932 -0.589 1 1 1240 . 4 1 1 A 112 112 VAL CA C 1880 63.553 62.520 1.033 1 1 1241 . 4 1 1 A 112 112 VAL CB C 1880 32.257 31.741 0.516 1 1 1243 . 4 1 1 A 112 112 VAL N N 1880 122.070 124.508 -2.438 1 1 1244 . 4 1 1 A 113 113 ASN H H 1881 8.822 9.009 -0.187 1 1 1245 . 4 1 1 A 113 113 ASN HA H 1881 4.079 4.349 -0.270 1 1 1250 . 4 1 1 A 113 113 ASN CA C 1881 55.459 55.017 0.442 1 1 1251 . 4 1 1 A 113 113 ASN CB C 1881 37.330 37.121 0.209 1 1 1252 . 4 1 1 A 113 113 ASN N N 1881 115.063 117.791 -2.728 1 1 1254 . 4 1 1 A 114 114 LYS H H 1882 8.073 7.352 0.721 1 1 1255 . 4 1 1 A 114 114 LYS HA H 1882 4.818 4.680 0.138 1 1 1260 . 4 1 1 A 114 114 LYS CA C 1882 53.039 53.127 -0.088 1 1 1261 . 4 1 1 A 114 114 LYS CB C 1882 34.020 33.212 0.808 1 1 1263 . 4 1 1 A 114 114 LYS N N 1882 121.439 119.233 2.206 1 1 1264 . 4 1 1 A 115 115 PRO HA H 1883 4.409 4.724 -0.315 1 1 1271 . 4 1 1 A 115 115 PRO CA C 1883 63.121 62.570 0.551 1 1 1272 . 4 1 1 A 115 115 PRO CB C 1883 31.515 31.805 -0.290 1 1 1275 . 4 1 1 A 116 116 ALA H H 1884 8.868 8.145 0.723 1 1 1276 . 4 1 1 A 116 116 ALA HA H 1884 4.804 4.921 -0.117 1 1 1280 . 4 1 1 A 116 116 ALA CA C 1884 50.620 50.532 0.088 1 1 1281 . 4 1 1 A 116 116 ALA CB C 1884 19.426 21.549 -2.123 1 1 1282 . 4 1 1 A 116 116 ALA N N 1884 132.329 125.382 6.947 1 1 1283 . 4 1 1 A 117 117 THR H H 1885 8.433 8.770 -0.337 1 1 1284 . 4 1 1 A 117 117 THR HA H 1885 5.747 5.429 0.318 1 1 1289 . 4 1 1 A 117 117 THR CA C 1885 60.364 59.920 0.444 1 1 1290 . 4 1 1 A 117 117 THR CB C 1885 72.204 71.993 0.211 1 1 1292 . 4 1 1 A 117 117 THR N N 1885 113.428 111.098 2.330 1 1 1293 . 4 1 1 A 118 118 PHE H H 1886 9.069 8.485 0.584 1 1 1294 . 4 1 1 A 118 118 PHE HA H 1886 5.123 5.183 -0.060 1 1 1301 . 4 1 1 A 118 118 PHE CA C 1886 57.059 56.013 1.046 1 1 1302 . 4 1 1 A 118 118 PHE CB C 1886 39.994 41.050 -1.056 1 1 1305 . 4 1 1 A 118 118 PHE N N 1886 119.166 117.617 1.549 1 1 1306 . 4 1 1 A 119 119 THR H H 1887 9.451 8.952 0.499 1 1 1307 . 4 1 1 A 119 119 THR HA H 1887 5.097 5.218 -0.121 1 1 1312 . 4 1 1 A 119 119 THR CA C 1887 62.050 61.203 0.847 1 1 1313 . 4 1 1 A 119 119 THR CB C 1887 71.696 72.056 -0.360 1 1 1315 . 4 1 1 A 119 119 THR N N 1887 119.436 114.336 5.100 1 1 1316 . 4 1 1 A 120 120 VAL H H 1888 8.812 9.348 -0.536 1 1 1317 . 4 1 1 A 120 120 VAL HA H 1888 4.807 4.618 0.189 1 1 1325 . 4 1 1 A 120 120 VAL CA C 1888 61.140 60.928 0.212 1 1 1326 . 4 1 1 A 120 120 VAL CB C 1888 34.059 34.251 -0.192 1 1 1329 . 4 1 1 A 120 120 VAL N N 1888 124.304 126.430 -2.126 1 1 1330 . 4 1 1 A 121 121 ASN H H 1889 9.291 9.138 0.153 1 1 1331 . 4 1 1 A 121 121 ASN HA H 1889 5.177 5.221 -0.044 1 1 1336 . 4 1 1 A 121 121 ASN CA C 1889 52.470 52.597 -0.127 1 1 1337 . 4 1 1 A 121 121 ASN CB C 1889 39.766 40.157 -0.391 1 1 1338 . 4 1 1 A 121 121 ASN N N 1889 128.674 125.842 2.832 1 1 1340 . 4 1 1 A 122 122 THR H H 1890 8.553 8.481 0.072 1 1 1341 . 4 1 1 A 122 122 THR HA H 1890 4.236 4.896 -0.660 1 1 1346 . 4 1 1 A 122 122 THR CA C 1890 61.062 61.090 -0.028 1 1 1347 . 4 1 1 A 122 122 THR CB C 1890 68.437 70.550 -2.113 1 1 1349 . 4 1 1 A 122 122 THR N N 1890 116.203 113.460 2.743 1 1 1350 . 4 1 1 A 123 123 LYS H H 1891 8.210 7.641 0.569 1 1 1351 . 4 1 1 A 123 123 LYS HA H 1891 4.019 4.007 0.012 1 1 1360 . 4 1 1 A 123 123 LYS CA C 1891 58.646 59.939 -1.293 1 1 1361 . 4 1 1 A 123 123 LYS CB C 1891 31.868 32.161 -0.293 1 1 1365 . 4 1 1 A 123 123 LYS N N 1891 124.070 122.509 1.561 1 1 1366 . 4 1 1 A 124 124 ASP H H 1892 8.596 7.888 0.708 1 1 1367 . 4 1 1 A 124 124 ASP HA H 1892 4.638 4.776 -0.138 1 1 1370 . 4 1 1 A 124 124 ASP CA C 1892 54.928 53.099 1.829 1 1 1371 . 4 1 1 A 124 124 ASP CB C 1892 40.725 40.903 -0.178 1 1 1372 . 4 1 1 A 124 124 ASP N N 1892 119.838 117.161 2.677 1 1 1373 . 4 1 1 A 125 125 ALA H H 1893 7.792 7.642 0.150 1 1 1374 . 4 1 1 A 125 125 ALA HA H 1893 4.248 4.088 0.160 1 1 1378 . 4 1 1 A 125 125 ALA CA C 1893 52.852 53.024 -0.172 1 1 1379 . 4 1 1 A 125 125 ALA CB C 1893 20.199 19.326 0.873 1 1 1380 . 4 1 1 A 125 125 ALA N N 1893 122.999 121.285 1.714 1 1 1381 . 4 1 1 A 126 126 GLY H H 1894 8.214 7.740 0.474 1 1 1382 . 4 1 1 A 126 126 GLY HA2 H 1894 4.183 3.964 0.219 1 1 1383 . 4 1 1 A 126 126 GLY HA3 H 1894 3.993 4.011 -0.018 1 1 1384 . 4 1 1 A 126 126 GLY CA C 1894 44.725 44.663 0.062 1 1 1385 . 4 1 1 A 126 126 GLY N N 1894 108.359 104.263 4.096 1 1 1386 . 4 1 1 A 127 127 GLU H H 1895 8.633 8.469 0.164 1 1 1387 . 4 1 1 A 127 127 GLU HA H 1895 4.318 4.517 -0.199 1 1 1392 . 4 1 1 A 127 127 GLU CA C 1895 57.280 57.035 0.245 1 1 1393 . 4 1 1 A 127 127 GLU CB C 1895 30.434 30.960 -0.526 1 1 1395 . 4 1 1 A 127 127 GLU N N 1895 122.934 120.808 2.126 1 1 1396 . 4 1 1 A 128 128 GLY H H 1896 8.351 8.637 -0.286 1 1 1397 . 4 1 1 A 128 128 GLY HA2 H 1896 3.853 4.100 -0.247 1 1 1398 . 4 1 1 A 128 128 GLY HA3 H 1896 3.853 4.105 -0.252 1 1 1399 . 4 1 1 A 128 128 GLY CA C 1896 45.766 45.532 0.234 1 1 1400 . 4 1 1 A 128 128 GLY N N 1896 111.048 113.626 -2.578 1 1 1401 . 4 1 1 A 129 129 GLY H H 1897 7.580 8.058 -0.478 1 1 1402 . 4 1 1 A 129 129 GLY HA2 H 1897 4.170 4.041 0.129 1 1 1403 . 4 1 1 A 129 129 GLY HA3 H 1897 3.463 4.071 -0.608 1 1 1404 . 4 1 1 A 129 129 GLY CA C 1897 44.670 45.775 -1.105 1 1 1405 . 4 1 1 A 129 129 GLY N N 1897 106.306 109.374 -3.068 1 1 1406 . 4 1 1 A 130 130 LEU H H 1898 8.416 8.188 0.228 1 1 1407 . 4 1 1 A 130 130 LEU HA H 1898 5.077 4.226 0.851 1 1 1417 . 4 1 1 A 130 130 LEU CA C 1898 54.526 54.126 0.400 1 1 1418 . 4 1 1 A 130 130 LEU CB C 1898 44.499 42.646 1.853 1 1 1422 . 4 1 1 A 130 130 LEU N N 1898 126.737 125.022 1.715 1 1 1423 . 4 1 1 A 131 131 SER H H 1899 9.254 9.308 -0.054 1 1 1424 . 4 1 1 A 131 131 SER HA H 1899 4.803 5.430 -0.627 1 1 1427 . 4 1 1 A 131 131 SER CA C 1899 57.293 57.170 0.123 1 1 1428 . 4 1 1 A 131 131 SER CB C 1899 65.376 66.660 -1.284 1 1 1429 . 4 1 1 A 131 131 SER N N 1899 123.028 124.673 -1.645 1 1 1430 . 4 1 1 A 132 132 LEU H H 1900 8.410 8.553 -0.143 1 1 1431 . 4 1 1 A 132 132 LEU HA H 1900 5.452 4.967 0.485 1 1 1441 . 4 1 1 A 132 132 LEU CA C 1900 53.045 54.439 -1.394 1 1 1442 . 4 1 1 A 132 132 LEU CB C 1900 46.982 46.038 0.944 1 1 1446 . 4 1 1 A 132 132 LEU N N 1900 126.218 122.964 3.254 1 1 1447 . 4 1 1 A 133 133 ALA H H 1901 8.708 8.583 0.125 1 1 1448 . 4 1 1 A 133 133 ALA HA H 1901 4.591 4.951 -0.360 1 1 1452 . 4 1 1 A 133 133 ALA CA C 1901 52.140 51.366 0.774 1 1 1453 . 4 1 1 A 133 133 ALA CB C 1901 22.653 23.759 -1.106 1 1 1454 . 4 1 1 A 133 133 ALA N N 1901 124.744 125.854 -1.110 1 1 1455 . 4 1 1 A 134 134 ILE H H 1902 8.641 8.559 0.082 1 1 1456 . 4 1 1 A 134 134 ILE HA H 1902 5.256 5.234 0.022 1 1 1466 . 4 1 1 A 134 134 ILE CA C 1902 59.873 59.949 -0.076 1 1 1467 . 4 1 1 A 134 134 ILE CB C 1902 41.214 42.066 -0.852 1 1 1471 . 4 1 1 A 134 134 ILE N N 1902 121.132 120.244 0.888 1 1 1472 . 4 1 1 A 135 135 GLU H H 1903 9.294 8.857 0.437 1 1 1473 . 4 1 1 A 135 135 GLU HA H 1903 4.869 5.195 -0.326 1 1 1478 . 4 1 1 A 135 135 GLU CA C 1903 54.307 54.776 -0.469 1 1 1479 . 4 1 1 A 135 135 GLU CB C 1903 32.474 33.642 -1.168 1 1 1481 . 4 1 1 A 135 135 GLU N N 1903 129.644 123.957 5.687 1 1 1482 . 4 1 1 A 136 136 GLY H H 1904 8.347 8.301 0.046 1 1 1483 . 4 1 1 A 136 136 GLY HA2 H 1904 4.005 3.465 0.540 1 1 1484 . 4 1 1 A 136 136 GLY HA3 H 1904 3.629 3.964 -0.335 1 1 1485 . 4 1 1 A 136 136 GLY CA C 1904 45.530 44.992 0.538 1 1 1486 . 4 1 1 A 136 136 GLY N N 1904 112.326 108.819 3.507 1 1 1487 . 4 1 1 A 137 137 PRO HA H 1905 4.268 4.316 -0.048 1 1 1494 . 4 1 1 A 137 137 PRO CA C 1905 64.189 64.026 0.163 1 1 1495 . 4 1 1 A 137 137 PRO CB C 1905 32.482 32.065 0.417 1 1 1498 . 4 1 1 A 138 138 SER H H 1906 7.060 7.351 -0.291 1 1 1499 . 4 1 1 A 138 138 SER HA H 1906 4.603 4.706 -0.103 1 1 1502 . 4 1 1 A 138 138 SER CA C 1906 56.433 56.736 -0.303 1 1 1503 . 4 1 1 A 138 138 SER CB C 1906 66.672 65.413 1.259 1 1 1504 . 4 1 1 A 138 138 SER N N 1906 109.100 111.620 -2.520 1 1 1505 . 4 1 1 A 139 139 LYS H H 1907 8.479 8.314 0.165 1 1 1506 . 4 1 1 A 139 139 LYS HA H 1907 4.413 4.425 -0.012 1 1 1515 . 4 1 1 A 139 139 LYS CA C 1907 56.638 56.724 -0.086 1 1 1516 . 4 1 1 A 139 139 LYS CB C 1907 31.873 32.971 -1.098 1 1 1520 . 4 1 1 A 139 139 LYS N N 1907 124.545 125.100 -0.555 1 1 1521 . 4 1 1 A 140 140 ALA H H 1908 8.358 8.489 -0.131 1 1 1522 . 4 1 1 A 140 140 ALA HA H 1908 4.706 4.574 0.132 1 1 1526 . 4 1 1 A 140 140 ALA CA C 1908 51.081 52.388 -1.307 1 1 1527 . 4 1 1 A 140 140 ALA CB C 1908 20.724 19.371 1.353 1 1 1528 . 4 1 1 A 140 140 ALA N N 1908 131.020 129.601 1.419 1 1 1529 . 4 1 1 A 141 141 GLU H H 1909 8.625 8.389 0.236 1 1 1530 . 4 1 1 A 141 141 GLU HA H 1909 4.248 4.873 -0.625 1 1 1535 . 4 1 1 A 141 141 GLU CA C 1909 56.991 55.886 1.105 1 1 1536 . 4 1 1 A 141 141 GLU CB C 1909 30.453 31.490 -1.037 1 1 1538 . 4 1 1 A 141 141 GLU N N 1909 124.862 121.065 3.797 1 1 1539 . 4 1 1 A 142 142 ILE H H 1910 8.588 8.709 -0.121 1 1 1540 . 4 1 1 A 142 142 ILE HA H 1910 4.871 5.128 -0.257 1 1 1550 . 4 1 1 A 142 142 ILE CA C 1910 60.733 60.006 0.727 1 1 1551 . 4 1 1 A 142 142 ILE CB C 1910 41.494 41.776 -0.282 1 1 1555 . 4 1 1 A 142 142 ILE N N 1910 126.220 124.568 1.652 1 1 1556 . 4 1 1 A 143 143 SER H H 1911 9.269 8.891 0.378 1 1 1557 . 4 1 1 A 143 143 SER HA H 1911 4.804 5.411 -0.607 1 1 1560 . 4 1 1 A 143 143 SER CA C 1911 56.988 57.367 -0.379 1 1 1561 . 4 1 1 A 143 143 SER CB C 1911 65.172 66.136 -0.964 1 1 1562 . 4 1 1 A 143 143 SER N N 1911 124.083 122.586 1.497 1 1 1563 . 4 1 1 A 144 144 CYS H H 1912 8.773 8.757 0.016 1 1 1564 . 4 1 1 A 144 144 CYS HA H 1912 5.200 5.110 0.090 1 1 1567 . 4 1 1 A 144 144 CYS CA C 1912 57.256 57.932 -0.676 1 1 1568 . 4 1 1 A 144 144 CYS CB C 1912 29.137 31.322 -2.185 1 1 1569 . 4 1 1 A 144 144 CYS N N 1912 125.729 121.010 4.719 1 1 1570 . 4 1 1 A 145 145 THR H H 1913 8.976 8.914 0.062 1 1 1571 . 4 1 1 A 145 145 THR HA H 1913 4.510 4.894 -0.384 1 1 1576 . 4 1 1 A 145 145 THR CA C 1913 61.388 61.212 0.176 1 1 1577 . 4 1 1 A 145 145 THR CB C 1913 71.558 71.931 -0.373 1 1 1579 . 4 1 1 A 145 145 THR N N 1913 124.914 119.785 5.129 1 1 1580 . 4 1 1 A 146 146 ASP H H 1914 8.843 9.004 -0.161 1 1 1581 . 4 1 1 A 146 146 ASP HA H 1914 4.842 4.841 0.001 1 1 1584 . 4 1 1 A 146 146 ASP CA C 1914 54.307 54.119 0.188 1 1 1585 . 4 1 1 A 146 146 ASP CB C 1914 41.262 42.173 -0.911 1 1 1586 . 4 1 1 A 146 146 ASP N N 1914 128.084 128.195 -0.111 1 1 1587 . 4 1 1 A 147 147 ASN H H 1915 8.700 8.758 -0.058 1 1 1588 . 4 1 1 A 147 147 ASN HA H 1915 4.798 5.054 -0.256 1 1 1593 . 4 1 1 A 147 147 ASN CA C 1915 54.283 51.932 2.351 1 1 1594 . 4 1 1 A 147 147 ASN CB C 1915 38.986 40.913 -1.927 1 1 1595 . 4 1 1 A 147 147 ASN N N 1915 125.720 122.803 2.917 1 1 1597 . 4 1 1 A 148 148 GLN HA H 1916 4.057 3.996 0.061 1 1 1602 . 4 1 1 A 148 148 GLN CA C 1916 57.839 58.127 -0.288 1 1 1603 . 4 1 1 A 148 148 GLN CB C 1916 26.281 28.576 -2.295 1 1 1605 . 4 1 1 A 149 149 ASP H H 1917 7.892 8.015 -0.123 1 1 1606 . 4 1 1 A 149 149 ASP HA H 1917 4.755 4.571 0.184 1 1 1609 . 4 1 1 A 149 149 ASP CA C 1917 52.659 54.181 -1.522 1 1 1610 . 4 1 1 A 149 149 ASP CB C 1917 41.111 40.958 0.153 1 1 1611 . 4 1 1 A 149 149 ASP N N 1917 118.769 116.656 2.113 1 1 1612 . 4 1 1 A 150 150 GLY H H 1918 8.673 8.891 -0.218 1 1 1613 . 4 1 1 A 150 150 GLY HA2 H 1918 4.358 3.900 0.458 1 1 1614 . 4 1 1 A 150 150 GLY HA3 H 1918 3.700 3.900 -0.200 1 1 1615 . 4 1 1 A 150 150 GLY CA C 1918 45.319 46.080 -0.761 1 1 1616 . 4 1 1 A 150 150 GLY N N 1918 110.464 108.475 1.989 1 1 1617 . 4 1 1 A 151 151 THR H H 1919 8.154 7.595 0.559 1 1 1618 . 4 1 1 A 151 151 THR HA H 1919 4.109 5.039 -0.930 1 1 1623 . 4 1 1 A 151 151 THR CA C 1919 60.041 59.413 0.628 1 1 1624 . 4 1 1 A 151 151 THR CB C 1919 73.422 72.727 0.695 1 1 1626 . 4 1 1 A 151 151 THR N N 1919 111.043 109.785 1.258 1 1 1627 . 4 1 1 A 152 152 CYS H H 1920 9.088 8.822 0.266 1 1 1628 . 4 1 1 A 152 152 CYS HA H 1920 5.362 5.156 0.206 1 1 1631 . 4 1 1 A 152 152 CYS CA C 1920 56.990 57.775 -0.785 1 1 1632 . 4 1 1 A 152 152 CYS CB C 1920 30.740 28.642 2.098 1 1 1633 . 4 1 1 A 152 152 CYS N N 1920 118.508 121.997 -3.489 1 1 1634 . 4 1 1 A 153 153 SER H H 1921 9.102 9.131 -0.029 1 1 1635 . 4 1 1 A 153 153 SER HA H 1921 4.865 4.952 -0.087 1 1 1638 . 4 1 1 A 153 153 SER CA C 1921 58.023 57.242 0.781 1 1 1639 . 4 1 1 A 153 153 SER CB C 1921 64.133 64.182 -0.049 1 1 1640 . 4 1 1 A 153 153 SER N N 1921 122.048 120.371 1.677 1 1 1641 . 4 1 1 A 154 154 VAL H H 1922 8.983 9.061 -0.078 1 1 1642 . 4 1 1 A 154 154 VAL HA H 1922 4.608 4.848 -0.240 1 1 1650 . 4 1 1 A 154 154 VAL CA C 1922 60.575 60.021 0.554 1 1 1651 . 4 1 1 A 154 154 VAL CB C 1922 32.710 34.180 -1.470 1 1 1654 . 4 1 1 A 154 154 VAL N N 1922 130.262 126.366 3.896 1 1 1655 . 4 1 1 A 155 155 SER H H 1923 8.737 8.904 -0.167 1 1 1656 . 4 1 1 A 155 155 SER HA H 1923 5.680 5.561 0.119 1 1 1659 . 4 1 1 A 155 155 SER CA C 1923 55.991 56.133 -0.142 1 1 1660 . 4 1 1 A 155 155 SER CB C 1923 66.306 66.189 0.117 1 1 1661 . 4 1 1 A 155 155 SER N N 1923 121.504 119.188 2.316 1 1 1662 . 4 1 1 A 156 156 TYR H H 1924 9.061 8.973 0.088 1 1 1663 . 4 1 1 A 156 156 TYR HA H 1924 5.790 5.587 0.203 1 1 1671 . 4 1 1 A 156 156 TYR CA C 1924 55.118 55.901 -0.783 1 1 1672 . 4 1 1 A 156 156 TYR CB C 1924 42.344 41.660 0.684 1 1 1675 . 4 1 1 A 156 156 TYR N N 1924 121.858 118.231 3.627 1 1 1676 . 4 1 1 A 157 157 LEU H H 1925 7.505 9.296 -1.791 1 1 1677 . 4 1 1 A 157 157 LEU HA H 1925 4.996 4.762 0.234 1 1 1687 . 4 1 1 A 157 157 LEU CA C 1925 50.476 51.142 -0.666 1 1 1688 . 4 1 1 A 157 157 LEU CB C 1925 43.334 43.433 -0.099 1 1 1692 . 4 1 1 A 157 157 LEU N N 1925 123.272 121.344 1.928 1 1 1693 . 4 1 1 A 158 158 PRO HA H 1926 4.691 4.934 -0.243 1 1 1700 . 4 1 1 A 158 158 PRO CA C 1926 61.808 62.337 -0.529 1 1 1701 . 4 1 1 A 158 158 PRO CB C 1926 32.551 32.987 -0.436 1 1 1704 . 4 1 1 A 159 159 VAL H H 1927 8.388 8.246 0.142 1 1 1705 . 4 1 1 A 159 159 VAL HA H 1927 4.510 4.488 0.022 1 1 1713 . 4 1 1 A 159 159 VAL CA C 1927 61.778 61.544 0.234 1 1 1714 . 4 1 1 A 159 159 VAL CB C 1927 32.432 34.084 -1.652 1 1 1717 . 4 1 1 A 159 159 VAL N N 1927 115.680 117.087 -1.407 1 1 1718 . 4 1 1 A 160 160 LEU H H 1928 6.931 7.800 -0.869 1 1 1719 . 4 1 1 A 160 160 LEU HA H 1928 4.931 4.844 0.087 1 1 1729 . 4 1 1 A 160 160 LEU CA C 1928 51.971 51.403 0.568 1 1 1730 . 4 1 1 A 160 160 LEU CB C 1928 45.905 44.648 1.257 1 1 1734 . 4 1 1 A 160 160 LEU N N 1928 120.258 123.371 -3.113 1 1 1735 . 4 1 1 A 161 161 PRO HA H 1929 4.317 4.845 -0.528 1 1 1742 . 4 1 1 A 161 161 PRO CA C 1929 62.809 62.911 -0.102 1 1 1743 . 4 1 1 A 161 161 PRO CB C 1929 32.662 33.020 -0.358 1 1 1746 . 4 1 1 A 162 162 GLY H H 1930 8.916 8.306 0.610 1 1 1747 . 4 1 1 A 162 162 GLY HA2 H 1930 4.461 4.168 0.293 1 1 1748 . 4 1 1 A 162 162 GLY HA3 H 1930 3.852 4.192 -0.340 1 1 1749 . 4 1 1 A 162 162 GLY CA C 1930 44.496 44.271 0.225 1 1 1750 . 4 1 1 A 162 162 GLY N N 1930 107.609 107.161 0.448 1 1 1751 . 4 1 1 A 163 163 ASP H H 1931 8.245 8.448 -0.203 1 1 1752 . 4 1 1 A 163 163 ASP HA H 1931 5.565 5.500 0.065 1 1 1755 . 4 1 1 A 163 163 ASP CA C 1931 53.628 53.273 0.355 1 1 1756 . 4 1 1 A 163 163 ASP CB C 1931 41.058 42.064 -1.006 1 1 1757 . 4 1 1 A 163 163 ASP N N 1931 121.979 119.281 2.698 1 1 1758 . 4 1 1 A 164 164 TYR H H 1932 9.606 9.453 0.153 1 1 1759 . 4 1 1 A 164 164 TYR HA H 1932 4.896 5.262 -0.366 1 1 1767 . 4 1 1 A 164 164 TYR CA C 1932 56.955 56.264 0.691 1 1 1768 . 4 1 1 A 164 164 TYR CB C 1932 40.339 41.442 -1.103 1 1 1771 . 4 1 1 A 164 164 TYR N N 1932 125.257 122.272 2.985 1 1 1772 . 4 1 1 A 165 165 SER H H 1933 9.095 9.171 -0.076 1 1 1773 . 4 1 1 A 165 165 SER HA H 1933 5.500 5.153 0.347 1 1 1776 . 4 1 1 A 165 165 SER CA C 1933 56.509 58.350 -1.841 1 1 1777 . 4 1 1 A 165 165 SER CB C 1933 64.486 64.191 0.295 1 1 1778 . 4 1 1 A 165 165 SER N N 1933 119.162 120.157 -0.995 1 1 1779 . 4 1 1 A 166 166 ILE H H 1934 9.598 9.589 0.009 1 1 1780 . 4 1 1 A 166 166 ILE HA H 1934 4.541 4.900 -0.359 1 1 1790 . 4 1 1 A 166 166 ILE CA C 1934 61.080 59.927 1.153 1 1 1791 . 4 1 1 A 166 166 ILE CB C 1934 39.282 39.161 0.121 1 1 1795 . 4 1 1 A 166 166 ILE N N 1934 128.701 128.094 0.607 1 1 1796 . 4 1 1 A 167 167 LEU H H 1935 9.359 9.357 0.002 1 1 1797 . 4 1 1 A 167 167 LEU HA H 1935 4.779 5.167 -0.388 1 1 1807 . 4 1 1 A 167 167 LEU CA C 1935 55.921 53.311 2.610 1 1 1808 . 4 1 1 A 167 167 LEU CB C 1935 42.473 44.960 -2.487 1 1 1811 . 4 1 1 A 167 167 LEU N N 1935 131.315 130.522 0.793 1 1 1812 . 4 1 1 A 168 168 VAL H H 1936 9.425 8.764 0.661 1 1 1813 . 4 1 1 A 168 168 VAL HA H 1936 4.617 4.890 -0.273 1 1 1821 . 4 1 1 A 168 168 VAL CA C 1936 61.418 60.928 0.490 1 1 1822 . 4 1 1 A 168 168 VAL CB C 1936 33.616 34.870 -1.254 1 1 1824 . 4 1 1 A 168 168 VAL N N 1936 126.961 126.258 0.703 1 1 1825 . 4 1 1 A 169 169 LYS H H 1937 8.643 8.260 0.383 1 1 1826 . 4 1 1 A 169 169 LYS HA H 1937 5.067 4.809 0.258 1 1 1835 . 4 1 1 A 169 169 LYS CA C 1937 53.949 55.623 -1.674 1 1 1836 . 4 1 1 A 169 169 LYS CB C 1937 36.691 36.260 0.431 1 1 1840 . 4 1 1 A 169 169 LYS N N 1937 124.773 127.241 -2.468 1 1 1841 . 4 1 1 A 170 170 TYR H H 1938 8.877 9.314 -0.437 1 1 1842 . 4 1 1 A 170 170 TYR HA H 1938 5.137 4.997 0.140 1 1 1849 . 4 1 1 A 170 170 TYR CA C 1938 57.034 57.520 -0.486 1 1 1850 . 4 1 1 A 170 170 TYR CB C 1938 42.105 41.933 0.172 1 1 1853 . 4 1 1 A 170 170 TYR N N 1938 122.371 126.863 -4.492 1 1 1854 . 4 1 1 A 171 171 ASN H H 1939 8.933 9.772 -0.839 1 1 1855 . 4 1 1 A 171 171 ASN HA H 1939 4.405 4.524 -0.119 1 1 1860 . 4 1 1 A 171 171 ASN CA C 1939 54.512 54.296 0.216 1 1 1861 . 4 1 1 A 171 171 ASN CB C 1939 37.025 37.267 -0.242 1 1 1862 . 4 1 1 A 171 171 ASN N N 1939 129.922 126.536 3.386 1 1 1864 . 4 1 1 A 172 172 GLU H H 1940 8.857 8.814 0.043 1 1 1865 . 4 1 1 A 172 172 GLU HA H 1940 3.511 4.065 -0.554 1 1 1870 . 4 1 1 A 172 172 GLU CA C 1940 57.910 57.629 0.281 1 1 1871 . 4 1 1 A 172 172 GLU CB C 1940 27.139 27.474 -0.335 1 1 1873 . 4 1 1 A 172 172 GLU N N 1940 107.943 116.252 -8.309 1 1 1874 . 4 1 1 A 173 173 GLN H H 1941 7.544 7.573 -0.029 1 1 1875 . 4 1 1 A 173 173 GLN HA H 1941 4.749 4.854 -0.105 1 1 1882 . 4 1 1 A 173 173 GLN CA C 1941 53.770 54.166 -0.396 1 1 1883 . 4 1 1 A 173 173 GLN CB C 1941 31.078 31.160 -0.082 1 1 1885 . 4 1 1 A 173 173 GLN N N 1941 119.865 120.013 -0.148 1 1 1887 . 4 1 1 A 174 174 HIS H H 1942 8.848 8.889 -0.041 1 1 1888 . 4 1 1 A 174 174 HIS HA H 1942 4.513 4.708 -0.195 1 1 1893 . 4 1 1 A 174 174 HIS CA C 1942 58.893 56.751 2.142 1 1 1894 . 4 1 1 A 174 174 HIS CB C 1942 32.196 30.368 1.828 1 1 1897 . 4 1 1 A 174 174 HIS N N 1942 126.437 121.736 4.701 1 1 1898 . 4 1 1 A 175 175 VAL H H 1943 8.483 8.345 0.138 1 1 1899 . 4 1 1 A 175 175 VAL HA H 1943 4.643 4.510 0.133 1 1 1907 . 4 1 1 A 175 175 VAL CA C 1943 60.025 60.678 -0.653 1 1 1908 . 4 1 1 A 175 175 VAL CB C 1943 29.439 32.062 -2.623 1 1 1911 . 4 1 1 A 175 175 VAL N N 1943 121.671 119.714 1.957 1 1 1912 . 4 1 1 A 176 176 PRO HA H 1944 4.045 4.239 -0.194 1 1 1919 . 4 1 1 A 176 176 PRO CA C 1944 64.943 65.108 -0.165 1 1 1920 . 4 1 1 A 176 176 PRO CB C 1944 31.120 31.626 -0.506 1 1 1923 . 4 1 1 A 177 177 GLY H H 1945 7.579 8.119 -0.540 1 1 1924 . 4 1 1 A 177 177 GLY HA2 H 1945 3.210 2.998 0.212 1 1 1925 . 4 1 1 A 177 177 GLY HA3 H 1945 2.311 3.263 -0.952 1 1 1926 . 4 1 1 A 177 177 GLY CA C 1945 44.184 44.247 -0.063 1 1 1927 . 4 1 1 A 177 177 GLY N N 1945 113.696 106.090 7.606 1 1 1928 . 4 1 1 A 178 178 SER H H 1946 7.469 7.184 0.285 1 1 1929 . 4 1 1 A 178 178 SER HA H 1946 4.023 3.438 0.585 1 1 1932 . 4 1 1 A 178 178 SER CA C 1946 54.593 55.914 -1.321 1 1 1933 . 4 1 1 A 178 178 SER CB C 1946 62.282 63.444 -1.162 1 1 1934 . 4 1 1 A 178 178 SER N N 1946 113.219 114.014 -0.795 1 1 1935 . 4 1 1 A 179 179 PRO HA H 1947 5.314 4.476 0.838 1 1 1942 . 4 1 1 A 179 179 PRO CA C 1947 62.198 62.285 -0.087 1 1 1943 . 4 1 1 A 179 179 PRO CB C 1947 33.923 32.202 1.721 1 1 1946 . 4 1 1 A 180 180 PHE H H 1948 9.395 8.624 0.771 1 1 1947 . 4 1 1 A 180 180 PHE HA H 1948 4.706 4.960 -0.254 1 1 1955 . 4 1 1 A 180 180 PHE CA C 1948 57.298 57.279 0.019 1 1 1956 . 4 1 1 A 180 180 PHE CB C 1948 41.116 41.169 -0.053 1 1 1960 . 4 1 1 A 180 180 PHE N N 1948 127.510 119.519 7.991 1 1 1961 . 4 1 1 A 181 181 THR H H 1949 9.111 8.813 0.298 1 1 1962 . 4 1 1 A 181 181 THR HA H 1949 5.091 5.353 -0.262 1 1 1967 . 4 1 1 A 181 181 THR CA C 1949 62.668 61.117 1.551 1 1 1968 . 4 1 1 A 181 181 THR CB C 1949 70.354 71.474 -1.120 1 1 1970 . 4 1 1 A 181 181 THR N N 1949 120.325 115.121 5.204 1 1 1971 . 4 1 1 A 182 182 ALA H H 1950 8.992 9.360 -0.368 1 1 1972 . 4 1 1 A 182 182 ALA HA H 1950 4.521 5.314 -0.793 1 1 1976 . 4 1 1 A 182 182 ALA CA C 1950 50.080 50.260 -0.180 1 1 1977 . 4 1 1 A 182 182 ALA CB C 1950 21.717 20.918 0.799 1 1 1978 . 4 1 1 A 182 182 ALA N N 1950 130.794 129.657 1.137 1 1 1979 . 4 1 1 A 183 183 ARG H H 1951 7.764 8.481 -0.717 1 1 1980 . 4 1 1 A 183 183 ARG HA H 1951 5.001 4.797 0.204 1 1 1988 . 4 1 1 A 183 183 ARG CA C 1951 55.116 55.110 0.006 1 1 1989 . 4 1 1 A 183 183 ARG CB C 1951 30.631 31.627 -0.996 1 1 1992 . 4 1 1 A 183 183 ARG N N 1951 121.920 123.562 -1.642 1 1 1994 . 4 1 1 A 184 184 VAL H H 1952 9.121 9.086 0.035 1 1 1995 . 4 1 1 A 184 184 VAL HA H 1952 4.865 4.632 0.233 1 1 2003 . 4 1 1 A 184 184 VAL CA C 1952 60.375 61.566 -1.191 1 1 2004 . 4 1 1 A 184 184 VAL CB C 1952 32.179 33.215 -1.036 1 1 2007 . 4 1 1 A 184 184 VAL N N 1952 125.421 127.422 -2.001 1 1 2008 . 4 1 1 A 185 185 THR H H 1953 8.799 8.353 0.446 1 1 2009 . 4 1 1 A 185 185 THR HA H 1953 4.829 4.874 -0.045 1 1 2014 . 4 1 1 A 185 185 THR CA C 1953 60.316 59.388 0.928 1 1 2015 . 4 1 1 A 185 185 THR CB C 1953 70.825 71.660 -0.835 1 1 2017 . 4 1 1 A 185 185 THR N N 1953 121.794 120.598 1.196 1 1 2018 . 4 1 1 A 186 186 GLY H H 1954 8.586 8.741 -0.155 1 1 2019 . 4 1 1 A 186 186 GLY HA2 H 1954 4.261 4.122 0.139 1 1 2020 . 4 1 1 A 186 186 GLY HA3 H 1954 4.033 4.128 -0.095 1 1 2021 . 4 1 1 A 186 186 GLY CA C 1954 45.038 45.248 -0.210 1 1 2022 . 4 1 1 A 186 186 GLY N N 1954 107.588 112.563 -4.975 1 1 2023 . 4 1 1 A 187 187 ASP H H 1955 8.386 9.160 -0.774 1 1 2024 . 4 1 1 A 187 187 ASP HA H 1955 4.772 4.518 0.254 1 1 2027 . 4 1 1 A 187 187 ASP CA C 1955 53.909 56.346 -2.437 1 1 2028 . 4 1 1 A 187 187 ASP CB C 1955 41.510 41.044 0.466 1 1 2029 . 4 1 1 A 187 187 ASP N N 1955 121.829 121.752 0.077 1 1 4 . 5 1 1 A 2 2 ALA HA H -2 4.368 4.495 -0.127 1 1 8 . 5 1 1 A 2 2 ALA CA C -2 52.604 51.674 0.930 1 1 9 . 5 1 1 A 2 2 ALA CB C -2 19.551 20.230 -0.679 1 1 32 . 5 1 1 A 5 5 PRO HA H 1773 4.433 4.573 -0.140 1 1 39 . 5 1 1 A 5 5 PRO CA C 1773 63.017 62.501 0.516 1 1 40 . 5 1 1 A 5 5 PRO CB C 1773 32.155 32.274 -0.119 1 1 43 . 5 1 1 A 6 6 GLU H H 1774 8.495 8.618 -0.123 1 1 44 . 5 1 1 A 6 6 GLU HA H 1774 4.242 4.656 -0.414 1 1 49 . 5 1 1 A 6 6 GLU CA C 1774 56.735 55.581 1.154 1 1 50 . 5 1 1 A 6 6 GLU CB C 1774 30.401 32.545 -2.144 1 1 52 . 5 1 1 A 6 6 GLU N N 1774 122.494 120.807 1.687 1 1 53 . 5 1 1 A 7 7 ARG H H 1775 8.275 8.590 -0.315 1 1 54 . 5 1 1 A 7 7 ARG HA H 1775 4.648 4.450 0.198 1 1 61 . 5 1 1 A 7 7 ARG CA C 1775 53.827 53.991 -0.164 1 1 62 . 5 1 1 A 7 7 ARG CB C 1775 30.417 30.677 -0.260 1 1 65 . 5 1 1 A 7 7 ARG N N 1775 124.017 128.447 -4.430 1 1 66 . 5 1 1 A 8 8 PRO HA H 1776 4.433 4.809 -0.376 1 1 73 . 5 1 1 A 8 8 PRO CA C 1776 63.036 62.448 0.588 1 1 74 . 5 1 1 A 8 8 PRO CB C 1776 32.201 32.679 -0.478 1 1 77 . 5 1 1 A 9 9 LEU H H 1777 8.349 8.877 -0.528 1 1 78 . 5 1 1 A 9 9 LEU HA H 1777 4.365 4.454 -0.089 1 1 88 . 5 1 1 A 9 9 LEU CA C 1777 55.275 55.023 0.252 1 1 89 . 5 1 1 A 9 9 LEU CB C 1777 42.376 42.078 0.298 1 1 93 . 5 1 1 A 9 9 LEU N N 1777 123.820 120.143 3.677 1 1 94 . 5 1 1 A 10 10 VAL H H 1778 7.989 7.648 0.341 1 1 95 . 5 1 1 A 10 10 VAL HA H 1778 4.182 4.463 -0.281 1 1 103 . 5 1 1 A 10 10 VAL CA C 1778 62.141 60.161 1.980 1 1 104 . 5 1 1 A 10 10 VAL CB C 1778 33.175 34.587 -1.412 1 1 106 . 5 1 1 A 10 10 VAL N N 1778 121.714 118.098 3.616 1 1 107 . 5 1 1 A 11 11 GLY H H 1779 8.450 8.791 -0.341 1 1 108 . 5 1 1 A 11 11 GLY HA2 H 1779 4.002 4.093 -0.091 1 1 109 . 5 1 1 A 11 11 GLY HA3 H 1779 4.002 4.093 -0.091 1 1 110 . 5 1 1 A 11 11 GLY CA C 1779 45.297 44.364 0.933 1 1 111 . 5 1 1 A 11 11 GLY N N 1779 113.826 116.013 -2.187 1 1 112 . 5 1 1 A 12 12 VAL H H 1780 8.013 8.328 -0.315 1 1 113 . 5 1 1 A 12 12 VAL HA H 1780 4.136 4.170 -0.034 1 1 121 . 5 1 1 A 12 12 VAL CA C 1780 62.466 61.677 0.789 1 1 122 . 5 1 1 A 12 12 VAL CB C 1780 32.752 32.839 -0.087 1 1 125 . 5 1 1 A 12 12 VAL N N 1780 120.109 117.592 2.517 1 1 126 . 5 1 1 A 13 13 ASN H H 1781 8.528 8.810 -0.282 1 1 127 . 5 1 1 A 13 13 ASN HA H 1781 4.712 5.105 -0.393 1 1 132 . 5 1 1 A 13 13 ASN CA C 1781 53.485 52.398 1.087 1 1 133 . 5 1 1 A 13 13 ASN CB C 1781 38.996 42.830 -3.834 1 1 134 . 5 1 1 A 13 13 ASN N N 1781 122.648 121.997 0.651 1 1 136 . 5 1 1 A 14 14 GLY H H 1782 8.283 8.892 -0.609 1 1 137 . 5 1 1 A 14 14 GLY HA2 H 1782 3.929 4.102 -0.173 1 1 138 . 5 1 1 A 14 14 GLY HA3 H 1782 3.929 4.102 -0.173 1 1 139 . 5 1 1 A 14 14 GLY CA C 1782 45.531 44.533 0.998 1 1 140 . 5 1 1 A 14 14 GLY N N 1782 110.229 112.648 -2.419 1 1 141 . 5 1 1 A 15 15 LEU H H 1783 7.925 8.623 -0.698 1 1 142 . 5 1 1 A 15 15 LEU HA H 1783 4.340 4.791 -0.451 1 1 152 . 5 1 1 A 15 15 LEU CA C 1783 55.045 53.792 1.253 1 1 153 . 5 1 1 A 15 15 LEU CB C 1783 42.682 43.391 -0.709 1 1 157 . 5 1 1 A 15 15 LEU N N 1783 122.626 121.691 0.935 1 1 158 . 5 1 1 A 16 16 ASP H H 1784 8.360 9.083 -0.723 1 1 159 . 5 1 1 A 16 16 ASP HA H 1784 4.747 4.358 0.389 1 1 162 . 5 1 1 A 16 16 ASP CA C 1784 53.939 56.803 -2.864 1 1 163 . 5 1 1 A 16 16 ASP CB C 1784 41.150 40.355 0.795 1 1 164 . 5 1 1 A 16 16 ASP N N 1784 122.868 123.617 -0.749 1 1 165 . 5 1 1 A 17 17 VAL H H 1785 8.201 7.851 0.350 1 1 166 . 5 1 1 A 17 17 VAL HA H 1785 4.237 3.972 0.265 1 1 174 . 5 1 1 A 17 17 VAL CA C 1785 62.881 65.280 -2.399 1 1 175 . 5 1 1 A 17 17 VAL CB C 1785 31.967 31.293 0.674 1 1 178 . 5 1 1 A 17 17 VAL N N 1785 121.110 116.093 5.017 1 1 179 . 5 1 1 A 18 18 THR H H 1786 8.291 7.759 0.532 1 1 180 . 5 1 1 A 18 18 THR HA H 1786 4.466 4.001 0.465 1 1 185 . 5 1 1 A 18 18 THR CA C 1786 62.388 64.337 -1.949 1 1 186 . 5 1 1 A 18 18 THR CB C 1786 69.719 68.843 0.876 1 1 188 . 5 1 1 A 18 18 THR N N 1786 115.267 116.889 -1.622 1 1 189 . 5 1 1 A 19 19 SER H H 1787 8.148 7.602 0.546 1 1 190 . 5 1 1 A 19 19 SER HA H 1787 4.542 4.472 0.070 1 1 193 . 5 1 1 A 19 19 SER CA C 1787 59.096 58.810 0.286 1 1 194 . 5 1 1 A 19 19 SER CB C 1787 63.993 62.910 1.083 1 1 195 . 5 1 1 A 19 19 SER N N 1787 118.576 114.462 4.114 1 1 196 . 5 1 1 A 20 20 LEU H H 1788 8.263 7.261 1.002 1 1 197 . 5 1 1 A 20 20 LEU HA H 1788 4.243 4.151 0.092 1 1 207 . 5 1 1 A 20 20 LEU CA C 1788 54.087 55.175 -1.088 1 1 208 . 5 1 1 A 20 20 LEU CB C 1788 43.006 42.086 0.920 1 1 212 . 5 1 1 A 20 20 LEU N N 1788 125.834 123.513 2.321 1 1 213 . 5 1 1 A 21 21 ARG H H 1789 8.191 7.828 0.363 1 1 214 . 5 1 1 A 21 21 ARG HA H 1789 4.080 4.252 -0.172 1 1 222 . 5 1 1 A 21 21 ARG CA C 1789 54.894 54.119 0.775 1 1 223 . 5 1 1 A 21 21 ARG CB C 1789 30.881 30.669 0.212 1 1 226 . 5 1 1 A 21 21 ARG N N 1789 127.213 122.362 4.851 1 1 228 . 5 1 1 A 22 22 PRO HA H 1790 4.441 4.658 -0.217 1 1 233 . 5 1 1 A 22 22 PRO CA C 1790 62.882 62.465 0.417 1 1 234 . 5 1 1 A 22 22 PRO CB C 1790 32.204 32.362 -0.158 1 1 237 . 5 1 1 A 23 23 PHE H H 1791 8.336 8.242 0.094 1 1 238 . 5 1 1 A 23 23 PHE HA H 1791 4.701 5.040 -0.339 1 1 246 . 5 1 1 A 23 23 PHE CA C 1791 57.504 56.648 0.856 1 1 247 . 5 1 1 A 23 23 PHE CB C 1791 42.192 42.073 0.119 1 1 251 . 5 1 1 A 23 23 PHE N N 1791 122.145 123.036 -0.891 1 1 252 . 5 1 1 A 24 24 ASP H H 1792 6.954 8.790 -1.836 1 1 253 . 5 1 1 A 24 24 ASP HA H 1792 5.039 5.235 -0.196 1 1 256 . 5 1 1 A 24 24 ASP CA C 1792 52.871 52.410 0.461 1 1 257 . 5 1 1 A 24 24 ASP CB C 1792 44.696 44.524 0.172 1 1 258 . 5 1 1 A 24 24 ASP N N 1792 127.481 125.770 1.711 1 1 259 . 5 1 1 A 25 25 LEU H H 1793 8.372 8.566 -0.194 1 1 260 . 5 1 1 A 25 25 LEU HA H 1793 4.336 4.904 -0.568 1 1 270 . 5 1 1 A 25 25 LEU CA C 1793 54.860 53.275 1.585 1 1 271 . 5 1 1 A 25 25 LEU CB C 1793 47.575 46.148 1.427 1 1 274 . 5 1 1 A 25 25 LEU N N 1793 123.241 122.276 0.965 1 1 275 . 5 1 1 A 26 26 VAL H H 1794 8.489 9.036 -0.547 1 1 276 . 5 1 1 A 26 26 VAL HA H 1794 4.903 5.056 -0.153 1 1 284 . 5 1 1 A 26 26 VAL CA C 1794 61.669 60.078 1.591 1 1 285 . 5 1 1 A 26 26 VAL CB C 1794 32.458 34.256 -1.798 1 1 288 . 5 1 1 A 26 26 VAL N N 1794 128.849 123.013 5.836 1 1 289 . 5 1 1 A 27 27 ILE H H 1795 9.101 9.212 -0.111 1 1 290 . 5 1 1 A 27 27 ILE HA H 1795 4.701 4.380 0.321 1 1 300 . 5 1 1 A 27 27 ILE CA C 1795 57.433 57.337 0.096 1 1 301 . 5 1 1 A 27 27 ILE CB C 1795 41.865 41.544 0.321 1 1 305 . 5 1 1 A 27 27 ILE N N 1795 127.511 128.025 -0.514 1 1 306 . 5 1 1 A 28 28 PRO HA H 1796 4.838 4.892 -0.054 1 1 313 . 5 1 1 A 28 28 PRO CA C 1796 62.406 62.366 0.040 1 1 314 . 5 1 1 A 28 28 PRO CB C 1796 30.684 30.261 0.423 1 1 317 . 5 1 1 A 29 29 PHE H H 1797 8.255 8.407 -0.152 1 1 318 . 5 1 1 A 29 29 PHE HA H 1797 4.151 4.976 -0.825 1 1 326 . 5 1 1 A 29 29 PHE CA C 1797 60.405 57.688 2.717 1 1 327 . 5 1 1 A 29 29 PHE CB C 1797 41.395 42.790 -1.395 1 1 331 . 5 1 1 A 29 29 PHE N N 1797 128.572 122.919 5.653 1 1 332 . 5 1 1 A 30 30 THR H H 1798 7.433 7.671 -0.238 1 1 333 . 5 1 1 A 30 30 THR HA H 1798 4.108 4.857 -0.749 1 1 338 . 5 1 1 A 30 30 THR CA C 1798 61.473 61.184 0.289 1 1 339 . 5 1 1 A 30 30 THR CB C 1798 69.324 70.883 -1.559 1 1 341 . 5 1 1 A 30 30 THR N N 1798 123.124 118.246 4.878 1 1 342 . 5 1 1 A 31 31 ILE H H 1799 8.402 8.804 -0.402 1 1 343 . 5 1 1 A 31 31 ILE HA H 1799 3.653 4.295 -0.642 1 1 353 . 5 1 1 A 31 31 ILE CA C 1799 61.802 60.983 0.819 1 1 354 . 5 1 1 A 31 31 ILE CB C 1799 38.548 37.459 1.089 1 1 358 . 5 1 1 A 31 31 ILE N N 1799 128.616 127.023 1.593 1 1 359 . 5 1 1 A 32 32 LYS H H 1800 7.742 8.513 -0.771 1 1 360 . 5 1 1 A 32 32 LYS HA H 1800 4.558 4.351 0.207 1 1 365 . 5 1 1 A 32 32 LYS CA C 1800 56.566 58.091 -1.525 1 1 366 . 5 1 1 A 32 32 LYS CB C 1800 31.982 32.679 -0.697 1 1 368 . 5 1 1 A 32 32 LYS N N 1800 128.656 128.386 0.270 1 1 369 . 5 1 1 A 33 33 LYS HA H 1801 4.531 4.551 -0.020 1 1 378 . 5 1 1 A 33 33 LYS CA C 1801 56.310 56.384 -0.074 1 1 379 . 5 1 1 A 33 33 LYS CB C 1801 33.027 34.450 -1.423 1 1 383 . 5 1 1 A 34 34 GLY H H 1802 8.088 8.289 -0.201 1 1 384 . 5 1 1 A 34 34 GLY HA2 H 1802 4.159 4.013 0.146 1 1 385 . 5 1 1 A 34 34 GLY HA3 H 1802 3.712 4.027 -0.315 1 1 386 . 5 1 1 A 34 34 GLY CA C 1802 45.302 44.300 1.002 1 1 387 . 5 1 1 A 34 34 GLY N N 1802 110.338 110.169 0.169 1 1 388 . 5 1 1 A 35 35 GLU H H 1803 8.219 8.034 0.185 1 1 389 . 5 1 1 A 35 35 GLU HA H 1803 4.692 4.926 -0.234 1 1 394 . 5 1 1 A 35 35 GLU CA C 1803 55.160 55.089 0.071 1 1 395 . 5 1 1 A 35 35 GLU CB C 1803 32.407 33.586 -1.179 1 1 397 . 5 1 1 A 35 35 GLU N N 1803 119.576 121.337 -1.761 1 1 398 . 5 1 1 A 36 36 ILE H H 1804 8.869 8.608 0.261 1 1 399 . 5 1 1 A 36 36 ILE HA H 1804 5.468 4.909 0.559 1 1 409 . 5 1 1 A 36 36 ILE CA C 1804 58.861 59.893 -1.032 1 1 410 . 5 1 1 A 36 36 ILE CB C 1804 41.007 41.309 -0.302 1 1 414 . 5 1 1 A 36 36 ILE N N 1804 128.141 123.493 4.648 1 1 415 . 5 1 1 A 37 37 THR H H 1805 9.075 8.798 0.277 1 1 416 . 5 1 1 A 37 37 THR HA H 1805 4.703 5.149 -0.446 1 1 421 . 5 1 1 A 37 37 THR CA C 1805 59.932 60.070 -0.138 1 1 422 . 5 1 1 A 37 37 THR CB C 1805 72.441 72.534 -0.093 1 1 424 . 5 1 1 A 37 37 THR N N 1805 119.846 117.948 1.898 1 1 425 . 5 1 1 A 38 38 GLY H H 1806 8.468 8.365 0.103 1 1 426 . 5 1 1 A 38 38 GLY HA2 H 1806 5.076 4.324 0.752 1 1 427 . 5 1 1 A 38 38 GLY HA3 H 1806 3.503 4.345 -0.842 1 1 428 . 5 1 1 A 38 38 GLY CA C 1806 45.593 45.675 -0.082 1 1 429 . 5 1 1 A 38 38 GLY N N 1806 107.815 108.657 -0.842 1 1 430 . 5 1 1 A 39 39 GLU H H 1807 8.519 8.575 -0.056 1 1 431 . 5 1 1 A 39 39 GLU HA H 1807 4.713 5.138 -0.425 1 1 436 . 5 1 1 A 39 39 GLU CA C 1807 56.936 55.473 1.463 1 1 437 . 5 1 1 A 39 39 GLU CB C 1807 34.937 33.791 1.146 1 1 439 . 5 1 1 A 39 39 GLU N N 1807 120.173 119.866 0.307 1 1 440 . 5 1 1 A 40 40 VAL H H 1808 9.156 9.415 -0.259 1 1 441 . 5 1 1 A 40 40 VAL HA H 1808 4.778 4.616 0.162 1 1 449 . 5 1 1 A 40 40 VAL CA C 1808 60.574 61.041 -0.467 1 1 450 . 5 1 1 A 40 40 VAL CB C 1808 34.168 33.326 0.842 1 1 452 . 5 1 1 A 40 40 VAL N N 1808 126.330 127.152 -0.822 1 1 453 . 5 1 1 A 41 41 ARG H H 1809 9.044 9.202 -0.158 1 1 454 . 5 1 1 A 41 41 ARG HA H 1809 4.778 4.923 -0.145 1 1 462 . 5 1 1 A 41 41 ARG CA C 1809 55.317 54.017 1.300 1 1 463 . 5 1 1 A 41 41 ARG CB C 1809 31.940 32.146 -0.206 1 1 466 . 5 1 1 A 41 41 ARG N N 1809 127.098 126.321 0.777 1 1 468 . 5 1 1 A 42 42 MET H H 1810 8.264 8.886 -0.622 1 1 469 . 5 1 1 A 42 42 MET HA H 1810 4.050 4.152 -0.102 1 1 477 . 5 1 1 A 42 42 MET CA C 1810 53.716 54.486 -0.770 1 1 478 . 5 1 1 A 42 42 MET CB C 1810 32.779 32.156 0.623 1 1 481 . 5 1 1 A 42 42 MET N N 1810 123.461 123.011 0.450 1 1 482 . 5 1 1 A 43 43 PRO HA H 1811 4.179 4.359 -0.180 1 1 489 . 5 1 1 A 43 43 PRO CA C 1811 66.422 64.112 2.310 1 1 490 . 5 1 1 A 43 43 PRO CB C 1811 31.462 31.701 -0.239 1 1 493 . 5 1 1 A 44 44 SER H H 1812 8.860 7.656 1.204 1 1 494 . 5 1 1 A 44 44 SER HA H 1812 5.516 4.194 1.322 1 1 497 . 5 1 1 A 44 44 SER CA C 1812 59.937 58.773 1.164 1 1 498 . 5 1 1 A 44 44 SER CB C 1812 62.755 63.724 -0.969 1 1 499 . 5 1 1 A 44 44 SER N N 1812 112.267 109.948 2.319 1 1 500 . 5 1 1 A 45 45 GLY H H 1813 8.368 7.954 0.414 1 1 501 . 5 1 1 A 45 45 GLY HA2 H 1813 4.461 3.864 0.597 1 1 502 . 5 1 1 A 45 45 GLY HA3 H 1813 3.569 3.876 -0.307 1 1 503 . 5 1 1 A 45 45 GLY CA C 1813 44.525 45.043 -0.518 1 1 504 . 5 1 1 A 45 45 GLY N N 1813 112.727 111.050 1.677 1 1 505 . 5 1 1 A 46 46 LYS H H 1814 7.126 7.703 -0.577 1 1 506 . 5 1 1 A 46 46 LYS HA H 1814 4.206 4.305 -0.099 1 1 515 . 5 1 1 A 46 46 LYS CA C 1814 57.460 56.485 0.975 1 1 516 . 5 1 1 A 46 46 LYS CB C 1814 33.453 33.746 -0.293 1 1 520 . 5 1 1 A 46 46 LYS N N 1814 122.101 120.633 1.468 1 1 521 . 5 1 1 A 47 47 VAL H H 1815 8.056 8.927 -0.871 1 1 522 . 5 1 1 A 47 47 VAL HA H 1815 5.400 5.107 0.293 1 1 530 . 5 1 1 A 47 47 VAL CA C 1815 60.048 59.419 0.629 1 1 531 . 5 1 1 A 47 47 VAL CB C 1815 35.044 36.086 -1.042 1 1 534 . 5 1 1 A 47 47 VAL N N 1815 118.680 118.152 0.528 1 1 535 . 5 1 1 A 48 48 ALA H H 1816 9.110 8.626 0.484 1 1 536 . 5 1 1 A 48 48 ALA HA H 1816 4.804 4.862 -0.058 1 1 540 . 5 1 1 A 48 48 ALA CA C 1816 50.808 51.212 -0.404 1 1 541 . 5 1 1 A 48 48 ALA CB C 1816 24.108 23.927 0.181 1 1 542 . 5 1 1 A 48 48 ALA N N 1816 128.274 124.006 4.268 1 1 543 . 5 1 1 A 49 49 GLN H H 1817 8.725 8.587 0.138 1 1 544 . 5 1 1 A 49 49 GLN HA H 1817 5.069 4.853 0.216 1 1 551 . 5 1 1 A 49 49 GLN CA C 1817 53.524 52.225 1.299 1 1 552 . 5 1 1 A 49 49 GLN CB C 1817 30.432 29.637 0.795 1 1 554 . 5 1 1 A 49 49 GLN N N 1817 120.102 117.968 2.134 1 1 556 . 5 1 1 A 50 50 PRO HA H 1818 5.136 4.870 0.266 1 1 563 . 5 1 1 A 50 50 PRO CA C 1818 61.966 62.475 -0.509 1 1 564 . 5 1 1 A 50 50 PRO CB C 1818 32.722 32.516 0.206 1 1 567 . 5 1 1 A 51 51 THR H H 1819 9.072 8.726 0.346 1 1 568 . 5 1 1 A 51 51 THR HA H 1819 4.566 4.793 -0.227 1 1 573 . 5 1 1 A 51 51 THR CA C 1819 62.695 61.246 1.449 1 1 574 . 5 1 1 A 51 51 THR CB C 1819 70.056 69.789 0.267 1 1 576 . 5 1 1 A 51 51 THR N N 1819 117.512 113.894 3.618 1 1 577 . 5 1 1 A 52 52 ILE H H 1820 8.900 9.365 -0.465 1 1 578 . 5 1 1 A 52 52 ILE HA H 1820 4.905 4.878 0.027 1 1 588 . 5 1 1 A 52 52 ILE CA C 1820 60.869 59.911 0.958 1 1 589 . 5 1 1 A 52 52 ILE CB C 1820 39.670 39.385 0.285 1 1 593 . 5 1 1 A 52 52 ILE N N 1820 129.513 129.796 -0.283 1 1 594 . 5 1 1 A 53 53 THR H H 1821 9.200 9.443 -0.243 1 1 595 . 5 1 1 A 53 53 THR HA H 1821 4.541 4.884 -0.343 1 1 600 . 5 1 1 A 53 53 THR CA C 1821 61.084 61.951 -0.867 1 1 601 . 5 1 1 A 53 53 THR CB C 1821 71.410 71.683 -0.273 1 1 603 . 5 1 1 A 53 53 THR N N 1821 125.271 124.123 1.148 1 1 604 . 5 1 1 A 54 54 ASP H H 1822 8.918 8.636 0.282 1 1 605 . 5 1 1 A 54 54 ASP HA H 1822 4.756 4.782 -0.026 1 1 608 . 5 1 1 A 54 54 ASP CA C 1822 53.906 54.422 -0.516 1 1 609 . 5 1 1 A 54 54 ASP CB C 1822 41.443 41.511 -0.068 1 1 610 . 5 1 1 A 54 54 ASP N N 1822 126.647 126.686 -0.039 1 1 611 . 5 1 1 A 55 55 ASN H H 1823 8.342 8.585 -0.243 1 1 612 . 5 1 1 A 55 55 ASN HA H 1823 4.704 4.661 0.043 1 1 617 . 5 1 1 A 55 55 ASN CA C 1823 54.421 53.114 1.307 1 1 618 . 5 1 1 A 55 55 ASN CB C 1823 38.557 38.888 -0.331 1 1 619 . 5 1 1 A 55 55 ASN N N 1823 126.271 124.440 1.831 1 1 621 . 5 1 1 A 56 56 LYS H H 1824 9.232 7.937 1.295 1 1 622 . 5 1 1 A 56 56 LYS HA H 1824 4.099 3.900 0.199 1 1 631 . 5 1 1 A 56 56 LYS CA C 1824 58.015 57.743 0.272 1 1 632 . 5 1 1 A 56 56 LYS CB C 1824 28.691 32.158 -3.467 1 1 636 . 5 1 1 A 56 56 LYS N N 1824 115.352 118.207 -2.855 1 1 637 . 5 1 1 A 57 57 ASP H H 1825 7.905 8.100 -0.195 1 1 638 . 5 1 1 A 57 57 ASP HA H 1825 4.791 4.814 -0.023 1 1 641 . 5 1 1 A 57 57 ASP CA C 1825 52.401 53.413 -1.012 1 1 642 . 5 1 1 A 57 57 ASP CB C 1825 41.166 41.104 0.062 1 1 643 . 5 1 1 A 57 57 ASP N N 1825 119.741 120.074 -0.333 1 1 644 . 5 1 1 A 58 58 GLY H H 1826 8.930 8.762 0.168 1 1 645 . 5 1 1 A 58 58 GLY HA2 H 1826 4.265 3.867 0.398 1 1 646 . 5 1 1 A 58 58 GLY HA3 H 1826 3.712 3.887 -0.175 1 1 647 . 5 1 1 A 58 58 GLY CA C 1826 44.870 45.396 -0.526 1 1 648 . 5 1 1 A 58 58 GLY N N 1826 109.578 108.030 1.548 1 1 649 . 5 1 1 A 59 59 THR H H 1827 8.004 7.608 0.396 1 1 650 . 5 1 1 A 59 59 THR HA H 1827 5.394 5.053 0.341 1 1 655 . 5 1 1 A 59 59 THR CA C 1827 60.262 59.358 0.904 1 1 656 . 5 1 1 A 59 59 THR CB C 1827 73.892 72.523 1.369 1 1 658 . 5 1 1 A 59 59 THR N N 1827 112.179 110.242 1.937 1 1 659 . 5 1 1 A 60 60 VAL H H 1828 8.822 9.154 -0.332 1 1 660 . 5 1 1 A 60 60 VAL HA H 1828 5.124 4.924 0.200 1 1 668 . 5 1 1 A 60 60 VAL CA C 1828 59.430 59.199 0.231 1 1 669 . 5 1 1 A 60 60 VAL CB C 1828 35.088 35.092 -0.004 1 1 672 . 5 1 1 A 60 60 VAL N N 1828 115.300 116.074 -0.774 1 1 673 . 5 1 1 A 61 61 THR H H 1829 9.115 8.806 0.309 1 1 674 . 5 1 1 A 61 61 THR HA H 1829 5.128 4.955 0.173 1 1 679 . 5 1 1 A 61 61 THR CA C 1829 61.934 61.712 0.222 1 1 680 . 5 1 1 A 61 61 THR CB C 1829 70.561 70.590 -0.029 1 1 682 . 5 1 1 A 61 61 THR N N 1829 121.210 119.014 2.196 1 1 683 . 5 1 1 A 62 62 VAL H H 1830 9.530 9.287 0.243 1 1 684 . 5 1 1 A 62 62 VAL HA H 1830 4.803 5.083 -0.280 1 1 692 . 5 1 1 A 62 62 VAL CA C 1830 60.580 60.670 -0.090 1 1 693 . 5 1 1 A 62 62 VAL CB C 1830 33.747 34.241 -0.494 1 1 696 . 5 1 1 A 62 62 VAL N N 1830 129.896 126.865 3.031 1 1 697 . 5 1 1 A 63 63 ARG H H 1831 8.879 9.092 -0.213 1 1 698 . 5 1 1 A 63 63 ARG HA H 1831 5.282 5.029 0.253 1 1 705 . 5 1 1 A 63 63 ARG CA C 1831 54.759 54.161 0.598 1 1 706 . 5 1 1 A 63 63 ARG CB C 1831 34.410 34.213 0.197 1 1 709 . 5 1 1 A 63 63 ARG N N 1831 125.701 125.827 -0.126 1 1 710 . 5 1 1 A 64 64 TYR H H 1832 8.878 8.802 0.076 1 1 711 . 5 1 1 A 64 64 TYR HA H 1832 4.888 4.913 -0.025 1 1 718 . 5 1 1 A 64 64 TYR CA C 1832 57.694 57.943 -0.249 1 1 719 . 5 1 1 A 64 64 TYR CB C 1832 42.389 42.303 0.086 1 1 722 . 5 1 1 A 64 64 TYR N N 1832 122.731 123.482 -0.751 1 1 723 . 5 1 1 A 65 65 ALA H H 1833 7.925 8.278 -0.353 1 1 724 . 5 1 1 A 65 65 ALA HA H 1833 4.736 4.511 0.225 1 1 728 . 5 1 1 A 65 65 ALA CA C 1833 47.938 49.087 -1.149 1 1 729 . 5 1 1 A 65 65 ALA CB C 1833 18.320 19.686 -1.366 1 1 730 . 5 1 1 A 65 65 ALA N N 1833 135.415 129.087 6.328 1 1 731 . 5 1 1 A 66 66 PRO HA H 1834 4.198 4.678 -0.480 1 1 738 . 5 1 1 A 66 66 PRO CA C 1834 62.701 62.473 0.228 1 1 739 . 5 1 1 A 66 66 PRO CB C 1834 34.445 33.258 1.187 1 1 742 . 5 1 1 A 67 67 SER H H 1835 9.019 8.715 0.304 1 1 743 . 5 1 1 A 67 67 SER HA H 1835 4.555 4.632 -0.077 1 1 746 . 5 1 1 A 67 67 SER CA C 1835 57.320 57.740 -0.420 1 1 747 . 5 1 1 A 67 67 SER CB C 1835 64.778 66.040 -1.262 1 1 748 . 5 1 1 A 67 67 SER N N 1835 112.422 115.240 -2.818 1 1 749 . 5 1 1 A 68 68 GLU H H 1836 7.625 7.770 -0.145 1 1 750 . 5 1 1 A 68 68 GLU HA H 1836 4.513 4.704 -0.191 1 1 755 . 5 1 1 A 68 68 GLU CA C 1836 54.777 55.154 -0.377 1 1 756 . 5 1 1 A 68 68 GLU CB C 1836 33.981 32.837 1.144 1 1 758 . 5 1 1 A 68 68 GLU N N 1836 123.025 117.881 5.144 1 1 759 . 5 1 1 A 69 69 ALA H H 1837 8.133 8.529 -0.396 1 1 760 . 5 1 1 A 69 69 ALA HA H 1837 4.088 4.248 -0.160 1 1 764 . 5 1 1 A 69 69 ALA CA C 1837 51.070 52.212 -1.142 1 1 765 . 5 1 1 A 69 69 ALA CB C 1837 19.665 20.074 -0.409 1 1 766 . 5 1 1 A 69 69 ALA N N 1837 122.311 124.859 -2.548 1 1 767 . 5 1 1 A 70 70 GLY H H 1838 9.120 8.100 1.020 1 1 768 . 5 1 1 A 70 70 GLY HA2 H 1838 4.453 3.807 0.646 1 1 769 . 5 1 1 A 70 70 GLY HA3 H 1838 2.953 3.993 -1.040 1 1 770 . 5 1 1 A 70 70 GLY CA C 1838 43.362 43.372 -0.010 1 1 771 . 5 1 1 A 70 70 GLY N N 1838 107.031 106.013 1.018 1 1 772 . 5 1 1 A 71 71 LEU H H 1839 9.096 8.299 0.797 1 1 773 . 5 1 1 A 71 71 LEU HA H 1839 4.336 4.691 -0.355 1 1 783 . 5 1 1 A 71 71 LEU CA C 1839 56.657 54.326 2.331 1 1 784 . 5 1 1 A 71 71 LEU CB C 1839 42.032 43.672 -1.640 1 1 788 . 5 1 1 A 71 71 LEU N N 1839 127.931 121.601 6.330 1 1 789 . 5 1 1 A 72 72 HIS H H 1840 9.359 9.406 -0.047 1 1 790 . 5 1 1 A 72 72 HIS HA H 1840 4.595 5.088 -0.493 1 1 796 . 5 1 1 A 72 72 HIS CA C 1840 54.539 53.744 0.795 1 1 797 . 5 1 1 A 72 72 HIS CB C 1840 31.421 32.709 -1.288 1 1 800 . 5 1 1 A 72 72 HIS N N 1840 128.527 125.154 3.373 1 1 802 . 5 1 1 A 73 73 GLU H H 1841 7.925 8.726 -0.801 1 1 803 . 5 1 1 A 73 73 GLU HA H 1841 5.142 5.199 -0.057 1 1 808 . 5 1 1 A 73 73 GLU CA C 1841 54.381 54.589 -0.208 1 1 809 . 5 1 1 A 73 73 GLU CB C 1841 34.043 33.478 0.565 1 1 811 . 5 1 1 A 73 73 GLU N N 1841 119.347 121.950 -2.603 1 1 812 . 5 1 1 A 74 74 MET H H 1842 9.383 9.188 0.195 1 1 813 . 5 1 1 A 74 74 MET HA H 1842 5.548 5.140 0.408 1 1 821 . 5 1 1 A 74 74 MET CA C 1842 53.859 54.521 -0.662 1 1 822 . 5 1 1 A 74 74 MET CB C 1842 38.571 36.078 2.493 1 1 825 . 5 1 1 A 74 74 MET N N 1842 124.747 124.829 -0.082 1 1 826 . 5 1 1 A 75 75 ASP H H 1843 9.005 9.436 -0.431 1 1 827 . 5 1 1 A 75 75 ASP HA H 1843 5.277 5.546 -0.269 1 1 830 . 5 1 1 A 75 75 ASP CA C 1843 52.774 52.783 -0.009 1 1 831 . 5 1 1 A 75 75 ASP CB C 1843 43.493 44.217 -0.724 1 1 832 . 5 1 1 A 75 75 ASP N N 1843 128.148 125.505 2.643 1 1 833 . 5 1 1 A 76 76 ILE H H 1844 9.434 8.910 0.524 1 1 834 . 5 1 1 A 76 76 ILE HA H 1844 4.672 4.873 -0.201 1 1 844 . 5 1 1 A 76 76 ILE CA C 1844 60.715 59.960 0.755 1 1 845 . 5 1 1 A 76 76 ILE CB C 1844 39.470 41.313 -1.843 1 1 849 . 5 1 1 A 76 76 ILE N N 1844 124.097 121.597 2.500 1 1 850 . 5 1 1 A 77 77 ARG H H 1845 8.888 9.043 -0.155 1 1 851 . 5 1 1 A 77 77 ARG HA H 1845 5.050 4.851 0.199 1 1 859 . 5 1 1 A 77 77 ARG CA C 1845 53.780 54.300 -0.520 1 1 860 . 5 1 1 A 77 77 ARG CB C 1845 34.564 33.631 0.933 1 1 863 . 5 1 1 A 77 77 ARG N N 1845 124.944 124.299 0.645 1 1 865 . 5 1 1 A 78 78 TYR H H 1846 8.974 9.202 -0.228 1 1 866 . 5 1 1 A 78 78 TYR HA H 1846 5.151 4.994 0.157 1 1 873 . 5 1 1 A 78 78 TYR CA C 1846 55.909 57.612 -1.703 1 1 874 . 5 1 1 A 78 78 TYR CB C 1846 41.732 40.856 0.876 1 1 877 . 5 1 1 A 78 78 TYR N N 1846 121.774 124.168 -2.394 1 1 878 . 5 1 1 A 79 79 ASP H H 1847 9.026 9.309 -0.283 1 1 879 . 5 1 1 A 79 79 ASP HA H 1847 4.127 4.224 -0.097 1 1 882 . 5 1 1 A 79 79 ASP CA C 1847 55.808 55.092 0.716 1 1 883 . 5 1 1 A 79 79 ASP CB C 1847 39.181 39.559 -0.378 1 1 884 . 5 1 1 A 79 79 ASP N N 1847 131.304 127.938 3.366 1 1 885 . 5 1 1 A 80 80 ASN H H 1848 8.608 8.590 0.018 1 1 886 . 5 1 1 A 80 80 ASN HA H 1848 3.990 4.333 -0.343 1 1 891 . 5 1 1 A 80 80 ASN CA C 1848 55.149 54.788 0.361 1 1 892 . 5 1 1 A 80 80 ASN CB C 1848 38.470 36.959 1.511 1 1 893 . 5 1 1 A 80 80 ASN N N 1848 108.490 109.196 -0.706 1 1 895 . 5 1 1 A 81 81 MET H H 1849 7.820 7.993 -0.173 1 1 896 . 5 1 1 A 81 81 MET HA H 1849 4.819 4.861 -0.042 1 1 904 . 5 1 1 A 81 81 MET CA C 1849 53.852 53.848 0.004 1 1 905 . 5 1 1 A 81 81 MET CB C 1849 34.665 33.425 1.240 1 1 908 . 5 1 1 A 81 81 MET N N 1849 121.878 118.407 3.471 1 1 909 . 5 1 1 A 82 82 HIS H H 1850 8.575 8.793 -0.218 1 1 910 . 5 1 1 A 82 82 HIS HA H 1850 4.539 4.672 -0.133 1 1 915 . 5 1 1 A 82 82 HIS CA C 1850 58.819 57.347 1.472 1 1 916 . 5 1 1 A 82 82 HIS CB C 1850 32.419 30.582 1.837 1 1 919 . 5 1 1 A 82 82 HIS N N 1850 124.291 120.844 3.447 1 1 920 . 5 1 1 A 83 83 ILE H H 1851 8.333 8.102 0.231 1 1 921 . 5 1 1 A 83 83 ILE HA H 1851 4.608 4.379 0.229 1 1 931 . 5 1 1 A 83 83 ILE CA C 1851 60.727 59.404 1.323 1 1 932 . 5 1 1 A 83 83 ILE CB C 1851 35.928 37.631 -1.703 1 1 936 . 5 1 1 A 83 83 ILE N N 1851 120.786 120.975 -0.189 1 1 937 . 5 1 1 A 84 84 PRO HA H 1852 4.426 4.338 0.088 1 1 944 . 5 1 1 A 84 84 PRO CA C 1852 65.249 64.044 1.205 1 1 945 . 5 1 1 A 84 84 PRO CB C 1852 31.120 31.477 -0.357 1 1 948 . 5 1 1 A 85 85 GLY H H 1853 8.498 9.019 -0.521 1 1 949 . 5 1 1 A 85 85 GLY HA2 H 1853 4.284 4.043 0.241 1 1 950 . 5 1 1 A 85 85 GLY HA3 H 1853 3.397 4.104 -0.707 1 1 951 . 5 1 1 A 85 85 GLY CA C 1853 44.913 45.214 -0.301 1 1 952 . 5 1 1 A 85 85 GLY N N 1853 114.093 113.757 0.336 1 1 953 . 5 1 1 A 86 86 SER H H 1854 7.823 8.058 -0.235 1 1 954 . 5 1 1 A 86 86 SER HA H 1854 4.834 4.760 0.074 1 1 957 . 5 1 1 A 86 86 SER CA C 1854 55.628 55.648 -0.020 1 1 958 . 5 1 1 A 86 86 SER CB C 1854 63.063 64.009 -0.946 1 1 959 . 5 1 1 A 86 86 SER N N 1854 112.722 117.815 -5.093 1 1 960 . 5 1 1 A 87 87 PRO HA H 1855 5.681 4.783 0.898 1 1 967 . 5 1 1 A 87 87 PRO CA C 1855 63.079 62.513 0.566 1 1 968 . 5 1 1 A 87 87 PRO CB C 1855 34.406 32.624 1.782 1 1 971 . 5 1 1 A 88 88 LEU H H 1856 9.168 8.957 0.211 1 1 972 . 5 1 1 A 88 88 LEU HA H 1856 4.909 5.158 -0.249 1 1 982 . 5 1 1 A 88 88 LEU CA C 1856 53.839 53.429 0.410 1 1 983 . 5 1 1 A 88 88 LEU CB C 1856 45.558 45.322 0.236 1 1 987 . 5 1 1 A 88 88 LEU N N 1856 122.495 121.365 1.130 1 1 988 . 5 1 1 A 89 89 GLN H H 1857 9.583 8.836 0.747 1 1 989 . 5 1 1 A 89 89 GLN HA H 1857 5.508 5.262 0.246 1 1 996 . 5 1 1 A 89 89 GLN CA C 1857 54.609 55.250 -0.641 1 1 997 . 5 1 1 A 89 89 GLN CB C 1857 32.840 32.680 0.160 1 1 999 . 5 1 1 A 89 89 GLN N N 1857 119.151 121.515 -2.364 1 1 1001 . 5 1 1 A 90 90 PHE H H 1858 8.600 8.705 -0.105 1 1 1002 . 5 1 1 A 90 90 PHE HA H 1858 5.095 5.137 -0.042 1 1 1010 . 5 1 1 A 90 90 PHE CA C 1858 56.161 56.123 0.038 1 1 1011 . 5 1 1 A 90 90 PHE CB C 1858 41.411 40.663 0.748 1 1 1015 . 5 1 1 A 90 90 PHE N N 1858 118.242 119.696 -1.454 1 1 1016 . 5 1 1 A 91 91 TYR H H 1859 9.892 8.790 1.102 1 1 1017 . 5 1 1 A 91 91 TYR HA H 1859 4.790 5.280 -0.490 1 1 1024 . 5 1 1 A 91 91 TYR CA C 1859 58.205 56.220 1.985 1 1 1025 . 5 1 1 A 91 91 TYR CB C 1859 40.867 42.013 -1.146 1 1 1028 . 5 1 1 A 91 91 TYR N N 1859 127.393 121.285 6.108 1 1 1029 . 5 1 1 A 92 92 VAL H H 1860 8.072 8.512 -0.440 1 1 1030 . 5 1 1 A 92 92 VAL HA H 1860 4.377 4.539 -0.162 1 1 1038 . 5 1 1 A 92 92 VAL CA C 1860 62.583 61.121 1.462 1 1 1039 . 5 1 1 A 92 92 VAL CB C 1860 33.609 32.491 1.118 1 1 1042 . 5 1 1 A 92 92 VAL N N 1860 132.007 126.752 5.255 1 1 1043 . 5 1 1 A 93 93 ASP H H 1861 8.438 8.511 -0.073 1 1 1044 . 5 1 1 A 93 93 ASP HA H 1861 5.024 4.918 0.106 1 1 1047 . 5 1 1 A 93 93 ASP CA C 1861 50.678 53.181 -2.503 1 1 1048 . 5 1 1 A 93 93 ASP CB C 1861 46.086 44.958 1.128 1 1 1049 . 5 1 1 A 93 93 ASP N N 1861 130.459 125.306 5.153 1 1 1050 . 5 1 1 A 94 94 TYR H H 1862 9.674 8.829 0.845 1 1 1051 . 5 1 1 A 94 94 TYR HA H 1862 4.606 4.706 -0.100 1 1 1058 . 5 1 1 A 94 94 TYR CA C 1862 58.983 58.383 0.600 1 1 1059 . 5 1 1 A 94 94 TYR CB C 1862 39.727 39.183 0.544 1 1 1062 . 5 1 1 A 94 94 TYR N N 1862 120.069 120.312 -0.243 1 1 1063 . 5 1 1 A 95 95 VAL H H 1863 8.371 8.773 -0.402 1 1 1064 . 5 1 1 A 95 95 VAL HA H 1863 3.654 3.947 -0.293 1 1 1072 . 5 1 1 A 95 95 VAL CA C 1863 64.922 64.343 0.579 1 1 1073 . 5 1 1 A 95 95 VAL CB C 1863 32.270 31.948 0.322 1 1 1076 . 5 1 1 A 95 95 VAL N N 1863 121.770 125.230 -3.460 1 1 1077 . 5 1 1 A 96 96 ASN H H 1864 8.729 7.806 0.923 1 1 1078 . 5 1 1 A 96 96 ASN HA H 1864 4.901 4.803 0.098 1 1 1083 . 5 1 1 A 96 96 ASN CA C 1864 52.652 52.029 0.623 1 1 1084 . 5 1 1 A 96 96 ASN CB C 1864 38.160 38.740 -0.580 1 1 1085 . 5 1 1 A 96 96 ASN N N 1864 120.006 118.033 1.973 1 1 1087 . 5 1 1 A 97 97 CYS H H 1865 7.875 7.437 0.438 1 1 1088 . 5 1 1 A 97 97 CYS HA H 1865 4.575 4.345 0.230 1 1 1091 . 5 1 1 A 97 97 CYS CA C 1865 57.009 59.385 -2.376 1 1 1092 . 5 1 1 A 97 97 CYS CB C 1865 29.845 27.619 2.226 1 1 1093 . 5 1 1 A 97 97 CYS N N 1865 117.023 118.112 -1.089 1 1 1094 . 5 1 1 A 98 98 GLY HA2 H 1866 4.045 3.974 0.071 1 1 1095 . 5 1 1 A 98 98 GLY HA3 H 1866 3.866 4.040 -0.174 1 1 1096 . 5 1 1 A 98 98 GLY CA C 1866 46.078 45.656 0.422 1 1 1097 . 5 1 1 A 99 99 HIS H H 1867 7.144 7.191 -0.047 1 1 1098 . 5 1 1 A 99 99 HIS HA H 1867 4.940 4.990 -0.050 1 1 1103 . 5 1 1 A 99 99 HIS CA C 1867 53.843 54.795 -0.952 1 1 1104 . 5 1 1 A 99 99 HIS CB C 1867 31.584 31.444 0.140 1 1 1107 . 5 1 1 A 99 99 HIS N N 1867 115.591 115.934 -0.343 1 1 1108 . 5 1 1 A 100 100 VAL H H 1868 8.434 8.645 -0.211 1 1 1109 . 5 1 1 A 100 100 VAL HA H 1868 4.143 4.286 -0.143 1 1 1117 . 5 1 1 A 100 100 VAL CA C 1868 63.974 63.546 0.428 1 1 1118 . 5 1 1 A 100 100 VAL CB C 1868 31.525 32.093 -0.568 1 1 1121 . 5 1 1 A 100 100 VAL N N 1868 122.851 120.802 2.049 1 1 1122 . 5 1 1 A 101 101 THR H H 1869 7.869 8.222 -0.353 1 1 1123 . 5 1 1 A 101 101 THR HA H 1869 5.217 5.074 0.143 1 1 1128 . 5 1 1 A 101 101 THR CA C 1869 59.495 60.667 -1.172 1 1 1129 . 5 1 1 A 101 101 THR CB C 1869 72.402 71.412 0.990 1 1 1131 . 5 1 1 A 101 101 THR N N 1869 118.578 119.800 -1.222 1 1 1132 . 5 1 1 A 102 102 ALA H H 1870 8.512 8.927 -0.415 1 1 1133 . 5 1 1 A 102 102 ALA HA H 1870 5.687 5.454 0.233 1 1 1137 . 5 1 1 A 102 102 ALA CA C 1870 50.497 50.773 -0.276 1 1 1138 . 5 1 1 A 102 102 ALA CB C 1870 23.128 23.655 -0.527 1 1 1139 . 5 1 1 A 102 102 ALA N N 1870 125.193 126.489 -1.296 1 1 1140 . 5 1 1 A 103 103 TYR H H 1871 8.753 8.842 -0.089 1 1 1141 . 5 1 1 A 103 103 TYR HA H 1871 5.019 5.165 -0.146 1 1 1148 . 5 1 1 A 103 103 TYR CA C 1871 56.303 56.235 0.068 1 1 1149 . 5 1 1 A 103 103 TYR CB C 1871 39.347 41.218 -1.871 1 1 1152 . 5 1 1 A 103 103 TYR N N 1871 119.968 116.665 3.303 1 1 1153 . 5 1 1 A 104 104 GLY H H 1872 9.006 8.658 0.348 1 1 1154 . 5 1 1 A 104 104 GLY HA2 H 1872 5.326 4.307 1.019 1 1 1155 . 5 1 1 A 104 104 GLY HA3 H 1872 4.226 4.330 -0.104 1 1 1156 . 5 1 1 A 104 104 GLY CA C 1872 44.624 44.426 0.198 1 1 1157 . 5 1 1 A 104 104 GLY N N 1872 109.622 107.028 2.594 1 1 1158 . 5 1 1 A 105 105 PRO HA H 1873 4.450 4.454 -0.004 1 1 1165 . 5 1 1 A 105 105 PRO CA C 1873 66.676 65.025 1.651 1 1 1166 . 5 1 1 A 105 105 PRO CB C 1873 32.425 32.108 0.317 1 1 1169 . 5 1 1 A 106 106 GLY H H 1874 9.251 8.616 0.635 1 1 1170 . 5 1 1 A 106 106 GLY HA2 H 1874 4.600 3.914 0.686 1 1 1171 . 5 1 1 A 106 106 GLY HA3 H 1874 3.521 4.134 -0.613 1 1 1172 . 5 1 1 A 106 106 GLY CA C 1874 46.454 46.964 -0.510 1 1 1173 . 5 1 1 A 106 106 GLY N N 1874 105.282 105.541 -0.259 1 1 1174 . 5 1 1 A 107 107 LEU H H 1875 7.161 7.868 -0.707 1 1 1175 . 5 1 1 A 107 107 LEU HA H 1875 4.062 4.007 0.055 1 1 1185 . 5 1 1 A 107 107 LEU CA C 1875 55.592 55.775 -0.183 1 1 1186 . 5 1 1 A 107 107 LEU CB C 1875 41.516 40.281 1.235 1 1 1190 . 5 1 1 A 107 107 LEU N N 1875 117.141 119.016 -1.875 1 1 1191 . 5 1 1 A 108 108 THR H H 1876 8.298 7.901 0.397 1 1 1192 . 5 1 1 A 108 108 THR HA H 1876 5.038 4.524 0.514 1 1 1197 . 5 1 1 A 108 108 THR CA C 1876 64.551 63.687 0.864 1 1 1198 . 5 1 1 A 108 108 THR CB C 1876 72.706 71.015 1.691 1 1 1200 . 5 1 1 A 108 108 THR N N 1876 114.411 112.502 1.909 1 1 1201 . 5 1 1 A 109 109 HIS H H 1877 9.030 8.027 1.003 1 1 1202 . 5 1 1 A 109 109 HIS HA H 1877 5.854 5.123 0.731 1 1 1207 . 5 1 1 A 109 109 HIS CA C 1877 56.127 54.235 1.892 1 1 1208 . 5 1 1 A 109 109 HIS CB C 1877 36.258 33.587 2.671 1 1 1211 . 5 1 1 A 109 109 HIS N N 1877 125.809 117.538 8.271 1 1 1212 . 5 1 1 A 110 110 GLY H H 1878 7.497 7.640 -0.143 1 1 1213 . 5 1 1 A 110 110 GLY HA2 H 1878 4.075 4.050 0.025 1 1 1214 . 5 1 1 A 110 110 GLY HA3 H 1878 3.512 4.065 -0.553 1 1 1215 . 5 1 1 A 110 110 GLY CA C 1878 44.559 44.746 -0.187 1 1 1216 . 5 1 1 A 110 110 GLY N N 1878 111.907 111.174 0.733 1 1 1217 . 5 1 1 A 111 111 VAL H H 1879 8.776 8.242 0.534 1 1 1218 . 5 1 1 A 111 111 VAL HA H 1879 4.741 4.724 0.017 1 1 1226 . 5 1 1 A 111 111 VAL CA C 1879 60.188 60.426 -0.238 1 1 1227 . 5 1 1 A 111 111 VAL CB C 1879 35.130 35.641 -0.511 1 1 1230 . 5 1 1 A 111 111 VAL N N 1879 119.617 119.783 -0.166 1 1 1231 . 5 1 1 A 112 112 VAL H H 1880 7.841 8.640 -0.799 1 1 1232 . 5 1 1 A 112 112 VAL HA H 1880 3.343 3.942 -0.599 1 1 1240 . 5 1 1 A 112 112 VAL CA C 1880 63.553 62.587 0.966 1 1 1241 . 5 1 1 A 112 112 VAL CB C 1880 32.257 31.630 0.627 1 1 1243 . 5 1 1 A 112 112 VAL N N 1880 122.070 126.119 -4.049 1 1 1244 . 5 1 1 A 113 113 ASN H H 1881 8.822 9.103 -0.281 1 1 1245 . 5 1 1 A 113 113 ASN HA H 1881 4.079 4.347 -0.268 1 1 1250 . 5 1 1 A 113 113 ASN CA C 1881 55.459 55.015 0.444 1 1 1251 . 5 1 1 A 113 113 ASN CB C 1881 37.330 37.108 0.222 1 1 1252 . 5 1 1 A 113 113 ASN N N 1881 115.063 117.795 -2.732 1 1 1254 . 5 1 1 A 114 114 LYS H H 1882 8.073 7.467 0.606 1 1 1255 . 5 1 1 A 114 114 LYS HA H 1882 4.818 4.630 0.188 1 1 1260 . 5 1 1 A 114 114 LYS CA C 1882 53.039 53.127 -0.088 1 1 1261 . 5 1 1 A 114 114 LYS CB C 1882 34.020 32.930 1.090 1 1 1263 . 5 1 1 A 114 114 LYS N N 1882 121.439 119.281 2.158 1 1 1264 . 5 1 1 A 115 115 PRO HA H 1883 4.409 4.748 -0.339 1 1 1271 . 5 1 1 A 115 115 PRO CA C 1883 63.121 62.445 0.676 1 1 1272 . 5 1 1 A 115 115 PRO CB C 1883 31.515 31.631 -0.116 1 1 1275 . 5 1 1 A 116 116 ALA H H 1884 8.868 8.015 0.853 1 1 1276 . 5 1 1 A 116 116 ALA HA H 1884 4.804 4.692 0.112 1 1 1280 . 5 1 1 A 116 116 ALA CA C 1884 50.620 51.462 -0.842 1 1 1281 . 5 1 1 A 116 116 ALA CB C 1884 19.426 20.329 -0.903 1 1 1282 . 5 1 1 A 116 116 ALA N N 1884 132.329 125.870 6.459 1 1 1283 . 5 1 1 A 117 117 THR H H 1885 8.433 8.898 -0.465 1 1 1284 . 5 1 1 A 117 117 THR HA H 1885 5.747 5.531 0.216 1 1 1289 . 5 1 1 A 117 117 THR CA C 1885 60.364 59.556 0.808 1 1 1290 . 5 1 1 A 117 117 THR CB C 1885 72.204 72.042 0.162 1 1 1292 . 5 1 1 A 117 117 THR N N 1885 113.428 111.297 2.131 1 1 1293 . 5 1 1 A 118 118 PHE H H 1886 9.069 8.491 0.578 1 1 1294 . 5 1 1 A 118 118 PHE HA H 1886 5.123 5.164 -0.041 1 1 1301 . 5 1 1 A 118 118 PHE CA C 1886 57.059 56.055 1.004 1 1 1302 . 5 1 1 A 118 118 PHE CB C 1886 39.994 41.110 -1.116 1 1 1305 . 5 1 1 A 118 118 PHE N N 1886 119.166 117.513 1.653 1 1 1306 . 5 1 1 A 119 119 THR H H 1887 9.451 9.020 0.431 1 1 1307 . 5 1 1 A 119 119 THR HA H 1887 5.097 5.322 -0.225 1 1 1312 . 5 1 1 A 119 119 THR CA C 1887 62.050 61.157 0.893 1 1 1313 . 5 1 1 A 119 119 THR CB C 1887 71.696 72.374 -0.678 1 1 1315 . 5 1 1 A 119 119 THR N N 1887 119.436 114.401 5.035 1 1 1316 . 5 1 1 A 120 120 VAL H H 1888 8.812 9.326 -0.514 1 1 1317 . 5 1 1 A 120 120 VAL HA H 1888 4.807 4.683 0.124 1 1 1325 . 5 1 1 A 120 120 VAL CA C 1888 61.140 60.907 0.233 1 1 1326 . 5 1 1 A 120 120 VAL CB C 1888 34.059 34.048 0.011 1 1 1329 . 5 1 1 A 120 120 VAL N N 1888 124.304 125.672 -1.368 1 1 1330 . 5 1 1 A 121 121 ASN H H 1889 9.291 9.316 -0.025 1 1 1331 . 5 1 1 A 121 121 ASN HA H 1889 5.177 5.227 -0.050 1 1 1336 . 5 1 1 A 121 121 ASN CA C 1889 52.470 52.635 -0.165 1 1 1337 . 5 1 1 A 121 121 ASN CB C 1889 39.766 39.850 -0.084 1 1 1338 . 5 1 1 A 121 121 ASN N N 1889 128.674 125.480 3.194 1 1 1340 . 5 1 1 A 122 122 THR H H 1890 8.553 8.201 0.352 1 1 1341 . 5 1 1 A 122 122 THR HA H 1890 4.236 4.567 -0.331 1 1 1346 . 5 1 1 A 122 122 THR CA C 1890 61.062 61.066 -0.004 1 1 1347 . 5 1 1 A 122 122 THR CB C 1890 68.437 69.166 -0.729 1 1 1349 . 5 1 1 A 122 122 THR N N 1890 116.203 113.659 2.544 1 1 1350 . 5 1 1 A 123 123 LYS H H 1891 8.210 7.825 0.385 1 1 1351 . 5 1 1 A 123 123 LYS HA H 1891 4.019 4.043 -0.024 1 1 1360 . 5 1 1 A 123 123 LYS CA C 1891 58.646 58.934 -0.288 1 1 1361 . 5 1 1 A 123 123 LYS CB C 1891 31.868 32.276 -0.408 1 1 1365 . 5 1 1 A 123 123 LYS N N 1891 124.070 122.376 1.694 1 1 1366 . 5 1 1 A 124 124 ASP H H 1892 8.596 7.845 0.751 1 1 1367 . 5 1 1 A 124 124 ASP HA H 1892 4.638 4.827 -0.189 1 1 1370 . 5 1 1 A 124 124 ASP CA C 1892 54.928 52.927 2.001 1 1 1371 . 5 1 1 A 124 124 ASP CB C 1892 40.725 41.024 -0.299 1 1 1372 . 5 1 1 A 124 124 ASP N N 1892 119.838 117.576 2.262 1 1 1373 . 5 1 1 A 125 125 ALA H H 1893 7.792 7.636 0.156 1 1 1374 . 5 1 1 A 125 125 ALA HA H 1893 4.248 4.143 0.105 1 1 1378 . 5 1 1 A 125 125 ALA CA C 1893 52.852 52.010 0.842 1 1 1379 . 5 1 1 A 125 125 ALA CB C 1893 20.199 18.999 1.200 1 1 1380 . 5 1 1 A 125 125 ALA N N 1893 122.999 121.713 1.286 1 1 1381 . 5 1 1 A 126 126 GLY H H 1894 8.214 8.415 -0.201 1 1 1382 . 5 1 1 A 126 126 GLY HA2 H 1894 4.183 3.981 0.202 1 1 1383 . 5 1 1 A 126 126 GLY HA3 H 1894 3.993 4.002 -0.009 1 1 1384 . 5 1 1 A 126 126 GLY CA C 1894 44.725 47.237 -2.512 1 1 1385 . 5 1 1 A 126 126 GLY N N 1894 108.359 106.828 1.531 1 1 1386 . 5 1 1 A 127 127 GLU H H 1895 8.633 8.503 0.130 1 1 1387 . 5 1 1 A 127 127 GLU HA H 1895 4.318 5.201 -0.883 1 1 1392 . 5 1 1 A 127 127 GLU CA C 1895 57.280 55.946 1.334 1 1 1393 . 5 1 1 A 127 127 GLU CB C 1895 30.434 33.035 -2.601 1 1 1395 . 5 1 1 A 127 127 GLU N N 1895 122.934 124.307 -1.373 1 1 1396 . 5 1 1 A 128 128 GLY H H 1896 8.351 8.328 0.023 1 1 1397 . 5 1 1 A 128 128 GLY HA2 H 1896 3.853 4.037 -0.184 1 1 1398 . 5 1 1 A 128 128 GLY HA3 H 1896 3.853 4.174 -0.321 1 1 1399 . 5 1 1 A 128 128 GLY CA C 1896 45.766 45.951 -0.185 1 1 1400 . 5 1 1 A 128 128 GLY N N 1896 111.048 111.473 -0.425 1 1 1401 . 5 1 1 A 129 129 GLY H H 1897 7.580 6.841 0.739 1 1 1402 . 5 1 1 A 129 129 GLY HA2 H 1897 4.170 3.895 0.275 1 1 1403 . 5 1 1 A 129 129 GLY HA3 H 1897 3.463 3.916 -0.453 1 1 1404 . 5 1 1 A 129 129 GLY CA C 1897 44.670 45.320 -0.650 1 1 1405 . 5 1 1 A 129 129 GLY N N 1897 106.306 108.570 -2.264 1 1 1406 . 5 1 1 A 130 130 LEU H H 1898 8.416 8.608 -0.192 1 1 1407 . 5 1 1 A 130 130 LEU HA H 1898 5.077 4.920 0.157 1 1 1417 . 5 1 1 A 130 130 LEU CA C 1898 54.526 54.111 0.415 1 1 1418 . 5 1 1 A 130 130 LEU CB C 1898 44.499 44.028 0.471 1 1 1422 . 5 1 1 A 130 130 LEU N N 1898 126.737 124.255 2.482 1 1 1423 . 5 1 1 A 131 131 SER H H 1899 9.254 9.363 -0.109 1 1 1424 . 5 1 1 A 131 131 SER HA H 1899 4.803 5.495 -0.692 1 1 1427 . 5 1 1 A 131 131 SER CA C 1899 57.293 57.244 0.049 1 1 1428 . 5 1 1 A 131 131 SER CB C 1899 65.376 66.855 -1.479 1 1 1429 . 5 1 1 A 131 131 SER N N 1899 123.028 124.263 -1.235 1 1 1430 . 5 1 1 A 132 132 LEU H H 1900 8.410 8.555 -0.145 1 1 1431 . 5 1 1 A 132 132 LEU HA H 1900 5.452 4.987 0.465 1 1 1441 . 5 1 1 A 132 132 LEU CA C 1900 53.045 54.308 -1.263 1 1 1442 . 5 1 1 A 132 132 LEU CB C 1900 46.982 46.144 0.838 1 1 1446 . 5 1 1 A 132 132 LEU N N 1900 126.218 122.953 3.265 1 1 1447 . 5 1 1 A 133 133 ALA H H 1901 8.708 8.552 0.156 1 1 1448 . 5 1 1 A 133 133 ALA HA H 1901 4.591 4.949 -0.358 1 1 1452 . 5 1 1 A 133 133 ALA CA C 1901 52.140 51.409 0.731 1 1 1453 . 5 1 1 A 133 133 ALA CB C 1901 22.653 23.678 -1.025 1 1 1454 . 5 1 1 A 133 133 ALA N N 1901 124.744 126.119 -1.375 1 1 1455 . 5 1 1 A 134 134 ILE H H 1902 8.641 8.555 0.086 1 1 1456 . 5 1 1 A 134 134 ILE HA H 1902 5.256 5.218 0.038 1 1 1466 . 5 1 1 A 134 134 ILE CA C 1902 59.873 60.041 -0.168 1 1 1467 . 5 1 1 A 134 134 ILE CB C 1902 41.214 41.992 -0.778 1 1 1471 . 5 1 1 A 134 134 ILE N N 1902 121.132 120.078 1.054 1 1 1472 . 5 1 1 A 135 135 GLU H H 1903 9.294 8.880 0.414 1 1 1473 . 5 1 1 A 135 135 GLU HA H 1903 4.869 5.241 -0.372 1 1 1478 . 5 1 1 A 135 135 GLU CA C 1903 54.307 54.679 -0.372 1 1 1479 . 5 1 1 A 135 135 GLU CB C 1903 32.474 33.101 -0.627 1 1 1481 . 5 1 1 A 135 135 GLU N N 1903 129.644 124.156 5.488 1 1 1482 . 5 1 1 A 136 136 GLY H H 1904 8.347 8.234 0.113 1 1 1483 . 5 1 1 A 136 136 GLY HA2 H 1904 4.005 3.405 0.600 1 1 1484 . 5 1 1 A 136 136 GLY HA3 H 1904 3.629 3.877 -0.248 1 1 1485 . 5 1 1 A 136 136 GLY CA C 1904 45.530 44.847 0.683 1 1 1486 . 5 1 1 A 136 136 GLY N N 1904 112.326 110.076 2.250 1 1 1487 . 5 1 1 A 137 137 PRO HA H 1905 4.268 4.316 -0.048 1 1 1494 . 5 1 1 A 137 137 PRO CA C 1905 64.189 64.189 0.000 1 1 1495 . 5 1 1 A 137 137 PRO CB C 1905 32.482 31.964 0.518 1 1 1498 . 5 1 1 A 138 138 SER H H 1906 7.060 7.350 -0.290 1 1 1499 . 5 1 1 A 138 138 SER HA H 1906 4.603 4.740 -0.137 1 1 1502 . 5 1 1 A 138 138 SER CA C 1906 56.433 56.738 -0.305 1 1 1503 . 5 1 1 A 138 138 SER CB C 1906 66.672 65.626 1.046 1 1 1504 . 5 1 1 A 138 138 SER N N 1906 109.100 111.753 -2.653 1 1 1505 . 5 1 1 A 139 139 LYS H H 1907 8.479 8.322 0.157 1 1 1506 . 5 1 1 A 139 139 LYS HA H 1907 4.413 4.397 0.016 1 1 1515 . 5 1 1 A 139 139 LYS CA C 1907 56.638 56.718 -0.080 1 1 1516 . 5 1 1 A 139 139 LYS CB C 1907 31.873 32.995 -1.122 1 1 1520 . 5 1 1 A 139 139 LYS N N 1907 124.545 125.514 -0.969 1 1 1521 . 5 1 1 A 140 140 ALA H H 1908 8.358 8.486 -0.128 1 1 1522 . 5 1 1 A 140 140 ALA HA H 1908 4.706 4.532 0.174 1 1 1526 . 5 1 1 A 140 140 ALA CA C 1908 51.081 52.558 -1.477 1 1 1527 . 5 1 1 A 140 140 ALA CB C 1908 20.724 19.445 1.279 1 1 1528 . 5 1 1 A 140 140 ALA N N 1908 131.020 129.601 1.419 1 1 1529 . 5 1 1 A 141 141 GLU H H 1909 8.625 8.286 0.339 1 1 1530 . 5 1 1 A 141 141 GLU HA H 1909 4.248 4.764 -0.516 1 1 1535 . 5 1 1 A 141 141 GLU CA C 1909 56.991 56.275 0.716 1 1 1536 . 5 1 1 A 141 141 GLU CB C 1909 30.453 31.074 -0.621 1 1 1538 . 5 1 1 A 141 141 GLU N N 1909 124.862 121.129 3.733 1 1 1539 . 5 1 1 A 142 142 ILE H H 1910 8.588 8.761 -0.173 1 1 1540 . 5 1 1 A 142 142 ILE HA H 1910 4.871 5.168 -0.297 1 1 1550 . 5 1 1 A 142 142 ILE CA C 1910 60.733 59.886 0.847 1 1 1551 . 5 1 1 A 142 142 ILE CB C 1910 41.494 41.440 0.054 1 1 1555 . 5 1 1 A 142 142 ILE N N 1910 126.220 124.966 1.254 1 1 1556 . 5 1 1 A 143 143 SER H H 1911 9.269 9.138 0.131 1 1 1557 . 5 1 1 A 143 143 SER HA H 1911 4.804 5.156 -0.352 1 1 1560 . 5 1 1 A 143 143 SER CA C 1911 56.988 57.050 -0.062 1 1 1561 . 5 1 1 A 143 143 SER CB C 1911 65.172 65.713 -0.541 1 1 1562 . 5 1 1 A 143 143 SER N N 1911 124.083 120.653 3.430 1 1 1563 . 5 1 1 A 144 144 CYS H H 1912 8.773 8.777 -0.004 1 1 1564 . 5 1 1 A 144 144 CYS HA H 1912 5.200 5.203 -0.003 1 1 1567 . 5 1 1 A 144 144 CYS CA C 1912 57.256 56.356 0.900 1 1 1568 . 5 1 1 A 144 144 CYS CB C 1912 29.137 31.427 -2.290 1 1 1569 . 5 1 1 A 144 144 CYS N N 1912 125.729 120.490 5.239 1 1 1570 . 5 1 1 A 145 145 THR H H 1913 8.976 8.828 0.148 1 1 1571 . 5 1 1 A 145 145 THR HA H 1913 4.510 4.973 -0.463 1 1 1576 . 5 1 1 A 145 145 THR CA C 1913 61.388 61.352 0.036 1 1 1577 . 5 1 1 A 145 145 THR CB C 1913 71.558 71.919 -0.361 1 1 1579 . 5 1 1 A 145 145 THR N N 1913 124.914 117.339 7.575 1 1 1580 . 5 1 1 A 146 146 ASP H H 1914 8.843 9.060 -0.217 1 1 1581 . 5 1 1 A 146 146 ASP HA H 1914 4.842 4.867 -0.025 1 1 1584 . 5 1 1 A 146 146 ASP CA C 1914 54.307 54.260 0.047 1 1 1585 . 5 1 1 A 146 146 ASP CB C 1914 41.262 42.148 -0.886 1 1 1586 . 5 1 1 A 146 146 ASP N N 1914 128.084 128.800 -0.716 1 1 1587 . 5 1 1 A 147 147 ASN H H 1915 8.700 9.060 -0.360 1 1 1588 . 5 1 1 A 147 147 ASN HA H 1915 4.798 5.055 -0.257 1 1 1593 . 5 1 1 A 147 147 ASN CA C 1915 54.283 51.906 2.377 1 1 1594 . 5 1 1 A 147 147 ASN CB C 1915 38.986 40.796 -1.810 1 1 1595 . 5 1 1 A 147 147 ASN N N 1915 125.720 122.762 2.958 1 1 1597 . 5 1 1 A 148 148 GLN HA H 1916 4.057 4.039 0.018 1 1 1602 . 5 1 1 A 148 148 GLN CA C 1916 57.839 58.565 -0.726 1 1 1603 . 5 1 1 A 148 148 GLN CB C 1916 26.281 28.289 -2.008 1 1 1605 . 5 1 1 A 149 149 ASP H H 1917 7.892 7.709 0.183 1 1 1606 . 5 1 1 A 149 149 ASP HA H 1917 4.755 4.746 0.009 1 1 1609 . 5 1 1 A 149 149 ASP CA C 1917 52.659 54.056 -1.397 1 1 1610 . 5 1 1 A 149 149 ASP CB C 1917 41.111 41.324 -0.213 1 1 1611 . 5 1 1 A 149 149 ASP N N 1917 118.769 117.449 1.320 1 1 1612 . 5 1 1 A 150 150 GLY H H 1918 8.673 8.060 0.613 1 1 1613 . 5 1 1 A 150 150 GLY HA2 H 1918 4.358 3.928 0.430 1 1 1614 . 5 1 1 A 150 150 GLY HA3 H 1918 3.700 3.931 -0.231 1 1 1615 . 5 1 1 A 150 150 GLY CA C 1918 45.319 45.344 -0.025 1 1 1616 . 5 1 1 A 150 150 GLY N N 1918 110.464 107.953 2.511 1 1 1617 . 5 1 1 A 151 151 THR H H 1919 8.154 7.768 0.386 1 1 1618 . 5 1 1 A 151 151 THR HA H 1919 4.109 4.910 -0.801 1 1 1623 . 5 1 1 A 151 151 THR CA C 1919 60.041 59.956 0.085 1 1 1624 . 5 1 1 A 151 151 THR CB C 1919 73.422 71.773 1.649 1 1 1626 . 5 1 1 A 151 151 THR N N 1919 111.043 111.708 -0.665 1 1 1627 . 5 1 1 A 152 152 CYS H H 1920 9.088 9.213 -0.125 1 1 1628 . 5 1 1 A 152 152 CYS HA H 1920 5.362 5.514 -0.152 1 1 1631 . 5 1 1 A 152 152 CYS CA C 1920 56.990 57.025 -0.035 1 1 1632 . 5 1 1 A 152 152 CYS CB C 1920 30.740 29.064 1.676 1 1 1633 . 5 1 1 A 152 152 CYS N N 1920 118.508 121.567 -3.059 1 1 1634 . 5 1 1 A 153 153 SER H H 1921 9.102 8.955 0.147 1 1 1635 . 5 1 1 A 153 153 SER HA H 1921 4.865 4.824 0.041 1 1 1638 . 5 1 1 A 153 153 SER CA C 1921 58.023 57.950 0.073 1 1 1639 . 5 1 1 A 153 153 SER CB C 1921 64.133 64.048 0.085 1 1 1640 . 5 1 1 A 153 153 SER N N 1921 122.048 120.240 1.808 1 1 1641 . 5 1 1 A 154 154 VAL H H 1922 8.983 8.776 0.207 1 1 1642 . 5 1 1 A 154 154 VAL HA H 1922 4.608 4.778 -0.170 1 1 1650 . 5 1 1 A 154 154 VAL CA C 1922 60.575 59.774 0.801 1 1 1651 . 5 1 1 A 154 154 VAL CB C 1922 32.710 34.742 -2.032 1 1 1654 . 5 1 1 A 154 154 VAL N N 1922 130.262 125.199 5.063 1 1 1655 . 5 1 1 A 155 155 SER H H 1923 8.737 8.978 -0.241 1 1 1656 . 5 1 1 A 155 155 SER HA H 1923 5.680 5.516 0.164 1 1 1659 . 5 1 1 A 155 155 SER CA C 1923 55.991 56.281 -0.290 1 1 1660 . 5 1 1 A 155 155 SER CB C 1923 66.306 66.268 0.038 1 1 1661 . 5 1 1 A 155 155 SER N N 1923 121.504 119.038 2.466 1 1 1662 . 5 1 1 A 156 156 TYR H H 1924 9.061 8.941 0.120 1 1 1663 . 5 1 1 A 156 156 TYR HA H 1924 5.790 5.555 0.235 1 1 1671 . 5 1 1 A 156 156 TYR CA C 1924 55.118 55.873 -0.755 1 1 1672 . 5 1 1 A 156 156 TYR CB C 1924 42.344 41.652 0.692 1 1 1675 . 5 1 1 A 156 156 TYR N N 1924 121.858 118.185 3.673 1 1 1676 . 5 1 1 A 157 157 LEU H H 1925 7.505 9.246 -1.741 1 1 1677 . 5 1 1 A 157 157 LEU HA H 1925 4.996 4.708 0.288 1 1 1687 . 5 1 1 A 157 157 LEU CA C 1925 50.476 51.115 -0.639 1 1 1688 . 5 1 1 A 157 157 LEU CB C 1925 43.334 42.894 0.440 1 1 1692 . 5 1 1 A 157 157 LEU N N 1925 123.272 121.846 1.426 1 1 1693 . 5 1 1 A 158 158 PRO HA H 1926 4.691 4.920 -0.229 1 1 1700 . 5 1 1 A 158 158 PRO CA C 1926 61.808 62.584 -0.776 1 1 1701 . 5 1 1 A 158 158 PRO CB C 1926 32.551 33.111 -0.560 1 1 1704 . 5 1 1 A 159 159 VAL H H 1927 8.388 8.291 0.097 1 1 1705 . 5 1 1 A 159 159 VAL HA H 1927 4.510 4.487 0.023 1 1 1713 . 5 1 1 A 159 159 VAL CA C 1927 61.778 61.571 0.207 1 1 1714 . 5 1 1 A 159 159 VAL CB C 1927 32.432 34.087 -1.655 1 1 1717 . 5 1 1 A 159 159 VAL N N 1927 115.680 117.141 -1.461 1 1 1718 . 5 1 1 A 160 160 LEU H H 1928 6.931 7.745 -0.814 1 1 1719 . 5 1 1 A 160 160 LEU HA H 1928 4.931 4.848 0.083 1 1 1729 . 5 1 1 A 160 160 LEU CA C 1928 51.971 51.352 0.619 1 1 1730 . 5 1 1 A 160 160 LEU CB C 1928 45.905 44.664 1.241 1 1 1734 . 5 1 1 A 160 160 LEU N N 1928 120.258 123.389 -3.131 1 1 1735 . 5 1 1 A 161 161 PRO HA H 1929 4.317 4.816 -0.499 1 1 1742 . 5 1 1 A 161 161 PRO CA C 1929 62.809 62.899 -0.090 1 1 1743 . 5 1 1 A 161 161 PRO CB C 1929 32.662 33.034 -0.372 1 1 1746 . 5 1 1 A 162 162 GLY H H 1930 8.916 8.272 0.644 1 1 1747 . 5 1 1 A 162 162 GLY HA2 H 1930 4.461 4.147 0.314 1 1 1748 . 5 1 1 A 162 162 GLY HA3 H 1930 3.852 4.175 -0.323 1 1 1749 . 5 1 1 A 162 162 GLY CA C 1930 44.496 44.410 0.086 1 1 1750 . 5 1 1 A 162 162 GLY N N 1930 107.609 107.210 0.399 1 1 1751 . 5 1 1 A 163 163 ASP H H 1931 8.245 8.384 -0.139 1 1 1752 . 5 1 1 A 163 163 ASP HA H 1931 5.565 5.430 0.135 1 1 1755 . 5 1 1 A 163 163 ASP CA C 1931 53.628 53.545 0.083 1 1 1756 . 5 1 1 A 163 163 ASP CB C 1931 41.058 42.682 -1.624 1 1 1757 . 5 1 1 A 163 163 ASP N N 1931 121.979 121.242 0.737 1 1 1758 . 5 1 1 A 164 164 TYR H H 1932 9.606 9.579 0.027 1 1 1759 . 5 1 1 A 164 164 TYR HA H 1932 4.896 5.333 -0.437 1 1 1767 . 5 1 1 A 164 164 TYR CA C 1932 56.955 56.359 0.596 1 1 1768 . 5 1 1 A 164 164 TYR CB C 1932 40.339 41.327 -0.988 1 1 1771 . 5 1 1 A 164 164 TYR N N 1932 125.257 122.089 3.168 1 1 1772 . 5 1 1 A 165 165 SER H H 1933 9.095 9.289 -0.194 1 1 1773 . 5 1 1 A 165 165 SER HA H 1933 5.500 5.172 0.328 1 1 1776 . 5 1 1 A 165 165 SER CA C 1933 56.509 58.429 -1.920 1 1 1777 . 5 1 1 A 165 165 SER CB C 1933 64.486 64.137 0.349 1 1 1778 . 5 1 1 A 165 165 SER N N 1933 119.162 120.350 -1.188 1 1 1779 . 5 1 1 A 166 166 ILE H H 1934 9.598 9.474 0.124 1 1 1780 . 5 1 1 A 166 166 ILE HA H 1934 4.541 4.761 -0.220 1 1 1790 . 5 1 1 A 166 166 ILE CA C 1934 61.080 60.268 0.812 1 1 1791 . 5 1 1 A 166 166 ILE CB C 1934 39.282 38.881 0.401 1 1 1795 . 5 1 1 A 166 166 ILE N N 1934 128.701 128.173 0.528 1 1 1796 . 5 1 1 A 167 167 LEU H H 1935 9.359 9.223 0.136 1 1 1797 . 5 1 1 A 167 167 LEU HA H 1935 4.779 5.013 -0.234 1 1 1807 . 5 1 1 A 167 167 LEU CA C 1935 55.921 53.483 2.438 1 1 1808 . 5 1 1 A 167 167 LEU CB C 1935 42.473 44.406 -1.933 1 1 1811 . 5 1 1 A 167 167 LEU N N 1935 131.315 130.039 1.276 1 1 1812 . 5 1 1 A 168 168 VAL H H 1936 9.425 8.975 0.450 1 1 1813 . 5 1 1 A 168 168 VAL HA H 1936 4.617 4.906 -0.289 1 1 1821 . 5 1 1 A 168 168 VAL CA C 1936 61.418 60.862 0.556 1 1 1822 . 5 1 1 A 168 168 VAL CB C 1936 33.616 34.823 -1.207 1 1 1824 . 5 1 1 A 168 168 VAL N N 1936 126.961 126.840 0.121 1 1 1825 . 5 1 1 A 169 169 LYS H H 1937 8.643 8.441 0.202 1 1 1826 . 5 1 1 A 169 169 LYS HA H 1937 5.067 4.999 0.068 1 1 1835 . 5 1 1 A 169 169 LYS CA C 1937 53.949 55.303 -1.354 1 1 1836 . 5 1 1 A 169 169 LYS CB C 1937 36.691 35.663 1.028 1 1 1840 . 5 1 1 A 169 169 LYS N N 1937 124.773 127.577 -2.804 1 1 1841 . 5 1 1 A 170 170 TYR H H 1938 8.877 9.252 -0.375 1 1 1842 . 5 1 1 A 170 170 TYR HA H 1938 5.137 5.176 -0.039 1 1 1849 . 5 1 1 A 170 170 TYR CA C 1938 57.034 57.542 -0.508 1 1 1850 . 5 1 1 A 170 170 TYR CB C 1938 42.105 41.830 0.275 1 1 1853 . 5 1 1 A 170 170 TYR N N 1938 122.371 126.928 -4.557 1 1 1854 . 5 1 1 A 171 171 ASN H H 1939 8.933 9.000 -0.067 1 1 1855 . 5 1 1 A 171 171 ASN HA H 1939 4.405 4.215 0.190 1 1 1860 . 5 1 1 A 171 171 ASN CA C 1939 54.512 54.112 0.400 1 1 1861 . 5 1 1 A 171 171 ASN CB C 1939 37.025 37.231 -0.206 1 1 1862 . 5 1 1 A 171 171 ASN N N 1939 129.922 125.900 4.022 1 1 1864 . 5 1 1 A 172 172 GLU H H 1940 8.857 8.695 0.162 1 1 1865 . 5 1 1 A 172 172 GLU HA H 1940 3.511 4.018 -0.507 1 1 1870 . 5 1 1 A 172 172 GLU CA C 1940 57.910 57.580 0.330 1 1 1871 . 5 1 1 A 172 172 GLU CB C 1940 27.139 27.422 -0.283 1 1 1873 . 5 1 1 A 172 172 GLU N N 1940 107.943 116.153 -8.210 1 1 1874 . 5 1 1 A 173 173 GLN H H 1941 7.544 7.667 -0.123 1 1 1875 . 5 1 1 A 173 173 GLN HA H 1941 4.749 4.831 -0.082 1 1 1882 . 5 1 1 A 173 173 GLN CA C 1941 53.770 54.242 -0.472 1 1 1883 . 5 1 1 A 173 173 GLN CB C 1941 31.078 31.125 -0.047 1 1 1885 . 5 1 1 A 173 173 GLN N N 1941 119.865 120.072 -0.207 1 1 1887 . 5 1 1 A 174 174 HIS H H 1942 8.848 9.022 -0.174 1 1 1888 . 5 1 1 A 174 174 HIS HA H 1942 4.513 4.644 -0.131 1 1 1893 . 5 1 1 A 174 174 HIS CA C 1942 58.893 57.255 1.638 1 1 1894 . 5 1 1 A 174 174 HIS CB C 1942 32.196 30.562 1.634 1 1 1897 . 5 1 1 A 174 174 HIS N N 1942 126.437 121.534 4.903 1 1 1898 . 5 1 1 A 175 175 VAL H H 1943 8.483 8.402 0.081 1 1 1899 . 5 1 1 A 175 175 VAL HA H 1943 4.643 4.355 0.288 1 1 1907 . 5 1 1 A 175 175 VAL CA C 1943 60.025 60.968 -0.943 1 1 1908 . 5 1 1 A 175 175 VAL CB C 1943 29.439 31.944 -2.505 1 1 1911 . 5 1 1 A 175 175 VAL N N 1943 121.671 121.257 0.414 1 1 1912 . 5 1 1 A 176 176 PRO HA H 1944 4.045 4.126 -0.081 1 1 1919 . 5 1 1 A 176 176 PRO CA C 1944 64.943 63.760 1.183 1 1 1920 . 5 1 1 A 176 176 PRO CB C 1944 31.120 31.251 -0.131 1 1 1923 . 5 1 1 A 177 177 GLY H H 1945 7.579 8.511 -0.932 1 1 1924 . 5 1 1 A 177 177 GLY HA2 H 1945 3.210 3.462 -0.252 1 1 1925 . 5 1 1 A 177 177 GLY HA3 H 1945 2.311 3.770 -1.459 1 1 1926 . 5 1 1 A 177 177 GLY CA C 1945 44.184 44.808 -0.624 1 1 1927 . 5 1 1 A 177 177 GLY N N 1945 113.696 112.814 0.882 1 1 1928 . 5 1 1 A 178 178 SER H H 1946 7.469 7.521 -0.052 1 1 1929 . 5 1 1 A 178 178 SER HA H 1946 4.023 3.492 0.531 1 1 1932 . 5 1 1 A 178 178 SER CA C 1946 54.593 54.892 -0.299 1 1 1933 . 5 1 1 A 178 178 SER CB C 1946 62.282 63.425 -1.143 1 1 1934 . 5 1 1 A 178 178 SER N N 1946 113.219 116.850 -3.631 1 1 1935 . 5 1 1 A 179 179 PRO HA H 1947 5.314 4.632 0.682 1 1 1942 . 5 1 1 A 179 179 PRO CA C 1947 62.198 62.431 -0.233 1 1 1943 . 5 1 1 A 179 179 PRO CB C 1947 33.923 32.801 1.122 1 1 1946 . 5 1 1 A 180 180 PHE H H 1948 9.395 8.447 0.948 1 1 1947 . 5 1 1 A 180 180 PHE HA H 1948 4.706 4.916 -0.210 1 1 1955 . 5 1 1 A 180 180 PHE CA C 1948 57.298 57.619 -0.321 1 1 1956 . 5 1 1 A 180 180 PHE CB C 1948 41.116 40.157 0.959 1 1 1960 . 5 1 1 A 180 180 PHE N N 1948 127.510 120.619 6.891 1 1 1961 . 5 1 1 A 181 181 THR H H 1949 9.111 8.904 0.207 1 1 1962 . 5 1 1 A 181 181 THR HA H 1949 5.091 5.254 -0.163 1 1 1967 . 5 1 1 A 181 181 THR CA C 1949 62.668 61.196 1.472 1 1 1968 . 5 1 1 A 181 181 THR CB C 1949 70.354 71.532 -1.178 1 1 1970 . 5 1 1 A 181 181 THR N N 1949 120.325 115.495 4.830 1 1 1971 . 5 1 1 A 182 182 ALA H H 1950 8.992 9.473 -0.481 1 1 1972 . 5 1 1 A 182 182 ALA HA H 1950 4.521 5.171 -0.650 1 1 1976 . 5 1 1 A 182 182 ALA CA C 1950 50.080 50.824 -0.744 1 1 1977 . 5 1 1 A 182 182 ALA CB C 1950 21.717 20.992 0.725 1 1 1978 . 5 1 1 A 182 182 ALA N N 1950 130.794 130.418 0.376 1 1 1979 . 5 1 1 A 183 183 ARG H H 1951 7.764 8.706 -0.942 1 1 1980 . 5 1 1 A 183 183 ARG HA H 1951 5.001 5.068 -0.067 1 1 1988 . 5 1 1 A 183 183 ARG CA C 1951 55.116 54.897 0.219 1 1 1989 . 5 1 1 A 183 183 ARG CB C 1951 30.631 33.375 -2.744 1 1 1992 . 5 1 1 A 183 183 ARG N N 1951 121.920 122.299 -0.379 1 1 1994 . 5 1 1 A 184 184 VAL H H 1952 9.121 9.570 -0.449 1 1 1995 . 5 1 1 A 184 184 VAL HA H 1952 4.865 4.853 0.012 1 1 2003 . 5 1 1 A 184 184 VAL CA C 1952 60.375 61.196 -0.821 1 1 2004 . 5 1 1 A 184 184 VAL CB C 1952 32.179 34.078 -1.899 1 1 2007 . 5 1 1 A 184 184 VAL N N 1952 125.421 127.036 -1.615 1 1 2008 . 5 1 1 A 185 185 THR H H 1953 8.799 8.800 -0.001 1 1 2009 . 5 1 1 A 185 185 THR HA H 1953 4.829 5.176 -0.347 1 1 2014 . 5 1 1 A 185 185 THR CA C 1953 60.316 60.063 0.253 1 1 2015 . 5 1 1 A 185 185 THR CB C 1953 70.825 71.457 -0.632 1 1 2017 . 5 1 1 A 185 185 THR N N 1953 121.794 117.573 4.221 1 1 2018 . 5 1 1 A 186 186 GLY H H 1954 8.586 8.540 0.046 1 1 2019 . 5 1 1 A 186 186 GLY HA2 H 1954 4.261 4.097 0.164 1 1 2020 . 5 1 1 A 186 186 GLY HA3 H 1954 4.033 4.101 -0.068 1 1 2021 . 5 1 1 A 186 186 GLY CA C 1954 45.038 45.140 -0.102 1 1 2022 . 5 1 1 A 186 186 GLY N N 1954 107.588 108.375 -0.787 1 1 2023 . 5 1 1 A 187 187 ASP H H 1955 8.386 8.963 -0.577 1 1 2024 . 5 1 1 A 187 187 ASP HA H 1955 4.772 4.542 0.230 1 1 2027 . 5 1 1 A 187 187 ASP CA C 1955 53.909 55.725 -1.816 1 1 2028 . 5 1 1 A 187 187 ASP CB C 1955 41.510 41.605 -0.095 1 1 2029 . 5 1 1 A 187 187 ASP N N 1955 121.829 121.256 0.573 1 1 4 . 6 1 1 A 2 2 ALA HA H -2 4.368 4.083 0.285 1 1 8 . 6 1 1 A 2 2 ALA CA C -2 52.604 54.508 -1.904 1 1 9 . 6 1 1 A 2 2 ALA CB C -2 19.551 18.399 1.152 1 1 32 . 6 1 1 A 5 5 PRO HA H 1773 4.433 4.669 -0.236 1 1 39 . 6 1 1 A 5 5 PRO CA C 1773 63.017 62.715 0.302 1 1 40 . 6 1 1 A 5 5 PRO CB C 1773 32.155 32.755 -0.600 1 1 43 . 6 1 1 A 6 6 GLU H H 1774 8.495 8.835 -0.340 1 1 44 . 6 1 1 A 6 6 GLU HA H 1774 4.242 4.051 0.191 1 1 49 . 6 1 1 A 6 6 GLU CA C 1774 56.735 58.853 -2.118 1 1 50 . 6 1 1 A 6 6 GLU CB C 1774 30.401 29.462 0.939 1 1 52 . 6 1 1 A 6 6 GLU N N 1774 122.494 119.877 2.617 1 1 53 . 6 1 1 A 7 7 ARG H H 1775 8.275 7.646 0.629 1 1 54 . 6 1 1 A 7 7 ARG HA H 1775 4.648 4.343 0.305 1 1 61 . 6 1 1 A 7 7 ARG CA C 1775 53.827 54.198 -0.371 1 1 62 . 6 1 1 A 7 7 ARG CB C 1775 30.417 30.961 -0.544 1 1 65 . 6 1 1 A 7 7 ARG N N 1775 124.017 122.716 1.301 1 1 66 . 6 1 1 A 8 8 PRO HA H 1776 4.433 4.673 -0.240 1 1 73 . 6 1 1 A 8 8 PRO CA C 1776 63.036 62.475 0.561 1 1 74 . 6 1 1 A 8 8 PRO CB C 1776 32.201 32.415 -0.214 1 1 77 . 6 1 1 A 9 9 LEU H H 1777 8.349 8.239 0.110 1 1 78 . 6 1 1 A 9 9 LEU HA H 1777 4.365 4.451 -0.086 1 1 88 . 6 1 1 A 9 9 LEU CA C 1777 55.275 54.282 0.993 1 1 89 . 6 1 1 A 9 9 LEU CB C 1777 42.376 40.486 1.890 1 1 93 . 6 1 1 A 9 9 LEU N N 1777 123.820 122.423 1.397 1 1 94 . 6 1 1 A 10 10 VAL H H 1778 7.989 8.362 -0.373 1 1 95 . 6 1 1 A 10 10 VAL HA H 1778 4.182 4.477 -0.295 1 1 103 . 6 1 1 A 10 10 VAL CA C 1778 62.141 60.627 1.514 1 1 104 . 6 1 1 A 10 10 VAL CB C 1778 33.175 34.775 -1.600 1 1 106 . 6 1 1 A 10 10 VAL N N 1778 121.714 123.796 -2.082 1 1 107 . 6 1 1 A 11 11 GLY H H 1779 8.450 8.414 0.036 1 1 108 . 6 1 1 A 11 11 GLY HA2 H 1779 4.002 4.059 -0.057 1 1 109 . 6 1 1 A 11 11 GLY HA3 H 1779 4.002 4.059 -0.057 1 1 110 . 6 1 1 A 11 11 GLY CA C 1779 45.297 44.586 0.711 1 1 111 . 6 1 1 A 11 11 GLY N N 1779 113.826 115.137 -1.311 1 1 112 . 6 1 1 A 12 12 VAL H H 1780 8.013 8.116 -0.103 1 1 113 . 6 1 1 A 12 12 VAL HA H 1780 4.136 5.039 -0.903 1 1 121 . 6 1 1 A 12 12 VAL CA C 1780 62.466 59.233 3.233 1 1 122 . 6 1 1 A 12 12 VAL CB C 1780 32.752 36.053 -3.301 1 1 125 . 6 1 1 A 12 12 VAL N N 1780 120.109 117.292 2.817 1 1 126 . 6 1 1 A 13 13 ASN H H 1781 8.528 8.755 -0.227 1 1 127 . 6 1 1 A 13 13 ASN HA H 1781 4.712 4.961 -0.249 1 1 132 . 6 1 1 A 13 13 ASN CA C 1781 53.485 52.474 1.011 1 1 133 . 6 1 1 A 13 13 ASN CB C 1781 38.996 39.644 -0.648 1 1 134 . 6 1 1 A 13 13 ASN N N 1781 122.648 120.446 2.202 1 1 136 . 6 1 1 A 14 14 GLY H H 1782 8.283 8.490 -0.207 1 1 137 . 6 1 1 A 14 14 GLY HA2 H 1782 3.929 4.163 -0.234 1 1 138 . 6 1 1 A 14 14 GLY HA3 H 1782 3.929 4.163 -0.234 1 1 139 . 6 1 1 A 14 14 GLY CA C 1782 45.531 44.544 0.987 1 1 140 . 6 1 1 A 14 14 GLY N N 1782 110.229 108.667 1.562 1 1 141 . 6 1 1 A 15 15 LEU H H 1783 7.925 8.637 -0.712 1 1 142 . 6 1 1 A 15 15 LEU HA H 1783 4.340 5.123 -0.783 1 1 152 . 6 1 1 A 15 15 LEU CA C 1783 55.045 53.281 1.764 1 1 153 . 6 1 1 A 15 15 LEU CB C 1783 42.682 46.418 -3.736 1 1 157 . 6 1 1 A 15 15 LEU N N 1783 122.626 121.823 0.803 1 1 158 . 6 1 1 A 16 16 ASP H H 1784 8.360 8.614 -0.254 1 1 159 . 6 1 1 A 16 16 ASP HA H 1784 4.747 5.041 -0.294 1 1 162 . 6 1 1 A 16 16 ASP CA C 1784 53.939 53.327 0.612 1 1 163 . 6 1 1 A 16 16 ASP CB C 1784 41.150 44.313 -3.163 1 1 164 . 6 1 1 A 16 16 ASP N N 1784 122.868 120.177 2.691 1 1 165 . 6 1 1 A 17 17 VAL H H 1785 8.201 8.738 -0.537 1 1 166 . 6 1 1 A 17 17 VAL HA H 1785 4.237 4.051 0.186 1 1 174 . 6 1 1 A 17 17 VAL CA C 1785 62.881 63.386 -0.505 1 1 175 . 6 1 1 A 17 17 VAL CB C 1785 31.967 31.599 0.368 1 1 178 . 6 1 1 A 17 17 VAL N N 1785 121.110 122.518 -1.408 1 1 179 . 6 1 1 A 18 18 THR H H 1786 8.291 7.684 0.607 1 1 180 . 6 1 1 A 18 18 THR HA H 1786 4.466 4.212 0.254 1 1 185 . 6 1 1 A 18 18 THR CA C 1786 62.388 64.080 -1.692 1 1 186 . 6 1 1 A 18 18 THR CB C 1786 69.719 68.802 0.917 1 1 188 . 6 1 1 A 18 18 THR N N 1786 115.267 116.680 -1.413 1 1 189 . 6 1 1 A 19 19 SER H H 1787 8.148 7.280 0.868 1 1 190 . 6 1 1 A 19 19 SER HA H 1787 4.542 4.436 0.106 1 1 193 . 6 1 1 A 19 19 SER CA C 1787 59.096 59.109 -0.013 1 1 194 . 6 1 1 A 19 19 SER CB C 1787 63.993 63.529 0.464 1 1 195 . 6 1 1 A 19 19 SER N N 1787 118.576 117.964 0.612 1 1 196 . 6 1 1 A 20 20 LEU H H 1788 8.263 8.415 -0.152 1 1 197 . 6 1 1 A 20 20 LEU HA H 1788 4.243 4.928 -0.685 1 1 207 . 6 1 1 A 20 20 LEU CA C 1788 54.087 53.291 0.796 1 1 208 . 6 1 1 A 20 20 LEU CB C 1788 43.006 44.589 -1.583 1 1 212 . 6 1 1 A 20 20 LEU N N 1788 125.834 124.524 1.310 1 1 213 . 6 1 1 A 21 21 ARG H H 1789 8.191 8.492 -0.301 1 1 214 . 6 1 1 A 21 21 ARG HA H 1789 4.080 4.204 -0.124 1 1 222 . 6 1 1 A 21 21 ARG CA C 1789 54.894 54.211 0.683 1 1 223 . 6 1 1 A 21 21 ARG CB C 1789 30.881 30.653 0.228 1 1 226 . 6 1 1 A 21 21 ARG N N 1789 127.213 122.529 4.684 1 1 228 . 6 1 1 A 22 22 PRO HA H 1790 4.441 4.636 -0.195 1 1 233 . 6 1 1 A 22 22 PRO CA C 1790 62.882 62.550 0.332 1 1 234 . 6 1 1 A 22 22 PRO CB C 1790 32.204 32.064 0.140 1 1 237 . 6 1 1 A 23 23 PHE H H 1791 8.336 8.299 0.037 1 1 238 . 6 1 1 A 23 23 PHE HA H 1791 4.701 4.909 -0.208 1 1 246 . 6 1 1 A 23 23 PHE CA C 1791 57.504 56.686 0.818 1 1 247 . 6 1 1 A 23 23 PHE CB C 1791 42.192 41.617 0.575 1 1 251 . 6 1 1 A 23 23 PHE N N 1791 122.145 122.456 -0.311 1 1 252 . 6 1 1 A 24 24 ASP H H 1792 6.954 9.072 -2.118 1 1 253 . 6 1 1 A 24 24 ASP HA H 1792 5.039 5.419 -0.380 1 1 256 . 6 1 1 A 24 24 ASP CA C 1792 52.871 52.623 0.248 1 1 257 . 6 1 1 A 24 24 ASP CB C 1792 44.696 44.578 0.118 1 1 258 . 6 1 1 A 24 24 ASP N N 1792 127.481 125.872 1.609 1 1 259 . 6 1 1 A 25 25 LEU H H 1793 8.372 8.730 -0.358 1 1 260 . 6 1 1 A 25 25 LEU HA H 1793 4.336 5.046 -0.710 1 1 270 . 6 1 1 A 25 25 LEU CA C 1793 54.860 53.348 1.512 1 1 271 . 6 1 1 A 25 25 LEU CB C 1793 47.575 46.292 1.283 1 1 274 . 6 1 1 A 25 25 LEU N N 1793 123.241 122.437 0.804 1 1 275 . 6 1 1 A 26 26 VAL H H 1794 8.489 8.939 -0.450 1 1 276 . 6 1 1 A 26 26 VAL HA H 1794 4.903 5.153 -0.250 1 1 284 . 6 1 1 A 26 26 VAL CA C 1794 61.669 59.517 2.152 1 1 285 . 6 1 1 A 26 26 VAL CB C 1794 32.458 35.075 -2.617 1 1 288 . 6 1 1 A 26 26 VAL N N 1794 128.849 121.059 7.790 1 1 289 . 6 1 1 A 27 27 ILE H H 1795 9.101 9.143 -0.042 1 1 290 . 6 1 1 A 27 27 ILE HA H 1795 4.701 4.594 0.107 1 1 300 . 6 1 1 A 27 27 ILE CA C 1795 57.433 57.571 -0.138 1 1 301 . 6 1 1 A 27 27 ILE CB C 1795 41.865 41.624 0.241 1 1 305 . 6 1 1 A 27 27 ILE N N 1795 127.511 128.059 -0.548 1 1 306 . 6 1 1 A 28 28 PRO HA H 1796 4.838 4.617 0.221 1 1 313 . 6 1 1 A 28 28 PRO CA C 1796 62.406 62.891 -0.485 1 1 314 . 6 1 1 A 28 28 PRO CB C 1796 30.684 29.448 1.236 1 1 317 . 6 1 1 A 29 29 PHE H H 1797 8.255 8.261 -0.006 1 1 318 . 6 1 1 A 29 29 PHE HA H 1797 4.151 4.830 -0.679 1 1 326 . 6 1 1 A 29 29 PHE CA C 1797 60.405 58.151 2.254 1 1 327 . 6 1 1 A 29 29 PHE CB C 1797 41.395 40.910 0.485 1 1 331 . 6 1 1 A 29 29 PHE N N 1797 128.572 121.986 6.586 1 1 332 . 6 1 1 A 30 30 THR H H 1798 7.433 7.509 -0.076 1 1 333 . 6 1 1 A 30 30 THR HA H 1798 4.108 4.863 -0.755 1 1 338 . 6 1 1 A 30 30 THR CA C 1798 61.473 61.135 0.338 1 1 339 . 6 1 1 A 30 30 THR CB C 1798 69.324 71.684 -2.360 1 1 341 . 6 1 1 A 30 30 THR N N 1798 123.124 118.862 4.262 1 1 342 . 6 1 1 A 31 31 ILE H H 1799 8.402 9.071 -0.669 1 1 343 . 6 1 1 A 31 31 ILE HA H 1799 3.653 4.474 -0.821 1 1 353 . 6 1 1 A 31 31 ILE CA C 1799 61.802 61.247 0.555 1 1 354 . 6 1 1 A 31 31 ILE CB C 1799 38.548 37.858 0.690 1 1 358 . 6 1 1 A 31 31 ILE N N 1799 128.616 128.105 0.511 1 1 359 . 6 1 1 A 32 32 LYS H H 1800 7.742 8.823 -1.081 1 1 360 . 6 1 1 A 32 32 LYS HA H 1800 4.558 4.603 -0.045 1 1 365 . 6 1 1 A 32 32 LYS CA C 1800 56.566 53.987 2.579 1 1 366 . 6 1 1 A 32 32 LYS CB C 1800 31.982 34.424 -2.442 1 1 368 . 6 1 1 A 32 32 LYS N N 1800 128.656 127.155 1.501 1 1 369 . 6 1 1 A 33 33 LYS HA H 1801 4.531 4.487 0.044 1 1 378 . 6 1 1 A 33 33 LYS CA C 1801 56.310 57.805 -1.495 1 1 379 . 6 1 1 A 33 33 LYS CB C 1801 33.027 33.042 -0.015 1 1 383 . 6 1 1 A 34 34 GLY H H 1802 8.088 8.538 -0.450 1 1 384 . 6 1 1 A 34 34 GLY HA2 H 1802 4.159 4.158 0.001 1 1 385 . 6 1 1 A 34 34 GLY HA3 H 1802 3.712 4.239 -0.527 1 1 386 . 6 1 1 A 34 34 GLY CA C 1802 45.302 44.596 0.706 1 1 387 . 6 1 1 A 34 34 GLY N N 1802 110.338 113.340 -3.002 1 1 388 . 6 1 1 A 35 35 GLU H H 1803 8.219 8.047 0.172 1 1 389 . 6 1 1 A 35 35 GLU HA H 1803 4.692 4.938 -0.246 1 1 394 . 6 1 1 A 35 35 GLU CA C 1803 55.160 55.332 -0.172 1 1 395 . 6 1 1 A 35 35 GLU CB C 1803 32.407 33.936 -1.529 1 1 397 . 6 1 1 A 35 35 GLU N N 1803 119.576 120.465 -0.889 1 1 398 . 6 1 1 A 36 36 ILE H H 1804 8.869 8.739 0.130 1 1 399 . 6 1 1 A 36 36 ILE HA H 1804 5.468 5.118 0.350 1 1 409 . 6 1 1 A 36 36 ILE CA C 1804 58.861 58.749 0.112 1 1 410 . 6 1 1 A 36 36 ILE CB C 1804 41.007 41.885 -0.878 1 1 414 . 6 1 1 A 36 36 ILE N N 1804 128.141 124.304 3.837 1 1 415 . 6 1 1 A 37 37 THR H H 1805 9.075 8.840 0.235 1 1 416 . 6 1 1 A 37 37 THR HA H 1805 4.703 5.118 -0.415 1 1 421 . 6 1 1 A 37 37 THR CA C 1805 59.932 60.054 -0.122 1 1 422 . 6 1 1 A 37 37 THR CB C 1805 72.441 72.597 -0.156 1 1 424 . 6 1 1 A 37 37 THR N N 1805 119.846 116.879 2.967 1 1 425 . 6 1 1 A 38 38 GLY H H 1806 8.468 8.389 0.079 1 1 426 . 6 1 1 A 38 38 GLY HA2 H 1806 5.076 4.294 0.782 1 1 427 . 6 1 1 A 38 38 GLY HA3 H 1806 3.503 4.307 -0.804 1 1 428 . 6 1 1 A 38 38 GLY CA C 1806 45.593 45.678 -0.085 1 1 429 . 6 1 1 A 38 38 GLY N N 1806 107.815 108.682 -0.867 1 1 430 . 6 1 1 A 39 39 GLU H H 1807 8.519 8.551 -0.032 1 1 431 . 6 1 1 A 39 39 GLU HA H 1807 4.713 5.080 -0.367 1 1 436 . 6 1 1 A 39 39 GLU CA C 1807 56.936 55.467 1.469 1 1 437 . 6 1 1 A 39 39 GLU CB C 1807 34.937 33.967 0.970 1 1 439 . 6 1 1 A 39 39 GLU N N 1807 120.173 119.779 0.394 1 1 440 . 6 1 1 A 40 40 VAL H H 1808 9.156 9.398 -0.242 1 1 441 . 6 1 1 A 40 40 VAL HA H 1808 4.778 4.607 0.171 1 1 449 . 6 1 1 A 40 40 VAL CA C 1808 60.574 61.264 -0.690 1 1 450 . 6 1 1 A 40 40 VAL CB C 1808 34.168 33.051 1.117 1 1 452 . 6 1 1 A 40 40 VAL N N 1808 126.330 127.849 -1.519 1 1 453 . 6 1 1 A 41 41 ARG H H 1809 9.044 9.010 0.034 1 1 454 . 6 1 1 A 41 41 ARG HA H 1809 4.778 4.962 -0.184 1 1 462 . 6 1 1 A 41 41 ARG CA C 1809 55.317 54.137 1.180 1 1 463 . 6 1 1 A 41 41 ARG CB C 1809 31.940 32.646 -0.706 1 1 466 . 6 1 1 A 41 41 ARG N N 1809 127.098 126.252 0.846 1 1 468 . 6 1 1 A 42 42 MET H H 1810 8.264 8.692 -0.428 1 1 469 . 6 1 1 A 42 42 MET HA H 1810 4.050 4.610 -0.560 1 1 477 . 6 1 1 A 42 42 MET CA C 1810 53.716 53.701 0.015 1 1 478 . 6 1 1 A 42 42 MET CB C 1810 32.779 33.219 -0.440 1 1 481 . 6 1 1 A 42 42 MET N N 1810 123.461 123.164 0.297 1 1 482 . 6 1 1 A 43 43 PRO HA H 1811 4.179 4.231 -0.052 1 1 489 . 6 1 1 A 43 43 PRO CA C 1811 66.422 64.645 1.777 1 1 490 . 6 1 1 A 43 43 PRO CB C 1811 31.462 31.794 -0.332 1 1 493 . 6 1 1 A 44 44 SER H H 1812 8.860 7.813 1.047 1 1 494 . 6 1 1 A 44 44 SER HA H 1812 5.516 4.196 1.320 1 1 497 . 6 1 1 A 44 44 SER CA C 1812 59.937 58.799 1.138 1 1 498 . 6 1 1 A 44 44 SER CB C 1812 62.755 63.330 -0.575 1 1 499 . 6 1 1 A 44 44 SER N N 1812 112.267 110.577 1.690 1 1 500 . 6 1 1 A 45 45 GLY H H 1813 8.368 9.089 -0.721 1 1 501 . 6 1 1 A 45 45 GLY HA2 H 1813 4.461 3.899 0.562 1 1 502 . 6 1 1 A 45 45 GLY HA3 H 1813 3.569 3.906 -0.337 1 1 503 . 6 1 1 A 45 45 GLY CA C 1813 44.525 46.104 -1.579 1 1 504 . 6 1 1 A 45 45 GLY N N 1813 112.727 111.922 0.805 1 1 505 . 6 1 1 A 46 46 LYS H H 1814 7.126 7.460 -0.334 1 1 506 . 6 1 1 A 46 46 LYS HA H 1814 4.206 4.972 -0.766 1 1 515 . 6 1 1 A 46 46 LYS CA C 1814 57.460 54.269 3.191 1 1 516 . 6 1 1 A 46 46 LYS CB C 1814 33.453 36.825 -3.372 1 1 520 . 6 1 1 A 46 46 LYS N N 1814 122.101 115.191 6.910 1 1 521 . 6 1 1 A 47 47 VAL H H 1815 8.056 8.652 -0.596 1 1 522 . 6 1 1 A 47 47 VAL HA H 1815 5.400 5.093 0.307 1 1 530 . 6 1 1 A 47 47 VAL CA C 1815 60.048 59.216 0.832 1 1 531 . 6 1 1 A 47 47 VAL CB C 1815 35.044 36.138 -1.094 1 1 534 . 6 1 1 A 47 47 VAL N N 1815 118.680 114.880 3.800 1 1 535 . 6 1 1 A 48 48 ALA H H 1816 9.110 8.460 0.650 1 1 536 . 6 1 1 A 48 48 ALA HA H 1816 4.804 4.922 -0.118 1 1 540 . 6 1 1 A 48 48 ALA CA C 1816 50.808 51.272 -0.464 1 1 541 . 6 1 1 A 48 48 ALA CB C 1816 24.108 24.009 0.099 1 1 542 . 6 1 1 A 48 48 ALA N N 1816 128.274 123.452 4.822 1 1 543 . 6 1 1 A 49 49 GLN H H 1817 8.725 8.539 0.186 1 1 544 . 6 1 1 A 49 49 GLN HA H 1817 5.069 4.835 0.234 1 1 551 . 6 1 1 A 49 49 GLN CA C 1817 53.524 52.220 1.304 1 1 552 . 6 1 1 A 49 49 GLN CB C 1817 30.432 29.871 0.561 1 1 554 . 6 1 1 A 49 49 GLN N N 1817 120.102 117.841 2.261 1 1 556 . 6 1 1 A 50 50 PRO HA H 1818 5.136 4.829 0.307 1 1 563 . 6 1 1 A 50 50 PRO CA C 1818 61.966 62.400 -0.434 1 1 564 . 6 1 1 A 50 50 PRO CB C 1818 32.722 32.591 0.131 1 1 567 . 6 1 1 A 51 51 THR H H 1819 9.072 8.708 0.364 1 1 568 . 6 1 1 A 51 51 THR HA H 1819 4.566 5.018 -0.452 1 1 573 . 6 1 1 A 51 51 THR CA C 1819 62.695 60.997 1.698 1 1 574 . 6 1 1 A 51 51 THR CB C 1819 70.056 70.574 -0.518 1 1 576 . 6 1 1 A 51 51 THR N N 1819 117.512 113.334 4.178 1 1 577 . 6 1 1 A 52 52 ILE H H 1820 8.900 9.295 -0.395 1 1 578 . 6 1 1 A 52 52 ILE HA H 1820 4.905 4.920 -0.015 1 1 588 . 6 1 1 A 52 52 ILE CA C 1820 60.869 59.841 1.028 1 1 589 . 6 1 1 A 52 52 ILE CB C 1820 39.670 40.010 -0.340 1 1 593 . 6 1 1 A 52 52 ILE N N 1820 129.513 128.427 1.086 1 1 594 . 6 1 1 A 53 53 THR H H 1821 9.200 9.278 -0.078 1 1 595 . 6 1 1 A 53 53 THR HA H 1821 4.541 4.874 -0.333 1 1 600 . 6 1 1 A 53 53 THR CA C 1821 61.084 61.799 -0.715 1 1 601 . 6 1 1 A 53 53 THR CB C 1821 71.410 71.848 -0.438 1 1 603 . 6 1 1 A 53 53 THR N N 1821 125.271 123.998 1.273 1 1 604 . 6 1 1 A 54 54 ASP H H 1822 8.918 8.767 0.151 1 1 605 . 6 1 1 A 54 54 ASP HA H 1822 4.756 4.779 -0.023 1 1 608 . 6 1 1 A 54 54 ASP CA C 1822 53.906 54.506 -0.600 1 1 609 . 6 1 1 A 54 54 ASP CB C 1822 41.443 41.822 -0.379 1 1 610 . 6 1 1 A 54 54 ASP N N 1822 126.647 127.087 -0.440 1 1 611 . 6 1 1 A 55 55 ASN H H 1823 8.342 8.953 -0.611 1 1 612 . 6 1 1 A 55 55 ASN HA H 1823 4.704 4.622 0.082 1 1 617 . 6 1 1 A 55 55 ASN CA C 1823 54.421 53.150 1.271 1 1 618 . 6 1 1 A 55 55 ASN CB C 1823 38.557 38.658 -0.101 1 1 619 . 6 1 1 A 55 55 ASN N N 1823 126.271 124.614 1.657 1 1 621 . 6 1 1 A 56 56 LYS H H 1824 9.232 7.991 1.241 1 1 622 . 6 1 1 A 56 56 LYS HA H 1824 4.099 4.025 0.074 1 1 631 . 6 1 1 A 56 56 LYS CA C 1824 58.015 57.785 0.230 1 1 632 . 6 1 1 A 56 56 LYS CB C 1824 28.691 29.922 -1.231 1 1 636 . 6 1 1 A 56 56 LYS N N 1824 115.352 115.226 0.126 1 1 637 . 6 1 1 A 57 57 ASP H H 1825 7.905 8.463 -0.558 1 1 638 . 6 1 1 A 57 57 ASP HA H 1825 4.791 4.656 0.135 1 1 641 . 6 1 1 A 57 57 ASP CA C 1825 52.401 53.745 -1.344 1 1 642 . 6 1 1 A 57 57 ASP CB C 1825 41.166 41.508 -0.342 1 1 643 . 6 1 1 A 57 57 ASP N N 1825 119.741 117.949 1.792 1 1 644 . 6 1 1 A 58 58 GLY H H 1826 8.930 9.041 -0.111 1 1 645 . 6 1 1 A 58 58 GLY HA2 H 1826 4.265 3.852 0.413 1 1 646 . 6 1 1 A 58 58 GLY HA3 H 1826 3.712 3.866 -0.154 1 1 647 . 6 1 1 A 58 58 GLY CA C 1826 44.870 45.691 -0.821 1 1 648 . 6 1 1 A 58 58 GLY N N 1826 109.578 107.714 1.864 1 1 649 . 6 1 1 A 59 59 THR H H 1827 8.004 7.628 0.376 1 1 650 . 6 1 1 A 59 59 THR HA H 1827 5.394 5.048 0.346 1 1 655 . 6 1 1 A 59 59 THR CA C 1827 60.262 59.144 1.118 1 1 656 . 6 1 1 A 59 59 THR CB C 1827 73.892 72.703 1.189 1 1 658 . 6 1 1 A 59 59 THR N N 1827 112.179 110.154 2.025 1 1 659 . 6 1 1 A 60 60 VAL H H 1828 8.822 9.362 -0.540 1 1 660 . 6 1 1 A 60 60 VAL HA H 1828 5.124 4.941 0.183 1 1 668 . 6 1 1 A 60 60 VAL CA C 1828 59.430 59.693 -0.263 1 1 669 . 6 1 1 A 60 60 VAL CB C 1828 35.088 34.111 0.977 1 1 672 . 6 1 1 A 60 60 VAL N N 1828 115.300 117.481 -2.181 1 1 673 . 6 1 1 A 61 61 THR H H 1829 9.115 9.022 0.093 1 1 674 . 6 1 1 A 61 61 THR HA H 1829 5.128 5.000 0.128 1 1 679 . 6 1 1 A 61 61 THR CA C 1829 61.934 61.725 0.209 1 1 680 . 6 1 1 A 61 61 THR CB C 1829 70.561 70.582 -0.021 1 1 682 . 6 1 1 A 61 61 THR N N 1829 121.210 119.674 1.536 1 1 683 . 6 1 1 A 62 62 VAL H H 1830 9.530 9.242 0.288 1 1 684 . 6 1 1 A 62 62 VAL HA H 1830 4.803 5.069 -0.266 1 1 692 . 6 1 1 A 62 62 VAL CA C 1830 60.580 60.582 -0.002 1 1 693 . 6 1 1 A 62 62 VAL CB C 1830 33.747 34.292 -0.545 1 1 696 . 6 1 1 A 62 62 VAL N N 1830 129.896 126.776 3.120 1 1 697 . 6 1 1 A 63 63 ARG H H 1831 8.879 9.042 -0.163 1 1 698 . 6 1 1 A 63 63 ARG HA H 1831 5.282 5.019 0.263 1 1 705 . 6 1 1 A 63 63 ARG CA C 1831 54.759 54.070 0.689 1 1 706 . 6 1 1 A 63 63 ARG CB C 1831 34.410 34.437 -0.027 1 1 709 . 6 1 1 A 63 63 ARG N N 1831 125.701 125.609 0.092 1 1 710 . 6 1 1 A 64 64 TYR H H 1832 8.878 8.657 0.221 1 1 711 . 6 1 1 A 64 64 TYR HA H 1832 4.888 4.859 0.029 1 1 718 . 6 1 1 A 64 64 TYR CA C 1832 57.694 57.945 -0.251 1 1 719 . 6 1 1 A 64 64 TYR CB C 1832 42.389 42.310 0.079 1 1 722 . 6 1 1 A 64 64 TYR N N 1832 122.731 123.477 -0.746 1 1 723 . 6 1 1 A 65 65 ALA H H 1833 7.925 8.214 -0.289 1 1 724 . 6 1 1 A 65 65 ALA HA H 1833 4.736 4.460 0.276 1 1 728 . 6 1 1 A 65 65 ALA CA C 1833 47.938 49.543 -1.605 1 1 729 . 6 1 1 A 65 65 ALA CB C 1833 18.320 19.543 -1.223 1 1 730 . 6 1 1 A 65 65 ALA N N 1833 135.415 128.922 6.493 1 1 731 . 6 1 1 A 66 66 PRO HA H 1834 4.198 4.615 -0.417 1 1 738 . 6 1 1 A 66 66 PRO CA C 1834 62.701 62.533 0.168 1 1 739 . 6 1 1 A 66 66 PRO CB C 1834 34.445 33.219 1.226 1 1 742 . 6 1 1 A 67 67 SER H H 1835 9.019 8.790 0.229 1 1 743 . 6 1 1 A 67 67 SER HA H 1835 4.555 4.590 -0.035 1 1 746 . 6 1 1 A 67 67 SER CA C 1835 57.320 58.296 -0.976 1 1 747 . 6 1 1 A 67 67 SER CB C 1835 64.778 66.119 -1.341 1 1 748 . 6 1 1 A 67 67 SER N N 1835 112.422 115.528 -3.106 1 1 749 . 6 1 1 A 68 68 GLU H H 1836 7.625 7.679 -0.054 1 1 750 . 6 1 1 A 68 68 GLU HA H 1836 4.513 4.579 -0.066 1 1 755 . 6 1 1 A 68 68 GLU CA C 1836 54.777 55.754 -0.977 1 1 756 . 6 1 1 A 68 68 GLU CB C 1836 33.981 33.312 0.669 1 1 758 . 6 1 1 A 68 68 GLU N N 1836 123.025 118.872 4.153 1 1 759 . 6 1 1 A 69 69 ALA H H 1837 8.133 8.367 -0.234 1 1 760 . 6 1 1 A 69 69 ALA HA H 1837 4.088 4.098 -0.010 1 1 764 . 6 1 1 A 69 69 ALA CA C 1837 51.070 52.452 -1.382 1 1 765 . 6 1 1 A 69 69 ALA CB C 1837 19.665 19.933 -0.268 1 1 766 . 6 1 1 A 69 69 ALA N N 1837 122.311 125.771 -3.460 1 1 767 . 6 1 1 A 70 70 GLY H H 1838 9.120 8.112 1.008 1 1 768 . 6 1 1 A 70 70 GLY HA2 H 1838 4.453 3.885 0.568 1 1 769 . 6 1 1 A 70 70 GLY HA3 H 1838 2.953 3.999 -1.046 1 1 770 . 6 1 1 A 70 70 GLY CA C 1838 43.362 43.571 -0.209 1 1 771 . 6 1 1 A 70 70 GLY N N 1838 107.031 106.057 0.974 1 1 772 . 6 1 1 A 71 71 LEU H H 1839 9.096 8.296 0.800 1 1 773 . 6 1 1 A 71 71 LEU HA H 1839 4.336 4.545 -0.209 1 1 783 . 6 1 1 A 71 71 LEU CA C 1839 56.657 54.515 2.142 1 1 784 . 6 1 1 A 71 71 LEU CB C 1839 42.032 43.422 -1.390 1 1 788 . 6 1 1 A 71 71 LEU N N 1839 127.931 121.427 6.504 1 1 789 . 6 1 1 A 72 72 HIS H H 1840 9.359 9.345 0.014 1 1 790 . 6 1 1 A 72 72 HIS HA H 1840 4.595 5.187 -0.592 1 1 796 . 6 1 1 A 72 72 HIS CA C 1840 54.539 54.348 0.191 1 1 797 . 6 1 1 A 72 72 HIS CB C 1840 31.421 33.234 -1.813 1 1 800 . 6 1 1 A 72 72 HIS N N 1840 128.527 125.797 2.730 1 1 802 . 6 1 1 A 73 73 GLU H H 1841 7.925 8.767 -0.842 1 1 803 . 6 1 1 A 73 73 GLU HA H 1841 5.142 5.321 -0.179 1 1 808 . 6 1 1 A 73 73 GLU CA C 1841 54.381 55.013 -0.632 1 1 809 . 6 1 1 A 73 73 GLU CB C 1841 34.043 33.904 0.139 1 1 811 . 6 1 1 A 73 73 GLU N N 1841 119.347 118.537 0.810 1 1 812 . 6 1 1 A 74 74 MET H H 1842 9.383 9.013 0.370 1 1 813 . 6 1 1 A 74 74 MET HA H 1842 5.548 5.117 0.431 1 1 821 . 6 1 1 A 74 74 MET CA C 1842 53.859 54.502 -0.643 1 1 822 . 6 1 1 A 74 74 MET CB C 1842 38.571 36.246 2.325 1 1 825 . 6 1 1 A 74 74 MET N N 1842 124.747 119.915 4.832 1 1 826 . 6 1 1 A 75 75 ASP H H 1843 9.005 9.032 -0.027 1 1 827 . 6 1 1 A 75 75 ASP HA H 1843 5.277 5.427 -0.150 1 1 830 . 6 1 1 A 75 75 ASP CA C 1843 52.774 52.824 -0.050 1 1 831 . 6 1 1 A 75 75 ASP CB C 1843 43.493 42.795 0.698 1 1 832 . 6 1 1 A 75 75 ASP N N 1843 128.148 125.219 2.929 1 1 833 . 6 1 1 A 76 76 ILE H H 1844 9.434 8.581 0.853 1 1 834 . 6 1 1 A 76 76 ILE HA H 1844 4.672 4.818 -0.146 1 1 844 . 6 1 1 A 76 76 ILE CA C 1844 60.715 59.458 1.257 1 1 845 . 6 1 1 A 76 76 ILE CB C 1844 39.470 40.322 -0.852 1 1 849 . 6 1 1 A 76 76 ILE N N 1844 124.097 123.027 1.070 1 1 850 . 6 1 1 A 77 77 ARG H H 1845 8.888 9.011 -0.123 1 1 851 . 6 1 1 A 77 77 ARG HA H 1845 5.050 4.966 0.084 1 1 859 . 6 1 1 A 77 77 ARG CA C 1845 53.780 54.241 -0.461 1 1 860 . 6 1 1 A 77 77 ARG CB C 1845 34.564 33.653 0.911 1 1 863 . 6 1 1 A 77 77 ARG N N 1845 124.944 124.108 0.836 1 1 865 . 6 1 1 A 78 78 TYR H H 1846 8.974 9.137 -0.163 1 1 866 . 6 1 1 A 78 78 TYR HA H 1846 5.151 4.900 0.251 1 1 873 . 6 1 1 A 78 78 TYR CA C 1846 55.909 57.526 -1.617 1 1 874 . 6 1 1 A 78 78 TYR CB C 1846 41.732 40.852 0.880 1 1 877 . 6 1 1 A 78 78 TYR N N 1846 121.774 124.419 -2.645 1 1 878 . 6 1 1 A 79 79 ASP H H 1847 9.026 9.297 -0.271 1 1 879 . 6 1 1 A 79 79 ASP HA H 1847 4.127 4.220 -0.093 1 1 882 . 6 1 1 A 79 79 ASP CA C 1847 55.808 55.080 0.728 1 1 883 . 6 1 1 A 79 79 ASP CB C 1847 39.181 39.596 -0.415 1 1 884 . 6 1 1 A 79 79 ASP N N 1847 131.304 127.948 3.356 1 1 885 . 6 1 1 A 80 80 ASN H H 1848 8.608 8.463 0.145 1 1 886 . 6 1 1 A 80 80 ASN HA H 1848 3.990 4.378 -0.388 1 1 891 . 6 1 1 A 80 80 ASN CA C 1848 55.149 54.654 0.495 1 1 892 . 6 1 1 A 80 80 ASN CB C 1848 38.470 38.946 -0.476 1 1 893 . 6 1 1 A 80 80 ASN N N 1848 108.490 115.012 -6.522 1 1 895 . 6 1 1 A 81 81 MET H H 1849 7.820 8.022 -0.202 1 1 896 . 6 1 1 A 81 81 MET HA H 1849 4.819 4.885 -0.066 1 1 904 . 6 1 1 A 81 81 MET CA C 1849 53.852 53.766 0.086 1 1 905 . 6 1 1 A 81 81 MET CB C 1849 34.665 33.360 1.305 1 1 908 . 6 1 1 A 81 81 MET N N 1849 121.878 119.138 2.740 1 1 909 . 6 1 1 A 82 82 HIS H H 1850 8.575 8.793 -0.218 1 1 910 . 6 1 1 A 82 82 HIS HA H 1850 4.539 4.717 -0.178 1 1 915 . 6 1 1 A 82 82 HIS CA C 1850 58.819 57.373 1.446 1 1 916 . 6 1 1 A 82 82 HIS CB C 1850 32.419 30.504 1.915 1 1 919 . 6 1 1 A 82 82 HIS N N 1850 124.291 121.099 3.192 1 1 920 . 6 1 1 A 83 83 ILE H H 1851 8.333 7.959 0.374 1 1 921 . 6 1 1 A 83 83 ILE HA H 1851 4.608 4.432 0.176 1 1 931 . 6 1 1 A 83 83 ILE CA C 1851 60.727 59.429 1.298 1 1 932 . 6 1 1 A 83 83 ILE CB C 1851 35.928 37.650 -1.722 1 1 936 . 6 1 1 A 83 83 ILE N N 1851 120.786 121.000 -0.214 1 1 937 . 6 1 1 A 84 84 PRO HA H 1852 4.426 4.339 0.087 1 1 944 . 6 1 1 A 84 84 PRO CA C 1852 65.249 64.205 1.044 1 1 945 . 6 1 1 A 84 84 PRO CB C 1852 31.120 31.525 -0.405 1 1 948 . 6 1 1 A 85 85 GLY H H 1853 8.498 9.051 -0.553 1 1 949 . 6 1 1 A 85 85 GLY HA2 H 1853 4.284 4.074 0.210 1 1 950 . 6 1 1 A 85 85 GLY HA3 H 1853 3.397 4.158 -0.761 1 1 951 . 6 1 1 A 85 85 GLY CA C 1853 44.913 45.245 -0.332 1 1 952 . 6 1 1 A 85 85 GLY N N 1853 114.093 113.758 0.335 1 1 953 . 6 1 1 A 86 86 SER H H 1854 7.823 8.038 -0.215 1 1 954 . 6 1 1 A 86 86 SER HA H 1854 4.834 4.732 0.102 1 1 957 . 6 1 1 A 86 86 SER CA C 1854 55.628 55.641 -0.013 1 1 958 . 6 1 1 A 86 86 SER CB C 1854 63.063 64.034 -0.971 1 1 959 . 6 1 1 A 86 86 SER N N 1854 112.722 117.844 -5.122 1 1 960 . 6 1 1 A 87 87 PRO HA H 1855 5.681 4.730 0.951 1 1 967 . 6 1 1 A 87 87 PRO CA C 1855 63.079 62.372 0.707 1 1 968 . 6 1 1 A 87 87 PRO CB C 1855 34.406 33.035 1.371 1 1 971 . 6 1 1 A 88 88 LEU H H 1856 9.168 8.831 0.337 1 1 972 . 6 1 1 A 88 88 LEU HA H 1856 4.909 5.207 -0.298 1 1 982 . 6 1 1 A 88 88 LEU CA C 1856 53.839 53.352 0.487 1 1 983 . 6 1 1 A 88 88 LEU CB C 1856 45.558 45.602 -0.044 1 1 987 . 6 1 1 A 88 88 LEU N N 1856 122.495 121.246 1.249 1 1 988 . 6 1 1 A 89 89 GLN H H 1857 9.583 8.756 0.827 1 1 989 . 6 1 1 A 89 89 GLN HA H 1857 5.508 5.342 0.166 1 1 996 . 6 1 1 A 89 89 GLN CA C 1857 54.609 54.862 -0.253 1 1 997 . 6 1 1 A 89 89 GLN CB C 1857 32.840 32.728 0.112 1 1 999 . 6 1 1 A 89 89 GLN N N 1857 119.151 121.764 -2.613 1 1 1001 . 6 1 1 A 90 90 PHE H H 1858 8.600 8.972 -0.372 1 1 1002 . 6 1 1 A 90 90 PHE HA H 1858 5.095 5.037 0.058 1 1 1010 . 6 1 1 A 90 90 PHE CA C 1858 56.161 56.058 0.103 1 1 1011 . 6 1 1 A 90 90 PHE CB C 1858 41.411 40.602 0.809 1 1 1015 . 6 1 1 A 90 90 PHE N N 1858 118.242 119.858 -1.616 1 1 1016 . 6 1 1 A 91 91 TYR H H 1859 9.892 8.775 1.117 1 1 1017 . 6 1 1 A 91 91 TYR HA H 1859 4.790 4.942 -0.152 1 1 1024 . 6 1 1 A 91 91 TYR CA C 1859 58.205 56.623 1.582 1 1 1025 . 6 1 1 A 91 91 TYR CB C 1859 40.867 41.008 -0.141 1 1 1028 . 6 1 1 A 91 91 TYR N N 1859 127.393 122.167 5.226 1 1 1029 . 6 1 1 A 92 92 VAL H H 1860 8.072 8.323 -0.251 1 1 1030 . 6 1 1 A 92 92 VAL HA H 1860 4.377 4.482 -0.105 1 1 1038 . 6 1 1 A 92 92 VAL CA C 1860 62.583 60.941 1.642 1 1 1039 . 6 1 1 A 92 92 VAL CB C 1860 33.609 32.875 0.734 1 1 1042 . 6 1 1 A 92 92 VAL N N 1860 132.007 126.949 5.058 1 1 1043 . 6 1 1 A 93 93 ASP H H 1861 8.438 8.412 0.026 1 1 1044 . 6 1 1 A 93 93 ASP HA H 1861 5.024 4.953 0.071 1 1 1047 . 6 1 1 A 93 93 ASP CA C 1861 50.678 53.166 -2.488 1 1 1048 . 6 1 1 A 93 93 ASP CB C 1861 46.086 44.929 1.157 1 1 1049 . 6 1 1 A 93 93 ASP N N 1861 130.459 125.133 5.326 1 1 1050 . 6 1 1 A 94 94 TYR H H 1862 9.674 8.836 0.838 1 1 1051 . 6 1 1 A 94 94 TYR HA H 1862 4.606 4.757 -0.151 1 1 1058 . 6 1 1 A 94 94 TYR CA C 1862 58.983 58.147 0.836 1 1 1059 . 6 1 1 A 94 94 TYR CB C 1862 39.727 39.179 0.548 1 1 1062 . 6 1 1 A 94 94 TYR N N 1862 120.069 120.492 -0.423 1 1 1063 . 6 1 1 A 95 95 VAL H H 1863 8.371 9.252 -0.881 1 1 1064 . 6 1 1 A 95 95 VAL HA H 1863 3.654 3.887 -0.233 1 1 1072 . 6 1 1 A 95 95 VAL CA C 1863 64.922 64.968 -0.046 1 1 1073 . 6 1 1 A 95 95 VAL CB C 1863 32.270 31.531 0.739 1 1 1076 . 6 1 1 A 95 95 VAL N N 1863 121.770 122.748 -0.978 1 1 1077 . 6 1 1 A 96 96 ASN H H 1864 8.729 8.324 0.405 1 1 1078 . 6 1 1 A 96 96 ASN HA H 1864 4.901 4.677 0.224 1 1 1083 . 6 1 1 A 96 96 ASN CA C 1864 52.652 53.812 -1.160 1 1 1084 . 6 1 1 A 96 96 ASN CB C 1864 38.160 37.912 0.248 1 1 1085 . 6 1 1 A 96 96 ASN N N 1864 120.006 117.991 2.015 1 1 1087 . 6 1 1 A 97 97 CYS H H 1865 7.875 7.198 0.677 1 1 1088 . 6 1 1 A 97 97 CYS HA H 1865 4.575 4.297 0.278 1 1 1091 . 6 1 1 A 97 97 CYS CA C 1865 57.009 59.460 -2.451 1 1 1092 . 6 1 1 A 97 97 CYS CB C 1865 29.845 27.732 2.113 1 1 1093 . 6 1 1 A 97 97 CYS N N 1865 117.023 119.704 -2.681 1 1 1094 . 6 1 1 A 98 98 GLY HA2 H 1866 4.045 3.912 0.133 1 1 1095 . 6 1 1 A 98 98 GLY HA3 H 1866 3.866 3.922 -0.056 1 1 1096 . 6 1 1 A 98 98 GLY CA C 1866 46.078 45.289 0.789 1 1 1097 . 6 1 1 A 99 99 HIS H H 1867 7.144 7.470 -0.326 1 1 1098 . 6 1 1 A 99 99 HIS HA H 1867 4.940 4.510 0.430 1 1 1103 . 6 1 1 A 99 99 HIS CA C 1867 53.843 55.910 -2.067 1 1 1104 . 6 1 1 A 99 99 HIS CB C 1867 31.584 30.780 0.804 1 1 1107 . 6 1 1 A 99 99 HIS N N 1867 115.591 117.910 -2.319 1 1 1108 . 6 1 1 A 100 100 VAL H H 1868 8.434 8.451 -0.017 1 1 1109 . 6 1 1 A 100 100 VAL HA H 1868 4.143 4.210 -0.067 1 1 1117 . 6 1 1 A 100 100 VAL CA C 1868 63.974 63.706 0.268 1 1 1118 . 6 1 1 A 100 100 VAL CB C 1868 31.525 32.382 -0.857 1 1 1121 . 6 1 1 A 100 100 VAL N N 1868 122.851 121.225 1.626 1 1 1122 . 6 1 1 A 101 101 THR H H 1869 7.869 8.828 -0.959 1 1 1123 . 6 1 1 A 101 101 THR HA H 1869 5.217 4.839 0.378 1 1 1128 . 6 1 1 A 101 101 THR CA C 1869 59.495 61.177 -1.682 1 1 1129 . 6 1 1 A 101 101 THR CB C 1869 72.402 70.828 1.574 1 1 1131 . 6 1 1 A 101 101 THR N N 1869 118.578 119.482 -0.904 1 1 1132 . 6 1 1 A 102 102 ALA H H 1870 8.512 9.055 -0.543 1 1 1133 . 6 1 1 A 102 102 ALA HA H 1870 5.687 5.619 0.068 1 1 1137 . 6 1 1 A 102 102 ALA CA C 1870 50.497 50.392 0.105 1 1 1138 . 6 1 1 A 102 102 ALA CB C 1870 23.128 23.076 0.052 1 1 1139 . 6 1 1 A 102 102 ALA N N 1870 125.193 127.274 -2.081 1 1 1140 . 6 1 1 A 103 103 TYR H H 1871 8.753 8.773 -0.020 1 1 1141 . 6 1 1 A 103 103 TYR HA H 1871 5.019 5.109 -0.090 1 1 1148 . 6 1 1 A 103 103 TYR CA C 1871 56.303 56.287 0.016 1 1 1149 . 6 1 1 A 103 103 TYR CB C 1871 39.347 41.241 -1.894 1 1 1152 . 6 1 1 A 103 103 TYR N N 1871 119.968 116.624 3.344 1 1 1153 . 6 1 1 A 104 104 GLY H H 1872 9.006 8.663 0.343 1 1 1154 . 6 1 1 A 104 104 GLY HA2 H 1872 5.326 4.304 1.022 1 1 1155 . 6 1 1 A 104 104 GLY HA3 H 1872 4.226 4.334 -0.108 1 1 1156 . 6 1 1 A 104 104 GLY CA C 1872 44.624 44.514 0.110 1 1 1157 . 6 1 1 A 104 104 GLY N N 1872 109.622 107.048 2.574 1 1 1158 . 6 1 1 A 105 105 PRO HA H 1873 4.450 4.469 -0.019 1 1 1165 . 6 1 1 A 105 105 PRO CA C 1873 66.676 64.958 1.718 1 1 1166 . 6 1 1 A 105 105 PRO CB C 1873 32.425 32.102 0.323 1 1 1169 . 6 1 1 A 106 106 GLY H H 1874 9.251 8.725 0.526 1 1 1170 . 6 1 1 A 106 106 GLY HA2 H 1874 4.600 3.909 0.691 1 1 1171 . 6 1 1 A 106 106 GLY HA3 H 1874 3.521 4.137 -0.616 1 1 1172 . 6 1 1 A 106 106 GLY CA C 1874 46.454 47.039 -0.585 1 1 1173 . 6 1 1 A 106 106 GLY N N 1874 105.282 105.884 -0.602 1 1 1174 . 6 1 1 A 107 107 LEU H H 1875 7.161 7.893 -0.732 1 1 1175 . 6 1 1 A 107 107 LEU HA H 1875 4.062 3.914 0.148 1 1 1185 . 6 1 1 A 107 107 LEU CA C 1875 55.592 55.895 -0.303 1 1 1186 . 6 1 1 A 107 107 LEU CB C 1875 41.516 40.666 0.850 1 1 1190 . 6 1 1 A 107 107 LEU N N 1875 117.141 119.269 -2.128 1 1 1191 . 6 1 1 A 108 108 THR H H 1876 8.298 7.828 0.470 1 1 1192 . 6 1 1 A 108 108 THR HA H 1876 5.038 4.598 0.440 1 1 1197 . 6 1 1 A 108 108 THR CA C 1876 64.551 63.586 0.965 1 1 1198 . 6 1 1 A 108 108 THR CB C 1876 72.706 71.076 1.630 1 1 1200 . 6 1 1 A 108 108 THR N N 1876 114.411 112.277 2.134 1 1 1201 . 6 1 1 A 109 109 HIS H H 1877 9.030 7.880 1.150 1 1 1202 . 6 1 1 A 109 109 HIS HA H 1877 5.854 5.061 0.793 1 1 1207 . 6 1 1 A 109 109 HIS CA C 1877 56.127 55.305 0.822 1 1 1208 . 6 1 1 A 109 109 HIS CB C 1877 36.258 33.031 3.227 1 1 1211 . 6 1 1 A 109 109 HIS N N 1877 125.809 117.132 8.677 1 1 1212 . 6 1 1 A 110 110 GLY H H 1878 7.497 7.644 -0.147 1 1 1213 . 6 1 1 A 110 110 GLY HA2 H 1878 4.075 4.063 0.012 1 1 1214 . 6 1 1 A 110 110 GLY HA3 H 1878 3.512 4.078 -0.566 1 1 1215 . 6 1 1 A 110 110 GLY CA C 1878 44.559 45.031 -0.472 1 1 1216 . 6 1 1 A 110 110 GLY N N 1878 111.907 110.400 1.507 1 1 1217 . 6 1 1 A 111 111 VAL H H 1879 8.776 8.216 0.560 1 1 1218 . 6 1 1 A 111 111 VAL HA H 1879 4.741 4.793 -0.052 1 1 1226 . 6 1 1 A 111 111 VAL CA C 1879 60.188 60.331 -0.143 1 1 1227 . 6 1 1 A 111 111 VAL CB C 1879 35.130 35.430 -0.300 1 1 1230 . 6 1 1 A 111 111 VAL N N 1879 119.617 119.855 -0.238 1 1 1231 . 6 1 1 A 112 112 VAL H H 1880 7.841 8.655 -0.814 1 1 1232 . 6 1 1 A 112 112 VAL HA H 1880 3.343 3.936 -0.593 1 1 1240 . 6 1 1 A 112 112 VAL CA C 1880 63.553 62.697 0.856 1 1 1241 . 6 1 1 A 112 112 VAL CB C 1880 32.257 31.633 0.624 1 1 1243 . 6 1 1 A 112 112 VAL N N 1880 122.070 126.026 -3.956 1 1 1244 . 6 1 1 A 113 113 ASN H H 1881 8.822 9.029 -0.207 1 1 1245 . 6 1 1 A 113 113 ASN HA H 1881 4.079 4.339 -0.260 1 1 1250 . 6 1 1 A 113 113 ASN CA C 1881 55.459 54.956 0.503 1 1 1251 . 6 1 1 A 113 113 ASN CB C 1881 37.330 37.194 0.136 1 1 1252 . 6 1 1 A 113 113 ASN N N 1881 115.063 117.860 -2.797 1 1 1254 . 6 1 1 A 114 114 LYS H H 1882 8.073 7.454 0.619 1 1 1255 . 6 1 1 A 114 114 LYS HA H 1882 4.818 4.679 0.139 1 1 1260 . 6 1 1 A 114 114 LYS CA C 1882 53.039 52.715 0.324 1 1 1261 . 6 1 1 A 114 114 LYS CB C 1882 34.020 33.306 0.714 1 1 1263 . 6 1 1 A 114 114 LYS N N 1882 121.439 118.810 2.629 1 1 1264 . 6 1 1 A 115 115 PRO HA H 1883 4.409 4.696 -0.287 1 1 1271 . 6 1 1 A 115 115 PRO CA C 1883 63.121 62.614 0.507 1 1 1272 . 6 1 1 A 115 115 PRO CB C 1883 31.515 31.779 -0.264 1 1 1275 . 6 1 1 A 116 116 ALA H H 1884 8.868 8.146 0.722 1 1 1276 . 6 1 1 A 116 116 ALA HA H 1884 4.804 5.010 -0.206 1 1 1280 . 6 1 1 A 116 116 ALA CA C 1884 50.620 50.288 0.332 1 1 1281 . 6 1 1 A 116 116 ALA CB C 1884 19.426 21.855 -2.429 1 1 1282 . 6 1 1 A 116 116 ALA N N 1884 132.329 125.765 6.564 1 1 1283 . 6 1 1 A 117 117 THR H H 1885 8.433 8.784 -0.351 1 1 1284 . 6 1 1 A 117 117 THR HA H 1885 5.747 5.471 0.276 1 1 1289 . 6 1 1 A 117 117 THR CA C 1885 60.364 59.749 0.615 1 1 1290 . 6 1 1 A 117 117 THR CB C 1885 72.204 71.834 0.370 1 1 1292 . 6 1 1 A 117 117 THR N N 1885 113.428 111.410 2.018 1 1 1293 . 6 1 1 A 118 118 PHE H H 1886 9.069 8.627 0.442 1 1 1294 . 6 1 1 A 118 118 PHE HA H 1886 5.123 5.214 -0.091 1 1 1301 . 6 1 1 A 118 118 PHE CA C 1886 57.059 56.023 1.036 1 1 1302 . 6 1 1 A 118 118 PHE CB C 1886 39.994 41.135 -1.141 1 1 1305 . 6 1 1 A 118 118 PHE N N 1886 119.166 117.730 1.436 1 1 1306 . 6 1 1 A 119 119 THR H H 1887 9.451 8.998 0.453 1 1 1307 . 6 1 1 A 119 119 THR HA H 1887 5.097 5.146 -0.049 1 1 1312 . 6 1 1 A 119 119 THR CA C 1887 62.050 61.294 0.756 1 1 1313 . 6 1 1 A 119 119 THR CB C 1887 71.696 72.825 -1.129 1 1 1315 . 6 1 1 A 119 119 THR N N 1887 119.436 114.383 5.053 1 1 1316 . 6 1 1 A 120 120 VAL H H 1888 8.812 9.418 -0.606 1 1 1317 . 6 1 1 A 120 120 VAL HA H 1888 4.807 4.561 0.246 1 1 1325 . 6 1 1 A 120 120 VAL CA C 1888 61.140 60.930 0.210 1 1 1326 . 6 1 1 A 120 120 VAL CB C 1888 34.059 34.228 -0.169 1 1 1329 . 6 1 1 A 120 120 VAL N N 1888 124.304 126.203 -1.899 1 1 1330 . 6 1 1 A 121 121 ASN H H 1889 9.291 9.178 0.113 1 1 1331 . 6 1 1 A 121 121 ASN HA H 1889 5.177 5.143 0.034 1 1 1336 . 6 1 1 A 121 121 ASN CA C 1889 52.470 52.994 -0.524 1 1 1337 . 6 1 1 A 121 121 ASN CB C 1889 39.766 40.154 -0.388 1 1 1338 . 6 1 1 A 121 121 ASN N N 1889 128.674 125.728 2.946 1 1 1340 . 6 1 1 A 122 122 THR H H 1890 8.553 8.478 0.075 1 1 1341 . 6 1 1 A 122 122 THR HA H 1890 4.236 4.934 -0.698 1 1 1346 . 6 1 1 A 122 122 THR CA C 1890 61.062 61.113 -0.051 1 1 1347 . 6 1 1 A 122 122 THR CB C 1890 68.437 70.571 -2.134 1 1 1349 . 6 1 1 A 122 122 THR N N 1890 116.203 113.451 2.752 1 1 1350 . 6 1 1 A 123 123 LYS H H 1891 8.210 7.644 0.566 1 1 1351 . 6 1 1 A 123 123 LYS HA H 1891 4.019 4.022 -0.003 1 1 1360 . 6 1 1 A 123 123 LYS CA C 1891 58.646 59.975 -1.329 1 1 1361 . 6 1 1 A 123 123 LYS CB C 1891 31.868 32.199 -0.331 1 1 1365 . 6 1 1 A 123 123 LYS N N 1891 124.070 122.524 1.546 1 1 1366 . 6 1 1 A 124 124 ASP H H 1892 8.596 7.891 0.705 1 1 1367 . 6 1 1 A 124 124 ASP HA H 1892 4.638 4.805 -0.167 1 1 1370 . 6 1 1 A 124 124 ASP CA C 1892 54.928 53.009 1.919 1 1 1371 . 6 1 1 A 124 124 ASP CB C 1892 40.725 40.918 -0.193 1 1 1372 . 6 1 1 A 124 124 ASP N N 1892 119.838 117.205 2.633 1 1 1373 . 6 1 1 A 125 125 ALA H H 1893 7.792 7.613 0.179 1 1 1374 . 6 1 1 A 125 125 ALA HA H 1893 4.248 4.105 0.143 1 1 1378 . 6 1 1 A 125 125 ALA CA C 1893 52.852 53.047 -0.195 1 1 1379 . 6 1 1 A 125 125 ALA CB C 1893 20.199 19.363 0.836 1 1 1380 . 6 1 1 A 125 125 ALA N N 1893 122.999 121.318 1.681 1 1 1381 . 6 1 1 A 126 126 GLY H H 1894 8.214 7.718 0.496 1 1 1382 . 6 1 1 A 126 126 GLY HA2 H 1894 4.183 3.967 0.216 1 1 1383 . 6 1 1 A 126 126 GLY HA3 H 1894 3.993 4.014 -0.021 1 1 1384 . 6 1 1 A 126 126 GLY CA C 1894 44.725 44.621 0.104 1 1 1385 . 6 1 1 A 126 126 GLY N N 1894 108.359 104.007 4.352 1 1 1386 . 6 1 1 A 127 127 GLU H H 1895 8.633 8.389 0.244 1 1 1387 . 6 1 1 A 127 127 GLU HA H 1895 4.318 4.518 -0.200 1 1 1392 . 6 1 1 A 127 127 GLU CA C 1895 57.280 55.879 1.401 1 1 1393 . 6 1 1 A 127 127 GLU CB C 1895 30.434 30.823 -0.389 1 1 1395 . 6 1 1 A 127 127 GLU N N 1895 122.934 118.941 3.993 1 1 1396 . 6 1 1 A 128 128 GLY H H 1896 8.351 8.676 -0.325 1 1 1397 . 6 1 1 A 128 128 GLY HA2 H 1896 3.853 3.999 -0.146 1 1 1398 . 6 1 1 A 128 128 GLY HA3 H 1896 3.853 4.012 -0.159 1 1 1399 . 6 1 1 A 128 128 GLY CA C 1896 45.766 45.197 0.569 1 1 1400 . 6 1 1 A 128 128 GLY N N 1896 111.048 110.705 0.343 1 1 1401 . 6 1 1 A 129 129 GLY H H 1897 7.580 8.621 -1.041 1 1 1402 . 6 1 1 A 129 129 GLY HA2 H 1897 4.170 4.102 0.068 1 1 1403 . 6 1 1 A 129 129 GLY HA3 H 1897 3.463 4.123 -0.660 1 1 1404 . 6 1 1 A 129 129 GLY CA C 1897 44.670 45.278 -0.608 1 1 1405 . 6 1 1 A 129 129 GLY N N 1897 106.306 109.257 -2.951 1 1 1406 . 6 1 1 A 130 130 LEU H H 1898 8.416 8.294 0.122 1 1 1407 . 6 1 1 A 130 130 LEU HA H 1898 5.077 4.295 0.782 1 1 1417 . 6 1 1 A 130 130 LEU CA C 1898 54.526 54.472 0.054 1 1 1418 . 6 1 1 A 130 130 LEU CB C 1898 44.499 42.278 2.221 1 1 1422 . 6 1 1 A 130 130 LEU N N 1898 126.737 125.021 1.716 1 1 1423 . 6 1 1 A 131 131 SER H H 1899 9.254 9.061 0.193 1 1 1424 . 6 1 1 A 131 131 SER HA H 1899 4.803 5.231 -0.428 1 1 1427 . 6 1 1 A 131 131 SER CA C 1899 57.293 56.680 0.613 1 1 1428 . 6 1 1 A 131 131 SER CB C 1899 65.376 66.453 -1.077 1 1 1429 . 6 1 1 A 131 131 SER N N 1899 123.028 121.499 1.529 1 1 1430 . 6 1 1 A 132 132 LEU H H 1900 8.410 8.654 -0.244 1 1 1431 . 6 1 1 A 132 132 LEU HA H 1900 5.452 4.965 0.487 1 1 1441 . 6 1 1 A 132 132 LEU CA C 1900 53.045 54.332 -1.287 1 1 1442 . 6 1 1 A 132 132 LEU CB C 1900 46.982 45.952 1.030 1 1 1446 . 6 1 1 A 132 132 LEU N N 1900 126.218 124.646 1.572 1 1 1447 . 6 1 1 A 133 133 ALA H H 1901 8.708 8.462 0.246 1 1 1448 . 6 1 1 A 133 133 ALA HA H 1901 4.591 4.955 -0.364 1 1 1452 . 6 1 1 A 133 133 ALA CA C 1901 52.140 51.365 0.775 1 1 1453 . 6 1 1 A 133 133 ALA CB C 1901 22.653 23.690 -1.037 1 1 1454 . 6 1 1 A 133 133 ALA N N 1901 124.744 125.793 -1.049 1 1 1455 . 6 1 1 A 134 134 ILE H H 1902 8.641 8.561 0.080 1 1 1456 . 6 1 1 A 134 134 ILE HA H 1902 5.256 5.264 -0.008 1 1 1466 . 6 1 1 A 134 134 ILE CA C 1902 59.873 60.022 -0.149 1 1 1467 . 6 1 1 A 134 134 ILE CB C 1902 41.214 42.075 -0.861 1 1 1471 . 6 1 1 A 134 134 ILE N N 1902 121.132 120.318 0.814 1 1 1472 . 6 1 1 A 135 135 GLU H H 1903 9.294 8.739 0.555 1 1 1473 . 6 1 1 A 135 135 GLU HA H 1903 4.869 5.264 -0.395 1 1 1478 . 6 1 1 A 135 135 GLU CA C 1903 54.307 54.823 -0.516 1 1 1479 . 6 1 1 A 135 135 GLU CB C 1903 32.474 33.554 -1.080 1 1 1481 . 6 1 1 A 135 135 GLU N N 1903 129.644 123.903 5.741 1 1 1482 . 6 1 1 A 136 136 GLY H H 1904 8.347 8.110 0.237 1 1 1483 . 6 1 1 A 136 136 GLY HA2 H 1904 4.005 3.442 0.563 1 1 1484 . 6 1 1 A 136 136 GLY HA3 H 1904 3.629 3.926 -0.297 1 1 1485 . 6 1 1 A 136 136 GLY CA C 1904 45.530 44.987 0.543 1 1 1486 . 6 1 1 A 136 136 GLY N N 1904 112.326 108.962 3.364 1 1 1487 . 6 1 1 A 137 137 PRO HA H 1905 4.268 4.304 -0.036 1 1 1494 . 6 1 1 A 137 137 PRO CA C 1905 64.189 64.133 0.056 1 1 1495 . 6 1 1 A 137 137 PRO CB C 1905 32.482 32.099 0.383 1 1 1498 . 6 1 1 A 138 138 SER H H 1906 7.060 7.362 -0.302 1 1 1499 . 6 1 1 A 138 138 SER HA H 1906 4.603 4.804 -0.201 1 1 1502 . 6 1 1 A 138 138 SER CA C 1906 56.433 56.625 -0.192 1 1 1503 . 6 1 1 A 138 138 SER CB C 1906 66.672 65.974 0.698 1 1 1504 . 6 1 1 A 138 138 SER N N 1906 109.100 111.587 -2.487 1 1 1505 . 6 1 1 A 139 139 LYS H H 1907 8.479 8.264 0.215 1 1 1506 . 6 1 1 A 139 139 LYS HA H 1907 4.413 4.373 0.040 1 1 1515 . 6 1 1 A 139 139 LYS CA C 1907 56.638 56.738 -0.100 1 1 1516 . 6 1 1 A 139 139 LYS CB C 1907 31.873 33.001 -1.128 1 1 1520 . 6 1 1 A 139 139 LYS N N 1907 124.545 125.549 -1.004 1 1 1521 . 6 1 1 A 140 140 ALA H H 1908 8.358 8.470 -0.112 1 1 1522 . 6 1 1 A 140 140 ALA HA H 1908 4.706 4.572 0.134 1 1 1526 . 6 1 1 A 140 140 ALA CA C 1908 51.081 52.382 -1.301 1 1 1527 . 6 1 1 A 140 140 ALA CB C 1908 20.724 19.410 1.314 1 1 1528 . 6 1 1 A 140 140 ALA N N 1908 131.020 129.645 1.375 1 1 1529 . 6 1 1 A 141 141 GLU H H 1909 8.625 8.375 0.250 1 1 1530 . 6 1 1 A 141 141 GLU HA H 1909 4.248 4.831 -0.583 1 1 1535 . 6 1 1 A 141 141 GLU CA C 1909 56.991 56.267 0.724 1 1 1536 . 6 1 1 A 141 141 GLU CB C 1909 30.453 31.400 -0.947 1 1 1538 . 6 1 1 A 141 141 GLU N N 1909 124.862 121.108 3.754 1 1 1539 . 6 1 1 A 142 142 ILE H H 1910 8.588 8.702 -0.114 1 1 1540 . 6 1 1 A 142 142 ILE HA H 1910 4.871 5.133 -0.262 1 1 1550 . 6 1 1 A 142 142 ILE CA C 1910 60.733 59.820 0.913 1 1 1551 . 6 1 1 A 142 142 ILE CB C 1910 41.494 41.383 0.111 1 1 1555 . 6 1 1 A 142 142 ILE N N 1910 126.220 123.923 2.297 1 1 1556 . 6 1 1 A 143 143 SER H H 1911 9.269 9.097 0.172 1 1 1557 . 6 1 1 A 143 143 SER HA H 1911 4.804 5.104 -0.300 1 1 1560 . 6 1 1 A 143 143 SER CA C 1911 56.988 57.036 -0.048 1 1 1561 . 6 1 1 A 143 143 SER CB C 1911 65.172 65.395 -0.223 1 1 1562 . 6 1 1 A 143 143 SER N N 1911 124.083 120.078 4.005 1 1 1563 . 6 1 1 A 144 144 CYS H H 1912 8.773 8.738 0.035 1 1 1564 . 6 1 1 A 144 144 CYS HA H 1912 5.200 5.204 -0.004 1 1 1567 . 6 1 1 A 144 144 CYS CA C 1912 57.256 56.630 0.626 1 1 1568 . 6 1 1 A 144 144 CYS CB C 1912 29.137 31.596 -2.459 1 1 1569 . 6 1 1 A 144 144 CYS N N 1912 125.729 120.609 5.120 1 1 1570 . 6 1 1 A 145 145 THR H H 1913 8.976 8.886 0.090 1 1 1571 . 6 1 1 A 145 145 THR HA H 1913 4.510 4.885 -0.375 1 1 1576 . 6 1 1 A 145 145 THR CA C 1913 61.388 61.531 -0.143 1 1 1577 . 6 1 1 A 145 145 THR CB C 1913 71.558 71.971 -0.413 1 1 1579 . 6 1 1 A 145 145 THR N N 1913 124.914 117.545 7.369 1 1 1580 . 6 1 1 A 146 146 ASP H H 1914 8.843 9.028 -0.185 1 1 1581 . 6 1 1 A 146 146 ASP HA H 1914 4.842 4.838 0.004 1 1 1584 . 6 1 1 A 146 146 ASP CA C 1914 54.307 54.268 0.039 1 1 1585 . 6 1 1 A 146 146 ASP CB C 1914 41.262 42.148 -0.886 1 1 1586 . 6 1 1 A 146 146 ASP N N 1914 128.084 128.717 -0.633 1 1 1587 . 6 1 1 A 147 147 ASN H H 1915 8.700 8.982 -0.282 1 1 1588 . 6 1 1 A 147 147 ASN HA H 1915 4.798 5.042 -0.244 1 1 1593 . 6 1 1 A 147 147 ASN CA C 1915 54.283 51.954 2.329 1 1 1594 . 6 1 1 A 147 147 ASN CB C 1915 38.986 40.915 -1.929 1 1 1595 . 6 1 1 A 147 147 ASN N N 1915 125.720 122.926 2.794 1 1 1597 . 6 1 1 A 148 148 GLN HA H 1916 4.057 4.062 -0.005 1 1 1602 . 6 1 1 A 148 148 GLN CA C 1916 57.839 58.111 -0.272 1 1 1603 . 6 1 1 A 148 148 GLN CB C 1916 26.281 28.201 -1.920 1 1 1605 . 6 1 1 A 149 149 ASP H H 1917 7.892 8.004 -0.112 1 1 1606 . 6 1 1 A 149 149 ASP HA H 1917 4.755 4.657 0.098 1 1 1609 . 6 1 1 A 149 149 ASP CA C 1917 52.659 54.375 -1.716 1 1 1610 . 6 1 1 A 149 149 ASP CB C 1917 41.111 40.842 0.269 1 1 1611 . 6 1 1 A 149 149 ASP N N 1917 118.769 118.506 0.263 1 1 1612 . 6 1 1 A 150 150 GLY H H 1918 8.673 8.804 -0.131 1 1 1613 . 6 1 1 A 150 150 GLY HA2 H 1918 4.358 3.919 0.439 1 1 1614 . 6 1 1 A 150 150 GLY HA3 H 1918 3.700 3.920 -0.220 1 1 1615 . 6 1 1 A 150 150 GLY CA C 1918 45.319 46.218 -0.899 1 1 1616 . 6 1 1 A 150 150 GLY N N 1918 110.464 108.279 2.185 1 1 1617 . 6 1 1 A 151 151 THR H H 1919 8.154 7.569 0.585 1 1 1618 . 6 1 1 A 151 151 THR HA H 1919 4.109 5.079 -0.970 1 1 1623 . 6 1 1 A 151 151 THR CA C 1919 60.041 59.431 0.610 1 1 1624 . 6 1 1 A 151 151 THR CB C 1919 73.422 72.771 0.651 1 1 1626 . 6 1 1 A 151 151 THR N N 1919 111.043 109.731 1.312 1 1 1627 . 6 1 1 A 152 152 CYS H H 1920 9.088 9.133 -0.045 1 1 1628 . 6 1 1 A 152 152 CYS HA H 1920 5.362 5.268 0.094 1 1 1631 . 6 1 1 A 152 152 CYS CA C 1920 56.990 56.902 0.088 1 1 1632 . 6 1 1 A 152 152 CYS CB C 1920 30.740 30.484 0.256 1 1 1633 . 6 1 1 A 152 152 CYS N N 1920 118.508 121.690 -3.182 1 1 1634 . 6 1 1 A 153 153 SER H H 1921 9.102 8.991 0.111 1 1 1635 . 6 1 1 A 153 153 SER HA H 1921 4.865 4.917 -0.052 1 1 1638 . 6 1 1 A 153 153 SER CA C 1921 58.023 57.525 0.498 1 1 1639 . 6 1 1 A 153 153 SER CB C 1921 64.133 64.383 -0.250 1 1 1640 . 6 1 1 A 153 153 SER N N 1921 122.048 123.341 -1.293 1 1 1641 . 6 1 1 A 154 154 VAL H H 1922 8.983 8.775 0.208 1 1 1642 . 6 1 1 A 154 154 VAL HA H 1922 4.608 4.772 -0.164 1 1 1650 . 6 1 1 A 154 154 VAL CA C 1922 60.575 59.769 0.806 1 1 1651 . 6 1 1 A 154 154 VAL CB C 1922 32.710 34.832 -2.122 1 1 1654 . 6 1 1 A 154 154 VAL N N 1922 130.262 125.418 4.844 1 1 1655 . 6 1 1 A 155 155 SER H H 1923 8.737 8.963 -0.226 1 1 1656 . 6 1 1 A 155 155 SER HA H 1923 5.680 5.557 0.123 1 1 1659 . 6 1 1 A 155 155 SER CA C 1923 55.991 56.302 -0.311 1 1 1660 . 6 1 1 A 155 155 SER CB C 1923 66.306 66.419 -0.113 1 1 1661 . 6 1 1 A 155 155 SER N N 1923 121.504 118.949 2.555 1 1 1662 . 6 1 1 A 156 156 TYR H H 1924 9.061 8.941 0.120 1 1 1663 . 6 1 1 A 156 156 TYR HA H 1924 5.790 5.629 0.161 1 1 1671 . 6 1 1 A 156 156 TYR CA C 1924 55.118 55.907 -0.789 1 1 1672 . 6 1 1 A 156 156 TYR CB C 1924 42.344 41.538 0.806 1 1 1675 . 6 1 1 A 156 156 TYR N N 1924 121.858 117.734 4.124 1 1 1676 . 6 1 1 A 157 157 LEU H H 1925 7.505 9.434 -1.929 1 1 1677 . 6 1 1 A 157 157 LEU HA H 1925 4.996 4.746 0.250 1 1 1687 . 6 1 1 A 157 157 LEU CA C 1925 50.476 51.197 -0.721 1 1 1688 . 6 1 1 A 157 157 LEU CB C 1925 43.334 43.757 -0.423 1 1 1692 . 6 1 1 A 157 157 LEU N N 1925 123.272 121.347 1.925 1 1 1693 . 6 1 1 A 158 158 PRO HA H 1926 4.691 4.934 -0.243 1 1 1700 . 6 1 1 A 158 158 PRO CA C 1926 61.808 62.248 -0.440 1 1 1701 . 6 1 1 A 158 158 PRO CB C 1926 32.551 33.295 -0.744 1 1 1704 . 6 1 1 A 159 159 VAL H H 1927 8.388 8.254 0.134 1 1 1705 . 6 1 1 A 159 159 VAL HA H 1927 4.510 4.486 0.024 1 1 1713 . 6 1 1 A 159 159 VAL CA C 1927 61.778 61.513 0.265 1 1 1714 . 6 1 1 A 159 159 VAL CB C 1927 32.432 34.122 -1.690 1 1 1717 . 6 1 1 A 159 159 VAL N N 1927 115.680 117.044 -1.364 1 1 1718 . 6 1 1 A 160 160 LEU H H 1928 6.931 7.756 -0.825 1 1 1719 . 6 1 1 A 160 160 LEU HA H 1928 4.931 4.831 0.100 1 1 1729 . 6 1 1 A 160 160 LEU CA C 1928 51.971 51.519 0.452 1 1 1730 . 6 1 1 A 160 160 LEU CB C 1928 45.905 44.619 1.286 1 1 1734 . 6 1 1 A 160 160 LEU N N 1928 120.258 123.389 -3.131 1 1 1735 . 6 1 1 A 161 161 PRO HA H 1929 4.317 4.806 -0.489 1 1 1742 . 6 1 1 A 161 161 PRO CA C 1929 62.809 62.943 -0.134 1 1 1743 . 6 1 1 A 161 161 PRO CB C 1929 32.662 33.050 -0.388 1 1 1746 . 6 1 1 A 162 162 GLY H H 1930 8.916 8.296 0.620 1 1 1747 . 6 1 1 A 162 162 GLY HA2 H 1930 4.461 4.163 0.298 1 1 1748 . 6 1 1 A 162 162 GLY HA3 H 1930 3.852 4.183 -0.331 1 1 1749 . 6 1 1 A 162 162 GLY CA C 1930 44.496 44.171 0.325 1 1 1750 . 6 1 1 A 162 162 GLY N N 1930 107.609 107.436 0.173 1 1 1751 . 6 1 1 A 163 163 ASP H H 1931 8.245 8.401 -0.156 1 1 1752 . 6 1 1 A 163 163 ASP HA H 1931 5.565 5.471 0.094 1 1 1755 . 6 1 1 A 163 163 ASP CA C 1931 53.628 53.273 0.355 1 1 1756 . 6 1 1 A 163 163 ASP CB C 1931 41.058 41.984 -0.926 1 1 1757 . 6 1 1 A 163 163 ASP N N 1931 121.979 119.346 2.633 1 1 1758 . 6 1 1 A 164 164 TYR H H 1932 9.606 9.475 0.131 1 1 1759 . 6 1 1 A 164 164 TYR HA H 1932 4.896 5.228 -0.332 1 1 1767 . 6 1 1 A 164 164 TYR CA C 1932 56.955 56.291 0.664 1 1 1768 . 6 1 1 A 164 164 TYR CB C 1932 40.339 41.470 -1.131 1 1 1771 . 6 1 1 A 164 164 TYR N N 1932 125.257 122.310 2.947 1 1 1772 . 6 1 1 A 165 165 SER H H 1933 9.095 9.292 -0.197 1 1 1773 . 6 1 1 A 165 165 SER HA H 1933 5.500 5.092 0.408 1 1 1776 . 6 1 1 A 165 165 SER CA C 1933 56.509 58.321 -1.812 1 1 1777 . 6 1 1 A 165 165 SER CB C 1933 64.486 63.896 0.590 1 1 1778 . 6 1 1 A 165 165 SER N N 1933 119.162 120.353 -1.191 1 1 1779 . 6 1 1 A 166 166 ILE H H 1934 9.598 9.577 0.021 1 1 1780 . 6 1 1 A 166 166 ILE HA H 1934 4.541 4.777 -0.236 1 1 1790 . 6 1 1 A 166 166 ILE CA C 1934 61.080 60.193 0.887 1 1 1791 . 6 1 1 A 166 166 ILE CB C 1934 39.282 38.547 0.735 1 1 1795 . 6 1 1 A 166 166 ILE N N 1934 128.701 128.405 0.296 1 1 1796 . 6 1 1 A 167 167 LEU H H 1935 9.359 9.267 0.092 1 1 1797 . 6 1 1 A 167 167 LEU HA H 1935 4.779 5.003 -0.224 1 1 1807 . 6 1 1 A 167 167 LEU CA C 1935 55.921 53.241 2.680 1 1 1808 . 6 1 1 A 167 167 LEU CB C 1935 42.473 44.882 -2.409 1 1 1811 . 6 1 1 A 167 167 LEU N N 1935 131.315 130.259 1.056 1 1 1812 . 6 1 1 A 168 168 VAL H H 1936 9.425 8.727 0.698 1 1 1813 . 6 1 1 A 168 168 VAL HA H 1936 4.617 4.902 -0.285 1 1 1821 . 6 1 1 A 168 168 VAL CA C 1936 61.418 60.813 0.605 1 1 1822 . 6 1 1 A 168 168 VAL CB C 1936 33.616 35.053 -1.437 1 1 1824 . 6 1 1 A 168 168 VAL N N 1936 126.961 126.120 0.841 1 1 1825 . 6 1 1 A 169 169 LYS H H 1937 8.643 8.291 0.352 1 1 1826 . 6 1 1 A 169 169 LYS HA H 1937 5.067 4.813 0.254 1 1 1835 . 6 1 1 A 169 169 LYS CA C 1937 53.949 55.605 -1.656 1 1 1836 . 6 1 1 A 169 169 LYS CB C 1937 36.691 36.324 0.367 1 1 1840 . 6 1 1 A 169 169 LYS N N 1937 124.773 127.177 -2.404 1 1 1841 . 6 1 1 A 170 170 TYR H H 1938 8.877 9.291 -0.414 1 1 1842 . 6 1 1 A 170 170 TYR HA H 1938 5.137 5.016 0.121 1 1 1849 . 6 1 1 A 170 170 TYR CA C 1938 57.034 57.645 -0.611 1 1 1850 . 6 1 1 A 170 170 TYR CB C 1938 42.105 41.926 0.179 1 1 1853 . 6 1 1 A 170 170 TYR N N 1938 122.371 126.870 -4.499 1 1 1854 . 6 1 1 A 171 171 ASN H H 1939 8.933 9.871 -0.938 1 1 1855 . 6 1 1 A 171 171 ASN HA H 1939 4.405 4.513 -0.108 1 1 1860 . 6 1 1 A 171 171 ASN CA C 1939 54.512 54.270 0.242 1 1 1861 . 6 1 1 A 171 171 ASN CB C 1939 37.025 37.289 -0.264 1 1 1862 . 6 1 1 A 171 171 ASN N N 1939 129.922 126.536 3.386 1 1 1864 . 6 1 1 A 172 172 GLU H H 1940 8.857 8.794 0.063 1 1 1865 . 6 1 1 A 172 172 GLU HA H 1940 3.511 4.081 -0.570 1 1 1870 . 6 1 1 A 172 172 GLU CA C 1940 57.910 57.705 0.205 1 1 1871 . 6 1 1 A 172 172 GLU CB C 1940 27.139 27.517 -0.378 1 1 1873 . 6 1 1 A 172 172 GLU N N 1940 107.943 116.227 -8.284 1 1 1874 . 6 1 1 A 173 173 GLN H H 1941 7.544 7.578 -0.034 1 1 1875 . 6 1 1 A 173 173 GLN HA H 1941 4.749 4.769 -0.020 1 1 1882 . 6 1 1 A 173 173 GLN CA C 1941 53.770 54.872 -1.102 1 1 1883 . 6 1 1 A 173 173 GLN CB C 1941 31.078 30.801 0.277 1 1 1885 . 6 1 1 A 173 173 GLN N N 1941 119.865 120.421 -0.556 1 1 1887 . 6 1 1 A 174 174 HIS H H 1942 8.848 8.714 0.134 1 1 1888 . 6 1 1 A 174 174 HIS HA H 1942 4.513 4.748 -0.235 1 1 1893 . 6 1 1 A 174 174 HIS CA C 1942 58.893 56.806 2.087 1 1 1894 . 6 1 1 A 174 174 HIS CB C 1942 32.196 30.245 1.951 1 1 1897 . 6 1 1 A 174 174 HIS N N 1942 126.437 121.726 4.711 1 1 1898 . 6 1 1 A 175 175 VAL H H 1943 8.483 8.080 0.403 1 1 1899 . 6 1 1 A 175 175 VAL HA H 1943 4.643 4.406 0.237 1 1 1907 . 6 1 1 A 175 175 VAL CA C 1943 60.025 60.194 -0.169 1 1 1908 . 6 1 1 A 175 175 VAL CB C 1943 29.439 32.510 -3.071 1 1 1911 . 6 1 1 A 175 175 VAL N N 1943 121.671 118.468 3.203 1 1 1912 . 6 1 1 A 176 176 PRO HA H 1944 4.045 4.127 -0.082 1 1 1919 . 6 1 1 A 176 176 PRO CA C 1944 64.943 63.967 0.976 1 1 1920 . 6 1 1 A 176 176 PRO CB C 1944 31.120 31.259 -0.139 1 1 1923 . 6 1 1 A 177 177 GLY H H 1945 7.579 8.708 -1.129 1 1 1924 . 6 1 1 A 177 177 GLY HA2 H 1945 3.210 3.819 -0.609 1 1 1925 . 6 1 1 A 177 177 GLY HA3 H 1945 2.311 3.918 -1.607 1 1 1926 . 6 1 1 A 177 177 GLY CA C 1945 44.184 44.940 -0.756 1 1 1927 . 6 1 1 A 177 177 GLY N N 1945 113.696 113.054 0.642 1 1 1928 . 6 1 1 A 178 178 SER H H 1946 7.469 7.564 -0.095 1 1 1929 . 6 1 1 A 178 178 SER HA H 1946 4.023 3.303 0.720 1 1 1932 . 6 1 1 A 178 178 SER CA C 1946 54.593 56.321 -1.728 1 1 1933 . 6 1 1 A 178 178 SER CB C 1946 62.282 63.809 -1.527 1 1 1934 . 6 1 1 A 178 178 SER N N 1946 113.219 115.506 -2.287 1 1 1935 . 6 1 1 A 179 179 PRO HA H 1947 5.314 4.457 0.857 1 1 1942 . 6 1 1 A 179 179 PRO CA C 1947 62.198 62.206 -0.008 1 1 1943 . 6 1 1 A 179 179 PRO CB C 1947 33.923 32.255 1.668 1 1 1946 . 6 1 1 A 180 180 PHE H H 1948 9.395 8.533 0.862 1 1 1947 . 6 1 1 A 180 180 PHE HA H 1948 4.706 5.021 -0.315 1 1 1955 . 6 1 1 A 180 180 PHE CA C 1948 57.298 57.460 -0.162 1 1 1956 . 6 1 1 A 180 180 PHE CB C 1948 41.116 41.641 -0.525 1 1 1960 . 6 1 1 A 180 180 PHE N N 1948 127.510 119.303 8.207 1 1 1961 . 6 1 1 A 181 181 THR H H 1949 9.111 9.156 -0.045 1 1 1962 . 6 1 1 A 181 181 THR HA H 1949 5.091 5.214 -0.123 1 1 1967 . 6 1 1 A 181 181 THR CA C 1949 62.668 61.551 1.117 1 1 1968 . 6 1 1 A 181 181 THR CB C 1949 70.354 70.093 0.261 1 1 1970 . 6 1 1 A 181 181 THR N N 1949 120.325 115.747 4.578 1 1 1971 . 6 1 1 A 182 182 ALA H H 1950 8.992 9.431 -0.439 1 1 1972 . 6 1 1 A 182 182 ALA HA H 1950 4.521 5.218 -0.697 1 1 1976 . 6 1 1 A 182 182 ALA CA C 1950 50.080 50.369 -0.289 1 1 1977 . 6 1 1 A 182 182 ALA CB C 1950 21.717 20.720 0.997 1 1 1978 . 6 1 1 A 182 182 ALA N N 1950 130.794 130.041 0.753 1 1 1979 . 6 1 1 A 183 183 ARG H H 1951 7.764 8.749 -0.985 1 1 1980 . 6 1 1 A 183 183 ARG HA H 1951 5.001 4.806 0.195 1 1 1988 . 6 1 1 A 183 183 ARG CA C 1951 55.116 55.113 0.003 1 1 1989 . 6 1 1 A 183 183 ARG CB C 1951 30.631 31.471 -0.840 1 1 1992 . 6 1 1 A 183 183 ARG N N 1951 121.920 123.822 -1.902 1 1 1994 . 6 1 1 A 184 184 VAL H H 1952 9.121 9.029 0.092 1 1 1995 . 6 1 1 A 184 184 VAL HA H 1952 4.865 4.806 0.059 1 1 2003 . 6 1 1 A 184 184 VAL CA C 1952 60.375 61.549 -1.174 1 1 2004 . 6 1 1 A 184 184 VAL CB C 1952 32.179 32.525 -0.346 1 1 2007 . 6 1 1 A 184 184 VAL N N 1952 125.421 127.227 -1.806 1 1 2008 . 6 1 1 A 185 185 THR H H 1953 8.799 8.435 0.364 1 1 2009 . 6 1 1 A 185 185 THR HA H 1953 4.829 4.796 0.033 1 1 2014 . 6 1 1 A 185 185 THR CA C 1953 60.316 59.613 0.703 1 1 2015 . 6 1 1 A 185 185 THR CB C 1953 70.825 71.227 -0.402 1 1 2017 . 6 1 1 A 185 185 THR N N 1953 121.794 119.619 2.175 1 1 2018 . 6 1 1 A 186 186 GLY H H 1954 8.586 8.746 -0.160 1 1 2019 . 6 1 1 A 186 186 GLY HA2 H 1954 4.261 4.117 0.144 1 1 2020 . 6 1 1 A 186 186 GLY HA3 H 1954 4.033 4.125 -0.092 1 1 2021 . 6 1 1 A 186 186 GLY CA C 1954 45.038 45.183 -0.145 1 1 2022 . 6 1 1 A 186 186 GLY N N 1954 107.588 112.523 -4.935 1 1 2023 . 6 1 1 A 187 187 ASP H H 1955 8.386 9.149 -0.763 1 1 2024 . 6 1 1 A 187 187 ASP HA H 1955 4.772 4.561 0.211 1 1 2027 . 6 1 1 A 187 187 ASP CA C 1955 53.909 56.382 -2.473 1 1 2028 . 6 1 1 A 187 187 ASP CB C 1955 41.510 41.236 0.274 1 1 2029 . 6 1 1 A 187 187 ASP N N 1955 121.829 121.486 0.343 1 1 4 . 7 1 1 A 2 2 ALA HA H -2 4.368 4.382 -0.014 1 1 8 . 7 1 1 A 2 2 ALA CA C -2 52.604 51.610 0.994 1 1 9 . 7 1 1 A 2 2 ALA CB C -2 19.551 19.589 -0.038 1 1 32 . 7 1 1 A 5 5 PRO HA H 1773 4.433 4.673 -0.240 1 1 39 . 7 1 1 A 5 5 PRO CA C 1773 63.017 62.738 0.279 1 1 40 . 7 1 1 A 5 5 PRO CB C 1773 32.155 32.879 -0.724 1 1 43 . 7 1 1 A 6 6 GLU H H 1774 8.495 8.868 -0.373 1 1 44 . 7 1 1 A 6 6 GLU HA H 1774 4.242 4.070 0.172 1 1 49 . 7 1 1 A 6 6 GLU CA C 1774 56.735 58.939 -2.204 1 1 50 . 7 1 1 A 6 6 GLU CB C 1774 30.401 29.425 0.976 1 1 52 . 7 1 1 A 6 6 GLU N N 1774 122.494 120.093 2.401 1 1 53 . 7 1 1 A 7 7 ARG H H 1775 8.275 7.790 0.485 1 1 54 . 7 1 1 A 7 7 ARG HA H 1775 4.648 4.763 -0.115 1 1 61 . 7 1 1 A 7 7 ARG CA C 1775 53.827 53.600 0.227 1 1 62 . 7 1 1 A 7 7 ARG CB C 1775 30.417 30.913 -0.496 1 1 65 . 7 1 1 A 7 7 ARG N N 1775 124.017 119.501 4.516 1 1 66 . 7 1 1 A 8 8 PRO HA H 1776 4.433 4.764 -0.331 1 1 73 . 7 1 1 A 8 8 PRO CA C 1776 63.036 62.323 0.713 1 1 74 . 7 1 1 A 8 8 PRO CB C 1776 32.201 33.039 -0.838 1 1 77 . 7 1 1 A 9 9 LEU H H 1777 8.349 8.590 -0.241 1 1 78 . 7 1 1 A 9 9 LEU HA H 1777 4.365 4.425 -0.060 1 1 88 . 7 1 1 A 9 9 LEU CA C 1777 55.275 54.655 0.620 1 1 89 . 7 1 1 A 9 9 LEU CB C 1777 42.376 41.206 1.170 1 1 93 . 7 1 1 A 9 9 LEU N N 1777 123.820 120.515 3.305 1 1 94 . 7 1 1 A 10 10 VAL H H 1778 7.989 7.445 0.544 1 1 95 . 7 1 1 A 10 10 VAL HA H 1778 4.182 3.799 0.383 1 1 103 . 7 1 1 A 10 10 VAL CA C 1778 62.141 65.036 -2.895 1 1 104 . 7 1 1 A 10 10 VAL CB C 1778 33.175 31.433 1.742 1 1 106 . 7 1 1 A 10 10 VAL N N 1778 121.714 120.969 0.745 1 1 107 . 7 1 1 A 11 11 GLY H H 1779 8.450 8.535 -0.085 1 1 108 . 7 1 1 A 11 11 GLY HA2 H 1779 4.002 4.064 -0.062 1 1 109 . 7 1 1 A 11 11 GLY HA3 H 1779 4.002 4.064 -0.062 1 1 110 . 7 1 1 A 11 11 GLY CA C 1779 45.297 44.106 1.191 1 1 111 . 7 1 1 A 11 11 GLY N N 1779 113.826 112.630 1.196 1 1 112 . 7 1 1 A 12 12 VAL H H 1780 8.013 8.780 -0.767 1 1 113 . 7 1 1 A 12 12 VAL HA H 1780 4.136 3.951 0.185 1 1 121 . 7 1 1 A 12 12 VAL CA C 1780 62.466 63.852 -1.386 1 1 122 . 7 1 1 A 12 12 VAL CB C 1780 32.752 32.120 0.632 1 1 125 . 7 1 1 A 12 12 VAL N N 1780 120.109 124.073 -3.964 1 1 126 . 7 1 1 A 13 13 ASN H H 1781 8.528 7.970 0.558 1 1 127 . 7 1 1 A 13 13 ASN HA H 1781 4.712 4.516 0.196 1 1 132 . 7 1 1 A 13 13 ASN CA C 1781 53.485 55.352 -1.867 1 1 133 . 7 1 1 A 13 13 ASN CB C 1781 38.996 39.098 -0.102 1 1 134 . 7 1 1 A 13 13 ASN N N 1781 122.648 119.028 3.620 1 1 136 . 7 1 1 A 14 14 GLY H H 1782 8.283 7.646 0.637 1 1 137 . 7 1 1 A 14 14 GLY HA2 H 1782 3.929 4.041 -0.112 1 1 138 . 7 1 1 A 14 14 GLY HA3 H 1782 3.929 4.041 -0.112 1 1 139 . 7 1 1 A 14 14 GLY CA C 1782 45.531 44.725 0.806 1 1 140 . 7 1 1 A 14 14 GLY N N 1782 110.229 106.520 3.709 1 1 141 . 7 1 1 A 15 15 LEU H H 1783 7.925 8.474 -0.549 1 1 142 . 7 1 1 A 15 15 LEU HA H 1783 4.340 4.490 -0.150 1 1 152 . 7 1 1 A 15 15 LEU CA C 1783 55.045 54.956 0.089 1 1 153 . 7 1 1 A 15 15 LEU CB C 1783 42.682 42.331 0.351 1 1 157 . 7 1 1 A 15 15 LEU N N 1783 122.626 122.231 0.395 1 1 158 . 7 1 1 A 16 16 ASP H H 1784 8.360 8.828 -0.468 1 1 159 . 7 1 1 A 16 16 ASP HA H 1784 4.747 5.092 -0.345 1 1 162 . 7 1 1 A 16 16 ASP CA C 1784 53.939 53.578 0.361 1 1 163 . 7 1 1 A 16 16 ASP CB C 1784 41.150 44.585 -3.435 1 1 164 . 7 1 1 A 16 16 ASP N N 1784 122.868 122.259 0.609 1 1 165 . 7 1 1 A 17 17 VAL H H 1785 8.201 8.784 -0.583 1 1 166 . 7 1 1 A 17 17 VAL HA H 1785 4.237 4.467 -0.230 1 1 174 . 7 1 1 A 17 17 VAL CA C 1785 62.881 61.922 0.959 1 1 175 . 7 1 1 A 17 17 VAL CB C 1785 31.967 32.837 -0.870 1 1 178 . 7 1 1 A 17 17 VAL N N 1785 121.110 121.853 -0.743 1 1 179 . 7 1 1 A 18 18 THR H H 1786 8.291 8.652 -0.361 1 1 180 . 7 1 1 A 18 18 THR HA H 1786 4.466 4.645 -0.179 1 1 185 . 7 1 1 A 18 18 THR CA C 1786 62.388 61.222 1.166 1 1 186 . 7 1 1 A 18 18 THR CB C 1786 69.719 70.984 -1.265 1 1 188 . 7 1 1 A 18 18 THR N N 1786 115.267 122.644 -7.377 1 1 189 . 7 1 1 A 19 19 SER H H 1787 8.148 7.626 0.522 1 1 190 . 7 1 1 A 19 19 SER HA H 1787 4.542 4.652 -0.110 1 1 193 . 7 1 1 A 19 19 SER CA C 1787 59.096 58.916 0.180 1 1 194 . 7 1 1 A 19 19 SER CB C 1787 63.993 63.589 0.404 1 1 195 . 7 1 1 A 19 19 SER N N 1787 118.576 118.171 0.405 1 1 196 . 7 1 1 A 20 20 LEU H H 1788 8.263 8.461 -0.198 1 1 197 . 7 1 1 A 20 20 LEU HA H 1788 4.243 4.859 -0.616 1 1 207 . 7 1 1 A 20 20 LEU CA C 1788 54.087 53.923 0.164 1 1 208 . 7 1 1 A 20 20 LEU CB C 1788 43.006 45.949 -2.943 1 1 212 . 7 1 1 A 20 20 LEU N N 1788 125.834 126.877 -1.043 1 1 213 . 7 1 1 A 21 21 ARG H H 1789 8.191 8.392 -0.201 1 1 214 . 7 1 1 A 21 21 ARG HA H 1789 4.080 4.162 -0.082 1 1 222 . 7 1 1 A 21 21 ARG CA C 1789 54.894 54.211 0.683 1 1 223 . 7 1 1 A 21 21 ARG CB C 1789 30.881 30.940 -0.059 1 1 226 . 7 1 1 A 21 21 ARG N N 1789 127.213 127.264 -0.051 1 1 228 . 7 1 1 A 22 22 PRO HA H 1790 4.441 4.710 -0.269 1 1 233 . 7 1 1 A 22 22 PRO CA C 1790 62.882 62.536 0.346 1 1 234 . 7 1 1 A 22 22 PRO CB C 1790 32.204 32.054 0.150 1 1 237 . 7 1 1 A 23 23 PHE H H 1791 8.336 8.306 0.030 1 1 238 . 7 1 1 A 23 23 PHE HA H 1791 4.701 5.014 -0.313 1 1 246 . 7 1 1 A 23 23 PHE CA C 1791 57.504 56.762 0.742 1 1 247 . 7 1 1 A 23 23 PHE CB C 1791 42.192 41.900 0.292 1 1 251 . 7 1 1 A 23 23 PHE N N 1791 122.145 122.490 -0.345 1 1 252 . 7 1 1 A 24 24 ASP H H 1792 6.954 8.959 -2.005 1 1 253 . 7 1 1 A 24 24 ASP HA H 1792 5.039 5.376 -0.337 1 1 256 . 7 1 1 A 24 24 ASP CA C 1792 52.871 52.449 0.422 1 1 257 . 7 1 1 A 24 24 ASP CB C 1792 44.696 44.331 0.365 1 1 258 . 7 1 1 A 24 24 ASP N N 1792 127.481 125.710 1.771 1 1 259 . 7 1 1 A 25 25 LEU H H 1793 8.372 8.539 -0.167 1 1 260 . 7 1 1 A 25 25 LEU HA H 1793 4.336 4.907 -0.571 1 1 270 . 7 1 1 A 25 25 LEU CA C 1793 54.860 54.187 0.673 1 1 271 . 7 1 1 A 25 25 LEU CB C 1793 47.575 45.550 2.025 1 1 274 . 7 1 1 A 25 25 LEU N N 1793 123.241 123.072 0.169 1 1 275 . 7 1 1 A 26 26 VAL H H 1794 8.489 8.986 -0.497 1 1 276 . 7 1 1 A 26 26 VAL HA H 1794 4.903 4.718 0.185 1 1 284 . 7 1 1 A 26 26 VAL CA C 1794 61.669 61.572 0.097 1 1 285 . 7 1 1 A 26 26 VAL CB C 1794 32.458 32.917 -0.459 1 1 288 . 7 1 1 A 26 26 VAL N N 1794 128.849 125.688 3.161 1 1 289 . 7 1 1 A 27 27 ILE H H 1795 9.101 9.067 0.034 1 1 290 . 7 1 1 A 27 27 ILE HA H 1795 4.701 4.388 0.313 1 1 300 . 7 1 1 A 27 27 ILE CA C 1795 57.433 57.424 0.009 1 1 301 . 7 1 1 A 27 27 ILE CB C 1795 41.865 41.598 0.267 1 1 305 . 7 1 1 A 27 27 ILE N N 1795 127.511 127.350 0.161 1 1 306 . 7 1 1 A 28 28 PRO HA H 1796 4.838 4.696 0.142 1 1 313 . 7 1 1 A 28 28 PRO CA C 1796 62.406 62.624 -0.218 1 1 314 . 7 1 1 A 28 28 PRO CB C 1796 30.684 29.084 1.600 1 1 317 . 7 1 1 A 29 29 PHE H H 1797 8.255 8.514 -0.259 1 1 318 . 7 1 1 A 29 29 PHE HA H 1797 4.151 5.056 -0.905 1 1 326 . 7 1 1 A 29 29 PHE CA C 1797 60.405 56.774 3.631 1 1 327 . 7 1 1 A 29 29 PHE CB C 1797 41.395 42.580 -1.185 1 1 331 . 7 1 1 A 29 29 PHE N N 1797 128.572 122.640 5.932 1 1 332 . 7 1 1 A 30 30 THR H H 1798 7.433 7.723 -0.290 1 1 333 . 7 1 1 A 30 30 THR HA H 1798 4.108 4.907 -0.799 1 1 338 . 7 1 1 A 30 30 THR CA C 1798 61.473 61.278 0.195 1 1 339 . 7 1 1 A 30 30 THR CB C 1798 69.324 70.647 -1.323 1 1 341 . 7 1 1 A 30 30 THR N N 1798 123.124 118.736 4.388 1 1 342 . 7 1 1 A 31 31 ILE H H 1799 8.402 9.052 -0.650 1 1 343 . 7 1 1 A 31 31 ILE HA H 1799 3.653 4.862 -1.209 1 1 353 . 7 1 1 A 31 31 ILE CA C 1799 61.802 60.594 1.208 1 1 354 . 7 1 1 A 31 31 ILE CB C 1799 38.548 38.785 -0.237 1 1 358 . 7 1 1 A 31 31 ILE N N 1799 128.616 128.840 -0.224 1 1 359 . 7 1 1 A 32 32 LYS H H 1800 7.742 9.085 -1.343 1 1 360 . 7 1 1 A 32 32 LYS HA H 1800 4.558 4.700 -0.142 1 1 365 . 7 1 1 A 32 32 LYS CA C 1800 56.566 55.027 1.539 1 1 366 . 7 1 1 A 32 32 LYS CB C 1800 31.982 34.284 -2.302 1 1 368 . 7 1 1 A 32 32 LYS N N 1800 128.656 125.823 2.833 1 1 369 . 7 1 1 A 33 33 LYS HA H 1801 4.531 4.229 0.302 1 1 378 . 7 1 1 A 33 33 LYS CA C 1801 56.310 57.859 -1.549 1 1 379 . 7 1 1 A 33 33 LYS CB C 1801 33.027 32.090 0.937 1 1 383 . 7 1 1 A 34 34 GLY H H 1802 8.088 7.537 0.551 1 1 384 . 7 1 1 A 34 34 GLY HA2 H 1802 4.159 3.889 0.270 1 1 385 . 7 1 1 A 34 34 GLY HA3 H 1802 3.712 3.990 -0.278 1 1 386 . 7 1 1 A 34 34 GLY CA C 1802 45.302 44.757 0.545 1 1 387 . 7 1 1 A 34 34 GLY N N 1802 110.338 109.323 1.015 1 1 388 . 7 1 1 A 35 35 GLU H H 1803 8.219 8.191 0.028 1 1 389 . 7 1 1 A 35 35 GLU HA H 1803 4.692 4.762 -0.070 1 1 394 . 7 1 1 A 35 35 GLU CA C 1803 55.160 55.202 -0.042 1 1 395 . 7 1 1 A 35 35 GLU CB C 1803 32.407 31.144 1.263 1 1 397 . 7 1 1 A 35 35 GLU N N 1803 119.576 119.926 -0.350 1 1 398 . 7 1 1 A 36 36 ILE H H 1804 8.869 8.537 0.332 1 1 399 . 7 1 1 A 36 36 ILE HA H 1804 5.468 5.003 0.465 1 1 409 . 7 1 1 A 36 36 ILE CA C 1804 58.861 59.765 -0.904 1 1 410 . 7 1 1 A 36 36 ILE CB C 1804 41.007 41.639 -0.632 1 1 414 . 7 1 1 A 36 36 ILE N N 1804 128.141 124.433 3.708 1 1 415 . 7 1 1 A 37 37 THR H H 1805 9.075 8.920 0.155 1 1 416 . 7 1 1 A 37 37 THR HA H 1805 4.703 4.943 -0.240 1 1 421 . 7 1 1 A 37 37 THR CA C 1805 59.932 60.303 -0.371 1 1 422 . 7 1 1 A 37 37 THR CB C 1805 72.441 71.528 0.913 1 1 424 . 7 1 1 A 37 37 THR N N 1805 119.846 117.078 2.768 1 1 425 . 7 1 1 A 38 38 GLY H H 1806 8.468 8.362 0.106 1 1 426 . 7 1 1 A 38 38 GLY HA2 H 1806 5.076 4.299 0.777 1 1 427 . 7 1 1 A 38 38 GLY HA3 H 1806 3.503 4.321 -0.818 1 1 428 . 7 1 1 A 38 38 GLY CA C 1806 45.593 46.115 -0.522 1 1 429 . 7 1 1 A 38 38 GLY N N 1806 107.815 108.506 -0.691 1 1 430 . 7 1 1 A 39 39 GLU H H 1807 8.519 8.403 0.116 1 1 431 . 7 1 1 A 39 39 GLU HA H 1807 4.713 5.020 -0.307 1 1 436 . 7 1 1 A 39 39 GLU CA C 1807 56.936 55.595 1.341 1 1 437 . 7 1 1 A 39 39 GLU CB C 1807 34.937 34.007 0.930 1 1 439 . 7 1 1 A 39 39 GLU N N 1807 120.173 120.344 -0.171 1 1 440 . 7 1 1 A 40 40 VAL H H 1808 9.156 9.353 -0.197 1 1 441 . 7 1 1 A 40 40 VAL HA H 1808 4.778 4.627 0.151 1 1 449 . 7 1 1 A 40 40 VAL CA C 1808 60.574 61.147 -0.573 1 1 450 . 7 1 1 A 40 40 VAL CB C 1808 34.168 33.423 0.745 1 1 452 . 7 1 1 A 40 40 VAL N N 1808 126.330 127.417 -1.087 1 1 453 . 7 1 1 A 41 41 ARG H H 1809 9.044 9.241 -0.197 1 1 454 . 7 1 1 A 41 41 ARG HA H 1809 4.778 4.894 -0.116 1 1 462 . 7 1 1 A 41 41 ARG CA C 1809 55.317 54.349 0.968 1 1 463 . 7 1 1 A 41 41 ARG CB C 1809 31.940 32.506 -0.566 1 1 466 . 7 1 1 A 41 41 ARG N N 1809 127.098 126.345 0.753 1 1 468 . 7 1 1 A 42 42 MET H H 1810 8.264 8.860 -0.596 1 1 469 . 7 1 1 A 42 42 MET HA H 1810 4.050 4.458 -0.408 1 1 477 . 7 1 1 A 42 42 MET CA C 1810 53.716 54.247 -0.531 1 1 478 . 7 1 1 A 42 42 MET CB C 1810 32.779 32.785 -0.006 1 1 481 . 7 1 1 A 42 42 MET N N 1810 123.461 123.322 0.139 1 1 482 . 7 1 1 A 43 43 PRO HA H 1811 4.179 4.418 -0.239 1 1 489 . 7 1 1 A 43 43 PRO CA C 1811 66.422 64.013 2.409 1 1 490 . 7 1 1 A 43 43 PRO CB C 1811 31.462 31.645 -0.183 1 1 493 . 7 1 1 A 44 44 SER H H 1812 8.860 7.745 1.115 1 1 494 . 7 1 1 A 44 44 SER HA H 1812 5.516 4.243 1.273 1 1 497 . 7 1 1 A 44 44 SER CA C 1812 59.937 58.720 1.217 1 1 498 . 7 1 1 A 44 44 SER CB C 1812 62.755 63.207 -0.452 1 1 499 . 7 1 1 A 44 44 SER N N 1812 112.267 110.040 2.227 1 1 500 . 7 1 1 A 45 45 GLY H H 1813 8.368 9.101 -0.733 1 1 501 . 7 1 1 A 45 45 GLY HA2 H 1813 4.461 3.906 0.555 1 1 502 . 7 1 1 A 45 45 GLY HA3 H 1813 3.569 3.914 -0.345 1 1 503 . 7 1 1 A 45 45 GLY CA C 1813 44.525 46.434 -1.909 1 1 504 . 7 1 1 A 45 45 GLY N N 1813 112.727 112.222 0.505 1 1 505 . 7 1 1 A 46 46 LYS H H 1814 7.126 7.419 -0.293 1 1 506 . 7 1 1 A 46 46 LYS HA H 1814 4.206 4.905 -0.699 1 1 515 . 7 1 1 A 46 46 LYS CA C 1814 57.460 54.643 2.817 1 1 516 . 7 1 1 A 46 46 LYS CB C 1814 33.453 36.288 -2.835 1 1 520 . 7 1 1 A 46 46 LYS N N 1814 122.101 114.609 7.492 1 1 521 . 7 1 1 A 47 47 VAL H H 1815 8.056 8.618 -0.562 1 1 522 . 7 1 1 A 47 47 VAL HA H 1815 5.400 5.085 0.315 1 1 530 . 7 1 1 A 47 47 VAL CA C 1815 60.048 59.314 0.734 1 1 531 . 7 1 1 A 47 47 VAL CB C 1815 35.044 36.200 -1.156 1 1 534 . 7 1 1 A 47 47 VAL N N 1815 118.680 115.646 3.034 1 1 535 . 7 1 1 A 48 48 ALA H H 1816 9.110 8.605 0.505 1 1 536 . 7 1 1 A 48 48 ALA HA H 1816 4.804 4.891 -0.087 1 1 540 . 7 1 1 A 48 48 ALA CA C 1816 50.808 51.242 -0.434 1 1 541 . 7 1 1 A 48 48 ALA CB C 1816 24.108 23.567 0.541 1 1 542 . 7 1 1 A 48 48 ALA N N 1816 128.274 123.487 4.787 1 1 543 . 7 1 1 A 49 49 GLN H H 1817 8.725 8.516 0.209 1 1 544 . 7 1 1 A 49 49 GLN HA H 1817 5.069 4.795 0.274 1 1 551 . 7 1 1 A 49 49 GLN CA C 1817 53.524 52.083 1.441 1 1 552 . 7 1 1 A 49 49 GLN CB C 1817 30.432 30.207 0.225 1 1 554 . 7 1 1 A 49 49 GLN N N 1817 120.102 117.358 2.744 1 1 556 . 7 1 1 A 50 50 PRO HA H 1818 5.136 4.843 0.293 1 1 563 . 7 1 1 A 50 50 PRO CA C 1818 61.966 62.487 -0.521 1 1 564 . 7 1 1 A 50 50 PRO CB C 1818 32.722 32.513 0.209 1 1 567 . 7 1 1 A 51 51 THR H H 1819 9.072 8.732 0.340 1 1 568 . 7 1 1 A 51 51 THR HA H 1819 4.566 4.813 -0.247 1 1 573 . 7 1 1 A 51 51 THR CA C 1819 62.695 61.134 1.561 1 1 574 . 7 1 1 A 51 51 THR CB C 1819 70.056 69.867 0.189 1 1 576 . 7 1 1 A 51 51 THR N N 1819 117.512 114.138 3.374 1 1 577 . 7 1 1 A 52 52 ILE H H 1820 8.900 9.477 -0.577 1 1 578 . 7 1 1 A 52 52 ILE HA H 1820 4.905 4.895 0.010 1 1 588 . 7 1 1 A 52 52 ILE CA C 1820 60.869 59.822 1.047 1 1 589 . 7 1 1 A 52 52 ILE CB C 1820 39.670 39.191 0.479 1 1 593 . 7 1 1 A 52 52 ILE N N 1820 129.513 129.527 -0.014 1 1 594 . 7 1 1 A 53 53 THR H H 1821 9.200 9.270 -0.070 1 1 595 . 7 1 1 A 53 53 THR HA H 1821 4.541 4.807 -0.266 1 1 600 . 7 1 1 A 53 53 THR CA C 1821 61.084 61.763 -0.679 1 1 601 . 7 1 1 A 53 53 THR CB C 1821 71.410 71.832 -0.422 1 1 603 . 7 1 1 A 53 53 THR N N 1821 125.271 123.850 1.421 1 1 604 . 7 1 1 A 54 54 ASP H H 1822 8.918 8.855 0.063 1 1 605 . 7 1 1 A 54 54 ASP HA H 1822 4.756 4.774 -0.018 1 1 608 . 7 1 1 A 54 54 ASP CA C 1822 53.906 54.374 -0.468 1 1 609 . 7 1 1 A 54 54 ASP CB C 1822 41.443 41.241 0.202 1 1 610 . 7 1 1 A 54 54 ASP N N 1822 126.647 126.226 0.421 1 1 611 . 7 1 1 A 55 55 ASN H H 1823 8.342 8.784 -0.442 1 1 612 . 7 1 1 A 55 55 ASN HA H 1823 4.704 4.620 0.084 1 1 617 . 7 1 1 A 55 55 ASN CA C 1823 54.421 53.124 1.297 1 1 618 . 7 1 1 A 55 55 ASN CB C 1823 38.557 38.759 -0.202 1 1 619 . 7 1 1 A 55 55 ASN N N 1823 126.271 121.629 4.642 1 1 621 . 7 1 1 A 56 56 LYS H H 1824 9.232 8.111 1.121 1 1 622 . 7 1 1 A 56 56 LYS HA H 1824 4.099 3.926 0.173 1 1 631 . 7 1 1 A 56 56 LYS CA C 1824 58.015 57.680 0.335 1 1 632 . 7 1 1 A 56 56 LYS CB C 1824 28.691 31.791 -3.100 1 1 636 . 7 1 1 A 56 56 LYS N N 1824 115.352 118.235 -2.883 1 1 637 . 7 1 1 A 57 57 ASP H H 1825 7.905 8.014 -0.109 1 1 638 . 7 1 1 A 57 57 ASP HA H 1825 4.791 4.842 -0.051 1 1 641 . 7 1 1 A 57 57 ASP CA C 1825 52.401 53.250 -0.849 1 1 642 . 7 1 1 A 57 57 ASP CB C 1825 41.166 41.137 0.029 1 1 643 . 7 1 1 A 57 57 ASP N N 1825 119.741 119.780 -0.039 1 1 644 . 7 1 1 A 58 58 GLY H H 1826 8.930 8.783 0.147 1 1 645 . 7 1 1 A 58 58 GLY HA2 H 1826 4.265 3.859 0.406 1 1 646 . 7 1 1 A 58 58 GLY HA3 H 1826 3.712 3.869 -0.157 1 1 647 . 7 1 1 A 58 58 GLY CA C 1826 44.870 45.657 -0.787 1 1 648 . 7 1 1 A 58 58 GLY N N 1826 109.578 108.247 1.331 1 1 649 . 7 1 1 A 59 59 THR H H 1827 8.004 7.574 0.430 1 1 650 . 7 1 1 A 59 59 THR HA H 1827 5.394 4.973 0.421 1 1 655 . 7 1 1 A 59 59 THR CA C 1827 60.262 59.470 0.792 1 1 656 . 7 1 1 A 59 59 THR CB C 1827 73.892 72.640 1.252 1 1 658 . 7 1 1 A 59 59 THR N N 1827 112.179 109.945 2.234 1 1 659 . 7 1 1 A 60 60 VAL H H 1828 8.822 9.165 -0.343 1 1 660 . 7 1 1 A 60 60 VAL HA H 1828 5.124 5.034 0.090 1 1 668 . 7 1 1 A 60 60 VAL CA C 1828 59.430 59.046 0.384 1 1 669 . 7 1 1 A 60 60 VAL CB C 1828 35.088 35.643 -0.555 1 1 672 . 7 1 1 A 60 60 VAL N N 1828 115.300 115.608 -0.308 1 1 673 . 7 1 1 A 61 61 THR H H 1829 9.115 9.166 -0.051 1 1 674 . 7 1 1 A 61 61 THR HA H 1829 5.128 5.191 -0.063 1 1 679 . 7 1 1 A 61 61 THR CA C 1829 61.934 59.493 2.441 1 1 680 . 7 1 1 A 61 61 THR CB C 1829 70.561 71.875 -1.314 1 1 682 . 7 1 1 A 61 61 THR N N 1829 121.210 116.712 4.498 1 1 683 . 7 1 1 A 62 62 VAL H H 1830 9.530 9.113 0.417 1 1 684 . 7 1 1 A 62 62 VAL HA H 1830 4.803 4.939 -0.136 1 1 692 . 7 1 1 A 62 62 VAL CA C 1830 60.580 60.776 -0.196 1 1 693 . 7 1 1 A 62 62 VAL CB C 1830 33.747 33.953 -0.206 1 1 696 . 7 1 1 A 62 62 VAL N N 1830 129.896 126.411 3.485 1 1 697 . 7 1 1 A 63 63 ARG H H 1831 8.879 9.138 -0.259 1 1 698 . 7 1 1 A 63 63 ARG HA H 1831 5.282 4.996 0.286 1 1 705 . 7 1 1 A 63 63 ARG CA C 1831 54.759 54.019 0.740 1 1 706 . 7 1 1 A 63 63 ARG CB C 1831 34.410 34.084 0.326 1 1 709 . 7 1 1 A 63 63 ARG N N 1831 125.701 126.096 -0.395 1 1 710 . 7 1 1 A 64 64 TYR H H 1832 8.878 8.671 0.207 1 1 711 . 7 1 1 A 64 64 TYR HA H 1832 4.888 4.862 0.026 1 1 718 . 7 1 1 A 64 64 TYR CA C 1832 57.694 58.256 -0.562 1 1 719 . 7 1 1 A 64 64 TYR CB C 1832 42.389 42.112 0.277 1 1 722 . 7 1 1 A 64 64 TYR N N 1832 122.731 123.457 -0.726 1 1 723 . 7 1 1 A 65 65 ALA H H 1833 7.925 8.289 -0.364 1 1 724 . 7 1 1 A 65 65 ALA HA H 1833 4.736 4.413 0.323 1 1 728 . 7 1 1 A 65 65 ALA CA C 1833 47.938 49.975 -2.037 1 1 729 . 7 1 1 A 65 65 ALA CB C 1833 18.320 19.496 -1.176 1 1 730 . 7 1 1 A 65 65 ALA N N 1833 135.415 129.633 5.782 1 1 731 . 7 1 1 A 66 66 PRO HA H 1834 4.198 4.564 -0.366 1 1 738 . 7 1 1 A 66 66 PRO CA C 1834 62.701 62.331 0.370 1 1 739 . 7 1 1 A 66 66 PRO CB C 1834 34.445 33.546 0.899 1 1 742 . 7 1 1 A 67 67 SER H H 1835 9.019 8.851 0.168 1 1 743 . 7 1 1 A 67 67 SER HA H 1835 4.555 4.634 -0.079 1 1 746 . 7 1 1 A 67 67 SER CA C 1835 57.320 59.139 -1.819 1 1 747 . 7 1 1 A 67 67 SER CB C 1835 64.778 66.237 -1.459 1 1 748 . 7 1 1 A 67 67 SER N N 1835 112.422 115.388 -2.966 1 1 749 . 7 1 1 A 68 68 GLU H H 1836 7.625 7.871 -0.246 1 1 750 . 7 1 1 A 68 68 GLU HA H 1836 4.513 4.814 -0.301 1 1 755 . 7 1 1 A 68 68 GLU CA C 1836 54.777 54.497 0.280 1 1 756 . 7 1 1 A 68 68 GLU CB C 1836 33.981 34.616 -0.635 1 1 758 . 7 1 1 A 68 68 GLU N N 1836 123.025 117.715 5.310 1 1 759 . 7 1 1 A 69 69 ALA H H 1837 8.133 8.072 0.061 1 1 760 . 7 1 1 A 69 69 ALA HA H 1837 4.088 4.117 -0.029 1 1 764 . 7 1 1 A 69 69 ALA CA C 1837 51.070 52.307 -1.237 1 1 765 . 7 1 1 A 69 69 ALA CB C 1837 19.665 19.696 -0.031 1 1 766 . 7 1 1 A 69 69 ALA N N 1837 122.311 125.139 -2.828 1 1 767 . 7 1 1 A 70 70 GLY H H 1838 9.120 8.255 0.865 1 1 768 . 7 1 1 A 70 70 GLY HA2 H 1838 4.453 4.082 0.371 1 1 769 . 7 1 1 A 70 70 GLY HA3 H 1838 2.953 4.128 -1.175 1 1 770 . 7 1 1 A 70 70 GLY CA C 1838 43.362 43.599 -0.237 1 1 771 . 7 1 1 A 70 70 GLY N N 1838 107.031 106.151 0.880 1 1 772 . 7 1 1 A 71 71 LEU H H 1839 9.096 8.386 0.710 1 1 773 . 7 1 1 A 71 71 LEU HA H 1839 4.336 4.758 -0.422 1 1 783 . 7 1 1 A 71 71 LEU CA C 1839 56.657 54.473 2.184 1 1 784 . 7 1 1 A 71 71 LEU CB C 1839 42.032 43.645 -1.613 1 1 788 . 7 1 1 A 71 71 LEU N N 1839 127.931 121.665 6.266 1 1 789 . 7 1 1 A 72 72 HIS H H 1840 9.359 9.446 -0.087 1 1 790 . 7 1 1 A 72 72 HIS HA H 1840 4.595 5.128 -0.533 1 1 796 . 7 1 1 A 72 72 HIS CA C 1840 54.539 54.019 0.520 1 1 797 . 7 1 1 A 72 72 HIS CB C 1840 31.421 34.138 -2.717 1 1 800 . 7 1 1 A 72 72 HIS N N 1840 128.527 125.088 3.439 1 1 802 . 7 1 1 A 73 73 GLU H H 1841 7.925 8.575 -0.650 1 1 803 . 7 1 1 A 73 73 GLU HA H 1841 5.142 5.385 -0.243 1 1 808 . 7 1 1 A 73 73 GLU CA C 1841 54.381 54.871 -0.490 1 1 809 . 7 1 1 A 73 73 GLU CB C 1841 34.043 33.702 0.341 1 1 811 . 7 1 1 A 73 73 GLU N N 1841 119.347 121.109 -1.762 1 1 812 . 7 1 1 A 74 74 MET H H 1842 9.383 9.032 0.351 1 1 813 . 7 1 1 A 74 74 MET HA H 1842 5.548 5.109 0.439 1 1 821 . 7 1 1 A 74 74 MET CA C 1842 53.859 54.515 -0.656 1 1 822 . 7 1 1 A 74 74 MET CB C 1842 38.571 36.231 2.340 1 1 825 . 7 1 1 A 74 74 MET N N 1842 124.747 123.519 1.228 1 1 826 . 7 1 1 A 75 75 ASP H H 1843 9.005 9.074 -0.069 1 1 827 . 7 1 1 A 75 75 ASP HA H 1843 5.277 5.459 -0.182 1 1 830 . 7 1 1 A 75 75 ASP CA C 1843 52.774 52.849 -0.075 1 1 831 . 7 1 1 A 75 75 ASP CB C 1843 43.493 43.494 -0.001 1 1 832 . 7 1 1 A 75 75 ASP N N 1843 128.148 125.340 2.808 1 1 833 . 7 1 1 A 76 76 ILE H H 1844 9.434 8.498 0.936 1 1 834 . 7 1 1 A 76 76 ILE HA H 1844 4.672 4.888 -0.216 1 1 844 . 7 1 1 A 76 76 ILE CA C 1844 60.715 59.650 1.065 1 1 845 . 7 1 1 A 76 76 ILE CB C 1844 39.470 41.014 -1.544 1 1 849 . 7 1 1 A 76 76 ILE N N 1844 124.097 120.822 3.275 1 1 850 . 7 1 1 A 77 77 ARG H H 1845 8.888 9.132 -0.244 1 1 851 . 7 1 1 A 77 77 ARG HA H 1845 5.050 5.060 -0.010 1 1 859 . 7 1 1 A 77 77 ARG CA C 1845 53.780 54.253 -0.473 1 1 860 . 7 1 1 A 77 77 ARG CB C 1845 34.564 33.506 1.058 1 1 863 . 7 1 1 A 77 77 ARG N N 1845 124.944 124.165 0.779 1 1 865 . 7 1 1 A 78 78 TYR H H 1846 8.974 9.025 -0.051 1 1 866 . 7 1 1 A 78 78 TYR HA H 1846 5.151 4.934 0.217 1 1 873 . 7 1 1 A 78 78 TYR CA C 1846 55.909 57.553 -1.644 1 1 874 . 7 1 1 A 78 78 TYR CB C 1846 41.732 40.361 1.371 1 1 877 . 7 1 1 A 78 78 TYR N N 1846 121.774 125.630 -3.856 1 1 878 . 7 1 1 A 79 79 ASP H H 1847 9.026 9.344 -0.318 1 1 879 . 7 1 1 A 79 79 ASP HA H 1847 4.127 4.178 -0.051 1 1 882 . 7 1 1 A 79 79 ASP CA C 1847 55.808 55.037 0.771 1 1 883 . 7 1 1 A 79 79 ASP CB C 1847 39.181 39.530 -0.349 1 1 884 . 7 1 1 A 79 79 ASP N N 1847 131.304 127.766 3.538 1 1 885 . 7 1 1 A 80 80 ASN H H 1848 8.608 8.468 0.140 1 1 886 . 7 1 1 A 80 80 ASN HA H 1848 3.990 4.409 -0.419 1 1 891 . 7 1 1 A 80 80 ASN CA C 1848 55.149 54.686 0.463 1 1 892 . 7 1 1 A 80 80 ASN CB C 1848 38.470 38.711 -0.241 1 1 893 . 7 1 1 A 80 80 ASN N N 1848 108.490 114.986 -6.496 1 1 895 . 7 1 1 A 81 81 MET H H 1849 7.820 7.910 -0.090 1 1 896 . 7 1 1 A 81 81 MET HA H 1849 4.819 4.900 -0.081 1 1 904 . 7 1 1 A 81 81 MET CA C 1849 53.852 53.899 -0.047 1 1 905 . 7 1 1 A 81 81 MET CB C 1849 34.665 33.580 1.085 1 1 908 . 7 1 1 A 81 81 MET N N 1849 121.878 119.894 1.984 1 1 909 . 7 1 1 A 82 82 HIS H H 1850 8.575 8.808 -0.233 1 1 910 . 7 1 1 A 82 82 HIS HA H 1850 4.539 4.661 -0.122 1 1 915 . 7 1 1 A 82 82 HIS CA C 1850 58.819 57.410 1.409 1 1 916 . 7 1 1 A 82 82 HIS CB C 1850 32.419 30.559 1.860 1 1 919 . 7 1 1 A 82 82 HIS N N 1850 124.291 120.820 3.471 1 1 920 . 7 1 1 A 83 83 ILE H H 1851 8.333 8.461 -0.128 1 1 921 . 7 1 1 A 83 83 ILE HA H 1851 4.608 4.503 0.105 1 1 931 . 7 1 1 A 83 83 ILE CA C 1851 60.727 59.595 1.132 1 1 932 . 7 1 1 A 83 83 ILE CB C 1851 35.928 37.327 -1.399 1 1 936 . 7 1 1 A 83 83 ILE N N 1851 120.786 121.453 -0.667 1 1 937 . 7 1 1 A 84 84 PRO HA H 1852 4.426 4.464 -0.038 1 1 944 . 7 1 1 A 84 84 PRO CA C 1852 65.249 64.421 0.828 1 1 945 . 7 1 1 A 84 84 PRO CB C 1852 31.120 31.823 -0.703 1 1 948 . 7 1 1 A 85 85 GLY H H 1853 8.498 8.538 -0.040 1 1 949 . 7 1 1 A 85 85 GLY HA2 H 1853 4.284 3.964 0.320 1 1 950 . 7 1 1 A 85 85 GLY HA3 H 1853 3.397 4.117 -0.720 1 1 951 . 7 1 1 A 85 85 GLY CA C 1853 44.913 45.395 -0.482 1 1 952 . 7 1 1 A 85 85 GLY N N 1853 114.093 107.437 6.656 1 1 953 . 7 1 1 A 86 86 SER H H 1854 7.823 7.931 -0.108 1 1 954 . 7 1 1 A 86 86 SER HA H 1854 4.834 4.714 0.120 1 1 957 . 7 1 1 A 86 86 SER CA C 1854 55.628 55.584 0.044 1 1 958 . 7 1 1 A 86 86 SER CB C 1854 63.063 64.006 -0.943 1 1 959 . 7 1 1 A 86 86 SER N N 1854 112.722 116.856 -4.134 1 1 960 . 7 1 1 A 87 87 PRO HA H 1855 5.681 4.788 0.893 1 1 967 . 7 1 1 A 87 87 PRO CA C 1855 63.079 62.464 0.615 1 1 968 . 7 1 1 A 87 87 PRO CB C 1855 34.406 32.752 1.654 1 1 971 . 7 1 1 A 88 88 LEU H H 1856 9.168 8.886 0.282 1 1 972 . 7 1 1 A 88 88 LEU HA H 1856 4.909 5.196 -0.287 1 1 982 . 7 1 1 A 88 88 LEU CA C 1856 53.839 53.291 0.548 1 1 983 . 7 1 1 A 88 88 LEU CB C 1856 45.558 45.694 -0.136 1 1 987 . 7 1 1 A 88 88 LEU N N 1856 122.495 121.172 1.323 1 1 988 . 7 1 1 A 89 89 GLN H H 1857 9.583 8.735 0.848 1 1 989 . 7 1 1 A 89 89 GLN HA H 1857 5.508 5.299 0.209 1 1 996 . 7 1 1 A 89 89 GLN CA C 1857 54.609 54.873 -0.264 1 1 997 . 7 1 1 A 89 89 GLN CB C 1857 32.840 32.544 0.296 1 1 999 . 7 1 1 A 89 89 GLN N N 1857 119.151 121.599 -2.448 1 1 1001 . 7 1 1 A 90 90 PHE H H 1858 8.600 8.859 -0.259 1 1 1002 . 7 1 1 A 90 90 PHE HA H 1858 5.095 5.126 -0.031 1 1 1010 . 7 1 1 A 90 90 PHE CA C 1858 56.161 56.111 0.050 1 1 1011 . 7 1 1 A 90 90 PHE CB C 1858 41.411 40.688 0.723 1 1 1015 . 7 1 1 A 90 90 PHE N N 1858 118.242 119.844 -1.602 1 1 1016 . 7 1 1 A 91 91 TYR H H 1859 9.892 8.887 1.005 1 1 1017 . 7 1 1 A 91 91 TYR HA H 1859 4.790 5.169 -0.379 1 1 1024 . 7 1 1 A 91 91 TYR CA C 1859 58.205 56.111 2.094 1 1 1025 . 7 1 1 A 91 91 TYR CB C 1859 40.867 42.023 -1.156 1 1 1028 . 7 1 1 A 91 91 TYR N N 1859 127.393 121.984 5.409 1 1 1029 . 7 1 1 A 92 92 VAL H H 1860 8.072 8.126 -0.054 1 1 1030 . 7 1 1 A 92 92 VAL HA H 1860 4.377 4.759 -0.382 1 1 1038 . 7 1 1 A 92 92 VAL CA C 1860 62.583 60.147 2.436 1 1 1039 . 7 1 1 A 92 92 VAL CB C 1860 33.609 34.398 -0.789 1 1 1042 . 7 1 1 A 92 92 VAL N N 1860 132.007 125.402 6.605 1 1 1043 . 7 1 1 A 93 93 ASP H H 1861 8.438 8.804 -0.366 1 1 1044 . 7 1 1 A 93 93 ASP HA H 1861 5.024 4.934 0.090 1 1 1047 . 7 1 1 A 93 93 ASP CA C 1861 50.678 52.413 -1.735 1 1 1048 . 7 1 1 A 93 93 ASP CB C 1861 46.086 44.887 1.199 1 1 1049 . 7 1 1 A 93 93 ASP N N 1861 130.459 123.864 6.595 1 1 1050 . 7 1 1 A 94 94 TYR H H 1862 9.674 8.411 1.263 1 1 1051 . 7 1 1 A 94 94 TYR HA H 1862 4.606 4.495 0.111 1 1 1058 . 7 1 1 A 94 94 TYR CA C 1862 58.983 58.657 0.326 1 1 1059 . 7 1 1 A 94 94 TYR CB C 1862 39.727 38.856 0.871 1 1 1062 . 7 1 1 A 94 94 TYR N N 1862 120.069 121.669 -1.600 1 1 1063 . 7 1 1 A 95 95 VAL H H 1863 8.371 9.025 -0.654 1 1 1064 . 7 1 1 A 95 95 VAL HA H 1863 3.654 3.869 -0.215 1 1 1072 . 7 1 1 A 95 95 VAL CA C 1863 64.922 65.075 -0.153 1 1 1073 . 7 1 1 A 95 95 VAL CB C 1863 32.270 31.581 0.689 1 1 1076 . 7 1 1 A 95 95 VAL N N 1863 121.770 123.031 -1.261 1 1 1077 . 7 1 1 A 96 96 ASN H H 1864 8.729 8.521 0.208 1 1 1078 . 7 1 1 A 96 96 ASN HA H 1864 4.901 4.803 0.098 1 1 1083 . 7 1 1 A 96 96 ASN CA C 1864 52.652 52.421 0.231 1 1 1084 . 7 1 1 A 96 96 ASN CB C 1864 38.160 37.805 0.355 1 1 1085 . 7 1 1 A 96 96 ASN N N 1864 120.006 117.835 2.171 1 1 1087 . 7 1 1 A 97 97 CYS H H 1865 7.875 7.280 0.595 1 1 1088 . 7 1 1 A 97 97 CYS HA H 1865 4.575 4.369 0.206 1 1 1091 . 7 1 1 A 97 97 CYS CA C 1865 57.009 59.812 -2.803 1 1 1092 . 7 1 1 A 97 97 CYS CB C 1865 29.845 27.718 2.127 1 1 1093 . 7 1 1 A 97 97 CYS N N 1865 117.023 120.017 -2.994 1 1 1094 . 7 1 1 A 98 98 GLY HA2 H 1866 4.045 3.913 0.132 1 1 1095 . 7 1 1 A 98 98 GLY HA3 H 1866 3.866 3.940 -0.074 1 1 1096 . 7 1 1 A 98 98 GLY CA C 1866 46.078 45.714 0.364 1 1 1097 . 7 1 1 A 99 99 HIS H H 1867 7.144 7.636 -0.492 1 1 1098 . 7 1 1 A 99 99 HIS HA H 1867 4.940 4.536 0.404 1 1 1103 . 7 1 1 A 99 99 HIS CA C 1867 53.843 55.925 -2.082 1 1 1104 . 7 1 1 A 99 99 HIS CB C 1867 31.584 30.677 0.907 1 1 1107 . 7 1 1 A 99 99 HIS N N 1867 115.591 117.835 -2.244 1 1 1108 . 7 1 1 A 100 100 VAL H H 1868 8.434 8.526 -0.092 1 1 1109 . 7 1 1 A 100 100 VAL HA H 1868 4.143 4.254 -0.111 1 1 1117 . 7 1 1 A 100 100 VAL CA C 1868 63.974 63.139 0.835 1 1 1118 . 7 1 1 A 100 100 VAL CB C 1868 31.525 32.440 -0.915 1 1 1121 . 7 1 1 A 100 100 VAL N N 1868 122.851 120.229 2.622 1 1 1122 . 7 1 1 A 101 101 THR H H 1869 7.869 8.345 -0.476 1 1 1123 . 7 1 1 A 101 101 THR HA H 1869 5.217 5.407 -0.190 1 1 1128 . 7 1 1 A 101 101 THR CA C 1869 59.495 59.740 -0.245 1 1 1129 . 7 1 1 A 101 101 THR CB C 1869 72.402 72.706 -0.304 1 1 1131 . 7 1 1 A 101 101 THR N N 1869 118.578 118.578 0.000 1 1 1132 . 7 1 1 A 102 102 ALA H H 1870 8.512 8.898 -0.386 1 1 1133 . 7 1 1 A 102 102 ALA HA H 1870 5.687 5.352 0.335 1 1 1137 . 7 1 1 A 102 102 ALA CA C 1870 50.497 50.830 -0.333 1 1 1138 . 7 1 1 A 102 102 ALA CB C 1870 23.128 23.744 -0.616 1 1 1139 . 7 1 1 A 102 102 ALA N N 1870 125.193 122.430 2.763 1 1 1140 . 7 1 1 A 103 103 TYR H H 1871 8.753 8.827 -0.074 1 1 1141 . 7 1 1 A 103 103 TYR HA H 1871 5.019 5.175 -0.156 1 1 1148 . 7 1 1 A 103 103 TYR CA C 1871 56.303 56.224 0.079 1 1 1149 . 7 1 1 A 103 103 TYR CB C 1871 39.347 41.316 -1.969 1 1 1152 . 7 1 1 A 103 103 TYR N N 1871 119.968 116.507 3.461 1 1 1153 . 7 1 1 A 104 104 GLY H H 1872 9.006 8.719 0.287 1 1 1154 . 7 1 1 A 104 104 GLY HA2 H 1872 5.326 4.370 0.956 1 1 1155 . 7 1 1 A 104 104 GLY HA3 H 1872 4.226 4.394 -0.168 1 1 1156 . 7 1 1 A 104 104 GLY CA C 1872 44.624 44.419 0.205 1 1 1157 . 7 1 1 A 104 104 GLY N N 1872 109.622 107.047 2.575 1 1 1158 . 7 1 1 A 105 105 PRO HA H 1873 4.450 4.482 -0.032 1 1 1165 . 7 1 1 A 105 105 PRO CA C 1873 66.676 65.040 1.636 1 1 1166 . 7 1 1 A 105 105 PRO CB C 1873 32.425 32.123 0.302 1 1 1169 . 7 1 1 A 106 106 GLY H H 1874 9.251 8.630 0.621 1 1 1170 . 7 1 1 A 106 106 GLY HA2 H 1874 4.600 3.911 0.689 1 1 1171 . 7 1 1 A 106 106 GLY HA3 H 1874 3.521 4.138 -0.617 1 1 1172 . 7 1 1 A 106 106 GLY CA C 1874 46.454 47.011 -0.557 1 1 1173 . 7 1 1 A 106 106 GLY N N 1874 105.282 105.603 -0.321 1 1 1174 . 7 1 1 A 107 107 LEU H H 1875 7.161 7.921 -0.760 1 1 1175 . 7 1 1 A 107 107 LEU HA H 1875 4.062 3.934 0.128 1 1 1185 . 7 1 1 A 107 107 LEU CA C 1875 55.592 55.830 -0.238 1 1 1186 . 7 1 1 A 107 107 LEU CB C 1875 41.516 40.448 1.068 1 1 1190 . 7 1 1 A 107 107 LEU N N 1875 117.141 119.199 -2.058 1 1 1191 . 7 1 1 A 108 108 THR H H 1876 8.298 7.875 0.423 1 1 1192 . 7 1 1 A 108 108 THR HA H 1876 5.038 4.524 0.514 1 1 1197 . 7 1 1 A 108 108 THR CA C 1876 64.551 63.727 0.824 1 1 1198 . 7 1 1 A 108 108 THR CB C 1876 72.706 71.124 1.582 1 1 1200 . 7 1 1 A 108 108 THR N N 1876 114.411 112.540 1.871 1 1 1201 . 7 1 1 A 109 109 HIS H H 1877 9.030 8.028 1.002 1 1 1202 . 7 1 1 A 109 109 HIS HA H 1877 5.854 5.142 0.712 1 1 1207 . 7 1 1 A 109 109 HIS CA C 1877 56.127 54.221 1.906 1 1 1208 . 7 1 1 A 109 109 HIS CB C 1877 36.258 33.578 2.680 1 1 1211 . 7 1 1 A 109 109 HIS N N 1877 125.809 117.550 8.259 1 1 1212 . 7 1 1 A 110 110 GLY H H 1878 7.497 7.969 -0.472 1 1 1213 . 7 1 1 A 110 110 GLY HA2 H 1878 4.075 4.077 -0.002 1 1 1214 . 7 1 1 A 110 110 GLY HA3 H 1878 3.512 4.099 -0.587 1 1 1215 . 7 1 1 A 110 110 GLY CA C 1878 44.559 44.362 0.197 1 1 1216 . 7 1 1 A 110 110 GLY N N 1878 111.907 111.397 0.510 1 1 1217 . 7 1 1 A 111 111 VAL H H 1879 8.776 8.259 0.517 1 1 1218 . 7 1 1 A 111 111 VAL HA H 1879 4.741 4.749 -0.008 1 1 1226 . 7 1 1 A 111 111 VAL CA C 1879 60.188 60.507 -0.319 1 1 1227 . 7 1 1 A 111 111 VAL CB C 1879 35.130 35.475 -0.345 1 1 1230 . 7 1 1 A 111 111 VAL N N 1879 119.617 119.960 -0.343 1 1 1231 . 7 1 1 A 112 112 VAL H H 1880 7.841 8.634 -0.793 1 1 1232 . 7 1 1 A 112 112 VAL HA H 1880 3.343 3.935 -0.592 1 1 1240 . 7 1 1 A 112 112 VAL CA C 1880 63.553 62.805 0.748 1 1 1241 . 7 1 1 A 112 112 VAL CB C 1880 32.257 31.550 0.707 1 1 1243 . 7 1 1 A 112 112 VAL N N 1880 122.070 126.030 -3.960 1 1 1244 . 7 1 1 A 113 113 ASN H H 1881 8.822 9.124 -0.302 1 1 1245 . 7 1 1 A 113 113 ASN HA H 1881 4.079 4.345 -0.266 1 1 1250 . 7 1 1 A 113 113 ASN CA C 1881 55.459 54.949 0.510 1 1 1251 . 7 1 1 A 113 113 ASN CB C 1881 37.330 37.205 0.125 1 1 1252 . 7 1 1 A 113 113 ASN N N 1881 115.063 118.430 -3.367 1 1 1254 . 7 1 1 A 114 114 LYS H H 1882 8.073 7.540 0.533 1 1 1255 . 7 1 1 A 114 114 LYS HA H 1882 4.818 4.671 0.147 1 1 1260 . 7 1 1 A 114 114 LYS CA C 1882 53.039 52.617 0.422 1 1 1261 . 7 1 1 A 114 114 LYS CB C 1882 34.020 33.207 0.813 1 1 1263 . 7 1 1 A 114 114 LYS N N 1882 121.439 118.844 2.595 1 1 1264 . 7 1 1 A 115 115 PRO HA H 1883 4.409 4.675 -0.266 1 1 1271 . 7 1 1 A 115 115 PRO CA C 1883 63.121 62.660 0.461 1 1 1272 . 7 1 1 A 115 115 PRO CB C 1883 31.515 31.706 -0.191 1 1 1275 . 7 1 1 A 116 116 ALA H H 1884 8.868 8.179 0.689 1 1 1276 . 7 1 1 A 116 116 ALA HA H 1884 4.804 4.979 -0.175 1 1 1280 . 7 1 1 A 116 116 ALA CA C 1884 50.620 50.346 0.274 1 1 1281 . 7 1 1 A 116 116 ALA CB C 1884 19.426 21.969 -2.543 1 1 1282 . 7 1 1 A 116 116 ALA N N 1884 132.329 126.294 6.035 1 1 1283 . 7 1 1 A 117 117 THR H H 1885 8.433 8.748 -0.315 1 1 1284 . 7 1 1 A 117 117 THR HA H 1885 5.747 5.407 0.340 1 1 1289 . 7 1 1 A 117 117 THR CA C 1885 60.364 59.986 0.378 1 1 1290 . 7 1 1 A 117 117 THR CB C 1885 72.204 71.939 0.265 1 1 1292 . 7 1 1 A 117 117 THR N N 1885 113.428 111.312 2.116 1 1 1293 . 7 1 1 A 118 118 PHE H H 1886 9.069 8.531 0.538 1 1 1294 . 7 1 1 A 118 118 PHE HA H 1886 5.123 5.251 -0.128 1 1 1301 . 7 1 1 A 118 118 PHE CA C 1886 57.059 56.050 1.009 1 1 1302 . 7 1 1 A 118 118 PHE CB C 1886 39.994 41.093 -1.099 1 1 1305 . 7 1 1 A 118 118 PHE N N 1886 119.166 117.719 1.447 1 1 1306 . 7 1 1 A 119 119 THR H H 1887 9.451 8.997 0.454 1 1 1307 . 7 1 1 A 119 119 THR HA H 1887 5.097 5.089 0.008 1 1 1312 . 7 1 1 A 119 119 THR CA C 1887 62.050 61.291 0.759 1 1 1313 . 7 1 1 A 119 119 THR CB C 1887 71.696 72.850 -1.154 1 1 1315 . 7 1 1 A 119 119 THR N N 1887 119.436 114.446 4.990 1 1 1316 . 7 1 1 A 120 120 VAL H H 1888 8.812 9.299 -0.487 1 1 1317 . 7 1 1 A 120 120 VAL HA H 1888 4.807 4.546 0.261 1 1 1325 . 7 1 1 A 120 120 VAL CA C 1888 61.140 60.930 0.210 1 1 1326 . 7 1 1 A 120 120 VAL CB C 1888 34.059 33.865 0.194 1 1 1329 . 7 1 1 A 120 120 VAL N N 1888 124.304 126.379 -2.075 1 1 1330 . 7 1 1 A 121 121 ASN H H 1889 9.291 9.159 0.132 1 1 1331 . 7 1 1 A 121 121 ASN HA H 1889 5.177 5.334 -0.157 1 1 1336 . 7 1 1 A 121 121 ASN CA C 1889 52.470 52.447 0.023 1 1 1337 . 7 1 1 A 121 121 ASN CB C 1889 39.766 40.341 -0.575 1 1 1338 . 7 1 1 A 121 121 ASN N N 1889 128.674 125.270 3.404 1 1 1340 . 7 1 1 A 122 122 THR H H 1890 8.553 8.491 0.062 1 1 1341 . 7 1 1 A 122 122 THR HA H 1890 4.236 4.878 -0.642 1 1 1346 . 7 1 1 A 122 122 THR CA C 1890 61.062 61.157 -0.095 1 1 1347 . 7 1 1 A 122 122 THR CB C 1890 68.437 69.945 -1.508 1 1 1349 . 7 1 1 A 122 122 THR N N 1890 116.203 113.571 2.632 1 1 1350 . 7 1 1 A 123 123 LYS H H 1891 8.210 7.617 0.593 1 1 1351 . 7 1 1 A 123 123 LYS HA H 1891 4.019 3.994 0.025 1 1 1360 . 7 1 1 A 123 123 LYS CA C 1891 58.646 59.580 -0.934 1 1 1361 . 7 1 1 A 123 123 LYS CB C 1891 31.868 32.174 -0.306 1 1 1365 . 7 1 1 A 123 123 LYS N N 1891 124.070 122.539 1.531 1 1 1366 . 7 1 1 A 124 124 ASP H H 1892 8.596 7.893 0.703 1 1 1367 . 7 1 1 A 124 124 ASP HA H 1892 4.638 4.913 -0.275 1 1 1370 . 7 1 1 A 124 124 ASP CA C 1892 54.928 52.941 1.987 1 1 1371 . 7 1 1 A 124 124 ASP CB C 1892 40.725 41.319 -0.594 1 1 1372 . 7 1 1 A 124 124 ASP N N 1892 119.838 117.291 2.547 1 1 1373 . 7 1 1 A 125 125 ALA H H 1893 7.792 7.750 0.042 1 1 1374 . 7 1 1 A 125 125 ALA HA H 1893 4.248 4.196 0.052 1 1 1378 . 7 1 1 A 125 125 ALA CA C 1893 52.852 52.730 0.122 1 1 1379 . 7 1 1 A 125 125 ALA CB C 1893 20.199 19.545 0.654 1 1 1380 . 7 1 1 A 125 125 ALA N N 1893 122.999 121.557 1.442 1 1 1381 . 7 1 1 A 126 126 GLY H H 1894 8.214 7.806 0.408 1 1 1382 . 7 1 1 A 126 126 GLY HA2 H 1894 4.183 3.926 0.257 1 1 1383 . 7 1 1 A 126 126 GLY HA3 H 1894 3.993 3.982 0.011 1 1 1384 . 7 1 1 A 126 126 GLY CA C 1894 44.725 44.601 0.124 1 1 1385 . 7 1 1 A 126 126 GLY N N 1894 108.359 104.333 4.026 1 1 1386 . 7 1 1 A 127 127 GLU H H 1895 8.633 8.447 0.186 1 1 1387 . 7 1 1 A 127 127 GLU HA H 1895 4.318 4.479 -0.161 1 1 1392 . 7 1 1 A 127 127 GLU CA C 1895 57.280 57.033 0.247 1 1 1393 . 7 1 1 A 127 127 GLU CB C 1895 30.434 30.445 -0.011 1 1 1395 . 7 1 1 A 127 127 GLU N N 1895 122.934 120.943 1.991 1 1 1396 . 7 1 1 A 128 128 GLY H H 1896 8.351 8.662 -0.311 1 1 1397 . 7 1 1 A 128 128 GLY HA2 H 1896 3.853 4.017 -0.164 1 1 1398 . 7 1 1 A 128 128 GLY HA3 H 1896 3.853 4.039 -0.186 1 1 1399 . 7 1 1 A 128 128 GLY CA C 1896 45.766 45.240 0.526 1 1 1400 . 7 1 1 A 128 128 GLY N N 1896 111.048 114.511 -3.463 1 1 1401 . 7 1 1 A 129 129 GLY H H 1897 7.580 8.478 -0.898 1 1 1402 . 7 1 1 A 129 129 GLY HA2 H 1897 4.170 4.087 0.083 1 1 1403 . 7 1 1 A 129 129 GLY HA3 H 1897 3.463 4.105 -0.642 1 1 1404 . 7 1 1 A 129 129 GLY CA C 1897 44.670 45.869 -1.199 1 1 1405 . 7 1 1 A 129 129 GLY N N 1897 106.306 109.245 -2.939 1 1 1406 . 7 1 1 A 130 130 LEU H H 1898 8.416 8.247 0.169 1 1 1407 . 7 1 1 A 130 130 LEU HA H 1898 5.077 4.280 0.797 1 1 1417 . 7 1 1 A 130 130 LEU CA C 1898 54.526 54.511 0.015 1 1 1418 . 7 1 1 A 130 130 LEU CB C 1898 44.499 42.352 2.147 1 1 1422 . 7 1 1 A 130 130 LEU N N 1898 126.737 124.929 1.808 1 1 1423 . 7 1 1 A 131 131 SER H H 1899 9.254 9.326 -0.072 1 1 1424 . 7 1 1 A 131 131 SER HA H 1899 4.803 5.437 -0.634 1 1 1427 . 7 1 1 A 131 131 SER CA C 1899 57.293 57.194 0.099 1 1 1428 . 7 1 1 A 131 131 SER CB C 1899 65.376 66.782 -1.406 1 1 1429 . 7 1 1 A 131 131 SER N N 1899 123.028 124.610 -1.582 1 1 1430 . 7 1 1 A 132 132 LEU H H 1900 8.410 8.552 -0.142 1 1 1431 . 7 1 1 A 132 132 LEU HA H 1900 5.452 4.956 0.496 1 1 1441 . 7 1 1 A 132 132 LEU CA C 1900 53.045 54.405 -1.360 1 1 1442 . 7 1 1 A 132 132 LEU CB C 1900 46.982 46.032 0.950 1 1 1446 . 7 1 1 A 132 132 LEU N N 1900 126.218 122.957 3.261 1 1 1447 . 7 1 1 A 133 133 ALA H H 1901 8.708 8.563 0.145 1 1 1448 . 7 1 1 A 133 133 ALA HA H 1901 4.591 4.941 -0.350 1 1 1452 . 7 1 1 A 133 133 ALA CA C 1901 52.140 51.369 0.771 1 1 1453 . 7 1 1 A 133 133 ALA CB C 1901 22.653 23.667 -1.014 1 1 1454 . 7 1 1 A 133 133 ALA N N 1901 124.744 126.080 -1.336 1 1 1455 . 7 1 1 A 134 134 ILE H H 1902 8.641 8.526 0.115 1 1 1456 . 7 1 1 A 134 134 ILE HA H 1902 5.256 5.161 0.095 1 1 1466 . 7 1 1 A 134 134 ILE CA C 1902 59.873 60.066 -0.193 1 1 1467 . 7 1 1 A 134 134 ILE CB C 1902 41.214 41.992 -0.778 1 1 1471 . 7 1 1 A 134 134 ILE N N 1902 121.132 120.268 0.864 1 1 1472 . 7 1 1 A 135 135 GLU H H 1903 9.294 8.951 0.343 1 1 1473 . 7 1 1 A 135 135 GLU HA H 1903 4.869 5.192 -0.323 1 1 1478 . 7 1 1 A 135 135 GLU CA C 1903 54.307 54.741 -0.434 1 1 1479 . 7 1 1 A 135 135 GLU CB C 1903 32.474 33.472 -0.998 1 1 1481 . 7 1 1 A 135 135 GLU N N 1903 129.644 124.260 5.384 1 1 1482 . 7 1 1 A 136 136 GLY H H 1904 8.347 8.276 0.071 1 1 1483 . 7 1 1 A 136 136 GLY HA2 H 1904 4.005 3.519 0.486 1 1 1484 . 7 1 1 A 136 136 GLY HA3 H 1904 3.629 4.001 -0.372 1 1 1485 . 7 1 1 A 136 136 GLY CA C 1904 45.530 44.992 0.538 1 1 1486 . 7 1 1 A 136 136 GLY N N 1904 112.326 108.733 3.593 1 1 1487 . 7 1 1 A 137 137 PRO HA H 1905 4.268 4.309 -0.041 1 1 1494 . 7 1 1 A 137 137 PRO CA C 1905 64.189 63.939 0.250 1 1 1495 . 7 1 1 A 137 137 PRO CB C 1905 32.482 31.941 0.541 1 1 1498 . 7 1 1 A 138 138 SER H H 1906 7.060 7.369 -0.309 1 1 1499 . 7 1 1 A 138 138 SER HA H 1906 4.603 4.651 -0.048 1 1 1502 . 7 1 1 A 138 138 SER CA C 1906 56.433 56.845 -0.412 1 1 1503 . 7 1 1 A 138 138 SER CB C 1906 66.672 65.451 1.221 1 1 1504 . 7 1 1 A 138 138 SER N N 1906 109.100 111.653 -2.553 1 1 1505 . 7 1 1 A 139 139 LYS H H 1907 8.479 8.387 0.092 1 1 1506 . 7 1 1 A 139 139 LYS HA H 1907 4.413 4.421 -0.008 1 1 1515 . 7 1 1 A 139 139 LYS CA C 1907 56.638 56.777 -0.139 1 1 1516 . 7 1 1 A 139 139 LYS CB C 1907 31.873 33.006 -1.133 1 1 1520 . 7 1 1 A 139 139 LYS N N 1907 124.545 124.964 -0.419 1 1 1521 . 7 1 1 A 140 140 ALA H H 1908 8.358 8.473 -0.115 1 1 1522 . 7 1 1 A 140 140 ALA HA H 1908 4.706 4.525 0.181 1 1 1526 . 7 1 1 A 140 140 ALA CA C 1908 51.081 52.653 -1.572 1 1 1527 . 7 1 1 A 140 140 ALA CB C 1908 20.724 19.458 1.266 1 1 1528 . 7 1 1 A 140 140 ALA N N 1908 131.020 129.630 1.390 1 1 1529 . 7 1 1 A 141 141 GLU H H 1909 8.625 8.239 0.386 1 1 1530 . 7 1 1 A 141 141 GLU HA H 1909 4.248 4.745 -0.497 1 1 1535 . 7 1 1 A 141 141 GLU CA C 1909 56.991 55.810 1.181 1 1 1536 . 7 1 1 A 141 141 GLU CB C 1909 30.453 30.715 -0.262 1 1 1538 . 7 1 1 A 141 141 GLU N N 1909 124.862 120.423 4.439 1 1 1539 . 7 1 1 A 142 142 ILE H H 1910 8.588 8.688 -0.100 1 1 1540 . 7 1 1 A 142 142 ILE HA H 1910 4.871 5.116 -0.245 1 1 1550 . 7 1 1 A 142 142 ILE CA C 1910 60.733 59.916 0.817 1 1 1551 . 7 1 1 A 142 142 ILE CB C 1910 41.494 41.951 -0.457 1 1 1555 . 7 1 1 A 142 142 ILE N N 1910 126.220 123.629 2.591 1 1 1556 . 7 1 1 A 143 143 SER H H 1911 9.269 9.092 0.177 1 1 1557 . 7 1 1 A 143 143 SER HA H 1911 4.804 5.166 -0.362 1 1 1560 . 7 1 1 A 143 143 SER CA C 1911 56.988 56.974 0.014 1 1 1561 . 7 1 1 A 143 143 SER CB C 1911 65.172 65.783 -0.611 1 1 1562 . 7 1 1 A 143 143 SER N N 1911 124.083 120.285 3.798 1 1 1563 . 7 1 1 A 144 144 CYS H H 1912 8.773 8.744 0.029 1 1 1564 . 7 1 1 A 144 144 CYS HA H 1912 5.200 5.151 0.049 1 1 1567 . 7 1 1 A 144 144 CYS CA C 1912 57.256 56.533 0.723 1 1 1568 . 7 1 1 A 144 144 CYS CB C 1912 29.137 31.341 -2.204 1 1 1569 . 7 1 1 A 144 144 CYS N N 1912 125.729 120.628 5.101 1 1 1570 . 7 1 1 A 145 145 THR H H 1913 8.976 8.853 0.123 1 1 1571 . 7 1 1 A 145 145 THR HA H 1913 4.510 4.936 -0.426 1 1 1576 . 7 1 1 A 145 145 THR CA C 1913 61.388 61.471 -0.083 1 1 1577 . 7 1 1 A 145 145 THR CB C 1913 71.558 71.955 -0.397 1 1 1579 . 7 1 1 A 145 145 THR N N 1913 124.914 117.368 7.546 1 1 1580 . 7 1 1 A 146 146 ASP H H 1914 8.843 9.054 -0.211 1 1 1581 . 7 1 1 A 146 146 ASP HA H 1914 4.842 4.840 0.002 1 1 1584 . 7 1 1 A 146 146 ASP CA C 1914 54.307 54.269 0.038 1 1 1585 . 7 1 1 A 146 146 ASP CB C 1914 41.262 42.118 -0.856 1 1 1586 . 7 1 1 A 146 146 ASP N N 1914 128.084 128.690 -0.606 1 1 1587 . 7 1 1 A 147 147 ASN H H 1915 8.700 8.852 -0.152 1 1 1588 . 7 1 1 A 147 147 ASN HA H 1915 4.798 5.044 -0.246 1 1 1593 . 7 1 1 A 147 147 ASN CA C 1915 54.283 51.939 2.344 1 1 1594 . 7 1 1 A 147 147 ASN CB C 1915 38.986 40.909 -1.923 1 1 1595 . 7 1 1 A 147 147 ASN N N 1915 125.720 122.766 2.954 1 1 1597 . 7 1 1 A 148 148 GLN HA H 1916 4.057 4.122 -0.065 1 1 1602 . 7 1 1 A 148 148 GLN CA C 1916 57.839 58.516 -0.677 1 1 1603 . 7 1 1 A 148 148 GLN CB C 1916 26.281 28.416 -2.135 1 1 1605 . 7 1 1 A 149 149 ASP H H 1917 7.892 7.746 0.146 1 1 1606 . 7 1 1 A 149 149 ASP HA H 1917 4.755 4.753 0.002 1 1 1609 . 7 1 1 A 149 149 ASP CA C 1917 52.659 54.090 -1.431 1 1 1610 . 7 1 1 A 149 149 ASP CB C 1917 41.111 41.322 -0.211 1 1 1611 . 7 1 1 A 149 149 ASP N N 1917 118.769 117.534 1.235 1 1 1612 . 7 1 1 A 150 150 GLY H H 1918 8.673 8.776 -0.103 1 1 1613 . 7 1 1 A 150 150 GLY HA2 H 1918 4.358 3.913 0.445 1 1 1614 . 7 1 1 A 150 150 GLY HA3 H 1918 3.700 3.915 -0.215 1 1 1615 . 7 1 1 A 150 150 GLY CA C 1918 45.319 46.261 -0.942 1 1 1616 . 7 1 1 A 150 150 GLY N N 1918 110.464 108.115 2.349 1 1 1617 . 7 1 1 A 151 151 THR H H 1919 8.154 7.531 0.623 1 1 1618 . 7 1 1 A 151 151 THR HA H 1919 4.109 5.118 -1.009 1 1 1623 . 7 1 1 A 151 151 THR CA C 1919 60.041 59.646 0.395 1 1 1624 . 7 1 1 A 151 151 THR CB C 1919 73.422 72.676 0.746 1 1 1626 . 7 1 1 A 151 151 THR N N 1919 111.043 109.679 1.364 1 1 1627 . 7 1 1 A 152 152 CYS H H 1920 9.088 9.273 -0.185 1 1 1628 . 7 1 1 A 152 152 CYS HA H 1920 5.362 5.492 -0.130 1 1 1631 . 7 1 1 A 152 152 CYS CA C 1920 56.990 57.101 -0.111 1 1 1632 . 7 1 1 A 152 152 CYS CB C 1920 30.740 29.189 1.551 1 1 1633 . 7 1 1 A 152 152 CYS N N 1920 118.508 121.312 -2.804 1 1 1634 . 7 1 1 A 153 153 SER H H 1921 9.102 8.929 0.173 1 1 1635 . 7 1 1 A 153 153 SER HA H 1921 4.865 4.895 -0.030 1 1 1638 . 7 1 1 A 153 153 SER CA C 1921 58.023 57.621 0.402 1 1 1639 . 7 1 1 A 153 153 SER CB C 1921 64.133 64.243 -0.110 1 1 1640 . 7 1 1 A 153 153 SER N N 1921 122.048 120.216 1.832 1 1 1641 . 7 1 1 A 154 154 VAL H H 1922 8.983 8.657 0.326 1 1 1642 . 7 1 1 A 154 154 VAL HA H 1922 4.608 4.771 -0.163 1 1 1650 . 7 1 1 A 154 154 VAL CA C 1922 60.575 59.773 0.802 1 1 1651 . 7 1 1 A 154 154 VAL CB C 1922 32.710 34.835 -2.125 1 1 1654 . 7 1 1 A 154 154 VAL N N 1922 130.262 125.044 5.218 1 1 1655 . 7 1 1 A 155 155 SER H H 1923 8.737 8.959 -0.222 1 1 1656 . 7 1 1 A 155 155 SER HA H 1923 5.680 5.560 0.120 1 1 1659 . 7 1 1 A 155 155 SER CA C 1923 55.991 56.256 -0.265 1 1 1660 . 7 1 1 A 155 155 SER CB C 1923 66.306 66.330 -0.024 1 1 1661 . 7 1 1 A 155 155 SER N N 1923 121.504 119.013 2.491 1 1 1662 . 7 1 1 A 156 156 TYR H H 1924 9.061 8.974 0.087 1 1 1663 . 7 1 1 A 156 156 TYR HA H 1924 5.790 5.568 0.222 1 1 1671 . 7 1 1 A 156 156 TYR CA C 1924 55.118 55.883 -0.765 1 1 1672 . 7 1 1 A 156 156 TYR CB C 1924 42.344 41.745 0.599 1 1 1675 . 7 1 1 A 156 156 TYR N N 1924 121.858 117.742 4.116 1 1 1676 . 7 1 1 A 157 157 LEU H H 1925 7.505 9.095 -1.590 1 1 1677 . 7 1 1 A 157 157 LEU HA H 1925 4.996 4.713 0.283 1 1 1687 . 7 1 1 A 157 157 LEU CA C 1925 50.476 51.119 -0.643 1 1 1688 . 7 1 1 A 157 157 LEU CB C 1925 43.334 43.918 -0.584 1 1 1692 . 7 1 1 A 157 157 LEU N N 1925 123.272 121.079 2.193 1 1 1693 . 7 1 1 A 158 158 PRO HA H 1926 4.691 4.925 -0.234 1 1 1700 . 7 1 1 A 158 158 PRO CA C 1926 61.808 62.509 -0.701 1 1 1701 . 7 1 1 A 158 158 PRO CB C 1926 32.551 33.466 -0.915 1 1 1704 . 7 1 1 A 159 159 VAL H H 1927 8.388 8.294 0.094 1 1 1705 . 7 1 1 A 159 159 VAL HA H 1927 4.510 4.472 0.038 1 1 1713 . 7 1 1 A 159 159 VAL CA C 1927 61.778 61.596 0.182 1 1 1714 . 7 1 1 A 159 159 VAL CB C 1927 32.432 34.047 -1.615 1 1 1717 . 7 1 1 A 159 159 VAL N N 1927 115.680 116.768 -1.088 1 1 1718 . 7 1 1 A 160 160 LEU H H 1928 6.931 7.782 -0.851 1 1 1719 . 7 1 1 A 160 160 LEU HA H 1928 4.931 4.849 0.082 1 1 1729 . 7 1 1 A 160 160 LEU CA C 1928 51.971 51.368 0.603 1 1 1730 . 7 1 1 A 160 160 LEU CB C 1928 45.905 44.523 1.382 1 1 1734 . 7 1 1 A 160 160 LEU N N 1928 120.258 123.537 -3.279 1 1 1735 . 7 1 1 A 161 161 PRO HA H 1929 4.317 4.824 -0.507 1 1 1742 . 7 1 1 A 161 161 PRO CA C 1929 62.809 62.892 -0.083 1 1 1743 . 7 1 1 A 161 161 PRO CB C 1929 32.662 33.129 -0.467 1 1 1746 . 7 1 1 A 162 162 GLY H H 1930 8.916 8.307 0.609 1 1 1747 . 7 1 1 A 162 162 GLY HA2 H 1930 4.461 4.183 0.278 1 1 1748 . 7 1 1 A 162 162 GLY HA3 H 1930 3.852 4.207 -0.355 1 1 1749 . 7 1 1 A 162 162 GLY CA C 1930 44.496 44.611 -0.115 1 1 1750 . 7 1 1 A 162 162 GLY N N 1930 107.609 107.320 0.289 1 1 1751 . 7 1 1 A 163 163 ASP H H 1931 8.245 8.379 -0.134 1 1 1752 . 7 1 1 A 163 163 ASP HA H 1931 5.565 5.551 0.014 1 1 1755 . 7 1 1 A 163 163 ASP CA C 1931 53.628 53.035 0.593 1 1 1756 . 7 1 1 A 163 163 ASP CB C 1931 41.058 43.121 -2.063 1 1 1757 . 7 1 1 A 163 163 ASP N N 1931 121.979 121.710 0.269 1 1 1758 . 7 1 1 A 164 164 TYR H H 1932 9.606 9.434 0.172 1 1 1759 . 7 1 1 A 164 164 TYR HA H 1932 4.896 5.275 -0.379 1 1 1767 . 7 1 1 A 164 164 TYR CA C 1932 56.955 55.973 0.982 1 1 1768 . 7 1 1 A 164 164 TYR CB C 1932 40.339 41.292 -0.953 1 1 1771 . 7 1 1 A 164 164 TYR N N 1932 125.257 122.648 2.609 1 1 1772 . 7 1 1 A 165 165 SER H H 1933 9.095 9.327 -0.232 1 1 1773 . 7 1 1 A 165 165 SER HA H 1933 5.500 5.266 0.234 1 1 1776 . 7 1 1 A 165 165 SER CA C 1933 56.509 57.842 -1.333 1 1 1777 . 7 1 1 A 165 165 SER CB C 1933 64.486 63.968 0.518 1 1 1778 . 7 1 1 A 165 165 SER N N 1933 119.162 119.805 -0.643 1 1 1779 . 7 1 1 A 166 166 ILE H H 1934 9.598 9.659 -0.061 1 1 1780 . 7 1 1 A 166 166 ILE HA H 1934 4.541 4.885 -0.344 1 1 1790 . 7 1 1 A 166 166 ILE CA C 1934 61.080 60.059 1.021 1 1 1791 . 7 1 1 A 166 166 ILE CB C 1934 39.282 39.049 0.233 1 1 1795 . 7 1 1 A 166 166 ILE N N 1934 128.701 128.508 0.193 1 1 1796 . 7 1 1 A 167 167 LEU H H 1935 9.359 9.316 0.043 1 1 1797 . 7 1 1 A 167 167 LEU HA H 1935 4.779 5.158 -0.379 1 1 1807 . 7 1 1 A 167 167 LEU CA C 1935 55.921 53.285 2.636 1 1 1808 . 7 1 1 A 167 167 LEU CB C 1935 42.473 45.028 -2.555 1 1 1811 . 7 1 1 A 167 167 LEU N N 1935 131.315 130.637 0.678 1 1 1812 . 7 1 1 A 168 168 VAL H H 1936 9.425 8.749 0.676 1 1 1813 . 7 1 1 A 168 168 VAL HA H 1936 4.617 4.888 -0.271 1 1 1821 . 7 1 1 A 168 168 VAL CA C 1936 61.418 60.841 0.577 1 1 1822 . 7 1 1 A 168 168 VAL CB C 1936 33.616 34.878 -1.262 1 1 1824 . 7 1 1 A 168 168 VAL N N 1936 126.961 126.071 0.890 1 1 1825 . 7 1 1 A 169 169 LYS H H 1937 8.643 8.220 0.423 1 1 1826 . 7 1 1 A 169 169 LYS HA H 1937 5.067 4.757 0.310 1 1 1835 . 7 1 1 A 169 169 LYS CA C 1937 53.949 55.660 -1.711 1 1 1836 . 7 1 1 A 169 169 LYS CB C 1937 36.691 36.368 0.323 1 1 1840 . 7 1 1 A 169 169 LYS N N 1937 124.773 127.150 -2.377 1 1 1841 . 7 1 1 A 170 170 TYR H H 1938 8.877 9.372 -0.495 1 1 1842 . 7 1 1 A 170 170 TYR HA H 1938 5.137 5.010 0.127 1 1 1849 . 7 1 1 A 170 170 TYR CA C 1938 57.034 57.644 -0.610 1 1 1850 . 7 1 1 A 170 170 TYR CB C 1938 42.105 41.892 0.213 1 1 1853 . 7 1 1 A 170 170 TYR N N 1938 122.371 126.827 -4.456 1 1 1854 . 7 1 1 A 171 171 ASN H H 1939 8.933 9.858 -0.925 1 1 1855 . 7 1 1 A 171 171 ASN HA H 1939 4.405 4.472 -0.067 1 1 1860 . 7 1 1 A 171 171 ASN CA C 1939 54.512 54.255 0.257 1 1 1861 . 7 1 1 A 171 171 ASN CB C 1939 37.025 37.295 -0.270 1 1 1862 . 7 1 1 A 171 171 ASN N N 1939 129.922 126.549 3.373 1 1 1864 . 7 1 1 A 172 172 GLU H H 1940 8.857 8.794 0.063 1 1 1865 . 7 1 1 A 172 172 GLU HA H 1940 3.511 4.072 -0.561 1 1 1870 . 7 1 1 A 172 172 GLU CA C 1940 57.910 57.638 0.272 1 1 1871 . 7 1 1 A 172 172 GLU CB C 1940 27.139 27.474 -0.335 1 1 1873 . 7 1 1 A 172 172 GLU N N 1940 107.943 116.207 -8.264 1 1 1874 . 7 1 1 A 173 173 GLN H H 1941 7.544 7.553 -0.009 1 1 1875 . 7 1 1 A 173 173 GLN HA H 1941 4.749 4.846 -0.097 1 1 1882 . 7 1 1 A 173 173 GLN CA C 1941 53.770 54.163 -0.393 1 1 1883 . 7 1 1 A 173 173 GLN CB C 1941 31.078 31.238 -0.160 1 1 1885 . 7 1 1 A 173 173 GLN N N 1941 119.865 120.096 -0.231 1 1 1887 . 7 1 1 A 174 174 HIS H H 1942 8.848 8.925 -0.077 1 1 1888 . 7 1 1 A 174 174 HIS HA H 1942 4.513 4.730 -0.217 1 1 1893 . 7 1 1 A 174 174 HIS CA C 1942 58.893 56.991 1.902 1 1 1894 . 7 1 1 A 174 174 HIS CB C 1942 32.196 30.406 1.790 1 1 1897 . 7 1 1 A 174 174 HIS N N 1942 126.437 121.925 4.512 1 1 1898 . 7 1 1 A 175 175 VAL H H 1943 8.483 8.152 0.331 1 1 1899 . 7 1 1 A 175 175 VAL HA H 1943 4.643 4.370 0.273 1 1 1907 . 7 1 1 A 175 175 VAL CA C 1943 60.025 60.888 -0.863 1 1 1908 . 7 1 1 A 175 175 VAL CB C 1943 29.439 31.673 -2.234 1 1 1911 . 7 1 1 A 175 175 VAL N N 1943 121.671 120.863 0.808 1 1 1912 . 7 1 1 A 176 176 PRO HA H 1944 4.045 4.414 -0.369 1 1 1919 . 7 1 1 A 176 176 PRO CA C 1944 64.943 63.969 0.974 1 1 1920 . 7 1 1 A 176 176 PRO CB C 1944 31.120 31.846 -0.726 1 1 1923 . 7 1 1 A 177 177 GLY H H 1945 7.579 8.213 -0.634 1 1 1924 . 7 1 1 A 177 177 GLY HA2 H 1945 3.210 3.310 -0.100 1 1 1925 . 7 1 1 A 177 177 GLY HA3 H 1945 2.311 3.755 -1.444 1 1 1926 . 7 1 1 A 177 177 GLY CA C 1945 44.184 44.803 -0.619 1 1 1927 . 7 1 1 A 177 177 GLY N N 1945 113.696 106.638 7.058 1 1 1928 . 7 1 1 A 178 178 SER H H 1946 7.469 7.149 0.320 1 1 1929 . 7 1 1 A 178 178 SER HA H 1946 4.023 3.393 0.630 1 1 1932 . 7 1 1 A 178 178 SER CA C 1946 54.593 56.000 -1.407 1 1 1933 . 7 1 1 A 178 178 SER CB C 1946 62.282 63.324 -1.042 1 1 1934 . 7 1 1 A 178 178 SER N N 1946 113.219 113.761 -0.542 1 1 1935 . 7 1 1 A 179 179 PRO HA H 1947 5.314 4.455 0.859 1 1 1942 . 7 1 1 A 179 179 PRO CA C 1947 62.198 62.216 -0.018 1 1 1943 . 7 1 1 A 179 179 PRO CB C 1947 33.923 32.031 1.892 1 1 1946 . 7 1 1 A 180 180 PHE H H 1948 9.395 8.522 0.873 1 1 1947 . 7 1 1 A 180 180 PHE HA H 1948 4.706 5.039 -0.333 1 1 1955 . 7 1 1 A 180 180 PHE CA C 1948 57.298 57.348 -0.050 1 1 1956 . 7 1 1 A 180 180 PHE CB C 1948 41.116 41.586 -0.470 1 1 1960 . 7 1 1 A 180 180 PHE N N 1948 127.510 119.074 8.436 1 1 1961 . 7 1 1 A 181 181 THR H H 1949 9.111 8.884 0.227 1 1 1962 . 7 1 1 A 181 181 THR HA H 1949 5.091 5.287 -0.196 1 1 1967 . 7 1 1 A 181 181 THR CA C 1949 62.668 61.366 1.302 1 1 1968 . 7 1 1 A 181 181 THR CB C 1949 70.354 70.448 -0.094 1 1 1970 . 7 1 1 A 181 181 THR N N 1949 120.325 115.319 5.006 1 1 1971 . 7 1 1 A 182 182 ALA H H 1950 8.992 9.300 -0.308 1 1 1972 . 7 1 1 A 182 182 ALA HA H 1950 4.521 5.266 -0.745 1 1 1976 . 7 1 1 A 182 182 ALA CA C 1950 50.080 50.433 -0.353 1 1 1977 . 7 1 1 A 182 182 ALA CB C 1950 21.717 20.521 1.196 1 1 1978 . 7 1 1 A 182 182 ALA N N 1950 130.794 129.870 0.924 1 1 1979 . 7 1 1 A 183 183 ARG H H 1951 7.764 8.973 -1.209 1 1 1980 . 7 1 1 A 183 183 ARG HA H 1951 5.001 4.788 0.213 1 1 1988 . 7 1 1 A 183 183 ARG CA C 1951 55.116 55.729 -0.613 1 1 1989 . 7 1 1 A 183 183 ARG CB C 1951 30.631 31.008 -0.377 1 1 1992 . 7 1 1 A 183 183 ARG N N 1951 121.920 124.721 -2.801 1 1 1994 . 7 1 1 A 184 184 VAL H H 1952 9.121 9.360 -0.239 1 1 1995 . 7 1 1 A 184 184 VAL HA H 1952 4.865 4.804 0.061 1 1 2003 . 7 1 1 A 184 184 VAL CA C 1952 60.375 61.295 -0.920 1 1 2004 . 7 1 1 A 184 184 VAL CB C 1952 32.179 33.559 -1.380 1 1 2007 . 7 1 1 A 184 184 VAL N N 1952 125.421 127.056 -1.635 1 1 2008 . 7 1 1 A 185 185 THR H H 1953 8.799 8.736 0.063 1 1 2009 . 7 1 1 A 185 185 THR HA H 1953 4.829 5.121 -0.292 1 1 2014 . 7 1 1 A 185 185 THR CA C 1953 60.316 59.812 0.504 1 1 2015 . 7 1 1 A 185 185 THR CB C 1953 70.825 71.649 -0.824 1 1 2017 . 7 1 1 A 185 185 THR N N 1953 121.794 116.036 5.758 1 1 2018 . 7 1 1 A 186 186 GLY H H 1954 8.586 8.620 -0.034 1 1 2019 . 7 1 1 A 186 186 GLY HA2 H 1954 4.261 4.094 0.167 1 1 2020 . 7 1 1 A 186 186 GLY HA3 H 1954 4.033 4.098 -0.065 1 1 2021 . 7 1 1 A 186 186 GLY CA C 1954 45.038 45.256 -0.218 1 1 2022 . 7 1 1 A 186 186 GLY N N 1954 107.588 108.138 -0.550 1 1 2023 . 7 1 1 A 187 187 ASP H H 1955 8.386 9.047 -0.661 1 1 2024 . 7 1 1 A 187 187 ASP HA H 1955 4.772 4.480 0.292 1 1 2027 . 7 1 1 A 187 187 ASP CA C 1955 53.909 55.922 -2.013 1 1 2028 . 7 1 1 A 187 187 ASP CB C 1955 41.510 41.055 0.455 1 1 2029 . 7 1 1 A 187 187 ASP N N 1955 121.829 121.474 0.355 1 1 4 . 8 1 1 A 2 2 ALA HA H -2 4.368 4.391 -0.023 1 1 8 . 8 1 1 A 2 2 ALA CA C -2 52.604 51.595 1.009 1 1 9 . 8 1 1 A 2 2 ALA CB C -2 19.551 19.565 -0.014 1 1 32 . 8 1 1 A 5 5 PRO HA H 1773 4.433 4.824 -0.391 1 1 39 . 8 1 1 A 5 5 PRO CA C 1773 63.017 62.577 0.440 1 1 40 . 8 1 1 A 5 5 PRO CB C 1773 32.155 33.012 -0.857 1 1 43 . 8 1 1 A 6 6 GLU H H 1774 8.495 8.893 -0.398 1 1 44 . 8 1 1 A 6 6 GLU HA H 1774 4.242 4.883 -0.641 1 1 49 . 8 1 1 A 6 6 GLU CA C 1774 56.735 55.205 1.530 1 1 50 . 8 1 1 A 6 6 GLU CB C 1774 30.401 34.063 -3.662 1 1 52 . 8 1 1 A 6 6 GLU N N 1774 122.494 120.802 1.692 1 1 53 . 8 1 1 A 7 7 ARG H H 1775 8.275 8.818 -0.543 1 1 54 . 8 1 1 A 7 7 ARG HA H 1775 4.648 4.994 -0.346 1 1 61 . 8 1 1 A 7 7 ARG CA C 1775 53.827 53.638 0.189 1 1 62 . 8 1 1 A 7 7 ARG CB C 1775 30.417 33.344 -2.927 1 1 65 . 8 1 1 A 7 7 ARG N N 1775 124.017 122.368 1.649 1 1 66 . 8 1 1 A 8 8 PRO HA H 1776 4.433 4.921 -0.488 1 1 73 . 8 1 1 A 8 8 PRO CA C 1776 63.036 62.569 0.467 1 1 74 . 8 1 1 A 8 8 PRO CB C 1776 32.201 32.860 -0.659 1 1 77 . 8 1 1 A 9 9 LEU H H 1777 8.349 8.706 -0.357 1 1 78 . 8 1 1 A 9 9 LEU HA H 1777 4.365 4.616 -0.251 1 1 88 . 8 1 1 A 9 9 LEU CA C 1777 55.275 54.625 0.650 1 1 89 . 8 1 1 A 9 9 LEU CB C 1777 42.376 42.080 0.296 1 1 93 . 8 1 1 A 9 9 LEU N N 1777 123.820 120.896 2.924 1 1 94 . 8 1 1 A 10 10 VAL H H 1778 7.989 7.712 0.277 1 1 95 . 8 1 1 A 10 10 VAL HA H 1778 4.182 4.447 -0.265 1 1 103 . 8 1 1 A 10 10 VAL CA C 1778 62.141 60.769 1.372 1 1 104 . 8 1 1 A 10 10 VAL CB C 1778 33.175 34.745 -1.570 1 1 106 . 8 1 1 A 10 10 VAL N N 1778 121.714 119.645 2.069 1 1 107 . 8 1 1 A 11 11 GLY H H 1779 8.450 8.505 -0.055 1 1 108 . 8 1 1 A 11 11 GLY HA2 H 1779 4.002 4.056 -0.054 1 1 109 . 8 1 1 A 11 11 GLY HA3 H 1779 4.002 4.056 -0.054 1 1 110 . 8 1 1 A 11 11 GLY CA C 1779 45.297 44.927 0.370 1 1 111 . 8 1 1 A 11 11 GLY N N 1779 113.826 115.846 -2.020 1 1 112 . 8 1 1 A 12 12 VAL H H 1780 8.013 8.264 -0.251 1 1 113 . 8 1 1 A 12 12 VAL HA H 1780 4.136 4.770 -0.634 1 1 121 . 8 1 1 A 12 12 VAL CA C 1780 62.466 60.211 2.255 1 1 122 . 8 1 1 A 12 12 VAL CB C 1780 32.752 35.336 -2.584 1 1 125 . 8 1 1 A 12 12 VAL N N 1780 120.109 119.506 0.603 1 1 126 . 8 1 1 A 13 13 ASN H H 1781 8.528 8.678 -0.150 1 1 127 . 8 1 1 A 13 13 ASN HA H 1781 4.712 4.844 -0.132 1 1 132 . 8 1 1 A 13 13 ASN CA C 1781 53.485 53.019 0.466 1 1 133 . 8 1 1 A 13 13 ASN CB C 1781 38.996 39.231 -0.235 1 1 134 . 8 1 1 A 13 13 ASN N N 1781 122.648 125.463 -2.815 1 1 136 . 8 1 1 A 14 14 GLY H H 1782 8.283 7.864 0.419 1 1 137 . 8 1 1 A 14 14 GLY HA2 H 1782 3.929 4.026 -0.097 1 1 138 . 8 1 1 A 14 14 GLY HA3 H 1782 3.929 4.030 -0.101 1 1 139 . 8 1 1 A 14 14 GLY CA C 1782 45.531 45.197 0.334 1 1 140 . 8 1 1 A 14 14 GLY N N 1782 110.229 108.196 2.033 1 1 141 . 8 1 1 A 15 15 LEU H H 1783 7.925 8.415 -0.490 1 1 142 . 8 1 1 A 15 15 LEU HA H 1783 4.340 4.744 -0.404 1 1 152 . 8 1 1 A 15 15 LEU CA C 1783 55.045 53.066 1.979 1 1 153 . 8 1 1 A 15 15 LEU CB C 1783 42.682 45.261 -2.579 1 1 157 . 8 1 1 A 15 15 LEU N N 1783 122.626 118.592 4.034 1 1 158 . 8 1 1 A 16 16 ASP H H 1784 8.360 9.158 -0.798 1 1 159 . 8 1 1 A 16 16 ASP HA H 1784 4.747 4.471 0.276 1 1 162 . 8 1 1 A 16 16 ASP CA C 1784 53.939 55.949 -2.010 1 1 163 . 8 1 1 A 16 16 ASP CB C 1784 41.150 40.442 0.708 1 1 164 . 8 1 1 A 16 16 ASP N N 1784 122.868 118.961 3.907 1 1 165 . 8 1 1 A 17 17 VAL H H 1785 8.201 8.445 -0.244 1 1 166 . 8 1 1 A 17 17 VAL HA H 1785 4.237 3.854 0.383 1 1 174 . 8 1 1 A 17 17 VAL CA C 1785 62.881 64.843 -1.962 1 1 175 . 8 1 1 A 17 17 VAL CB C 1785 31.967 31.517 0.450 1 1 178 . 8 1 1 A 17 17 VAL N N 1785 121.110 118.094 3.016 1 1 179 . 8 1 1 A 18 18 THR H H 1786 8.291 7.768 0.523 1 1 180 . 8 1 1 A 18 18 THR HA H 1786 4.466 4.095 0.371 1 1 185 . 8 1 1 A 18 18 THR CA C 1786 62.388 64.079 -1.691 1 1 186 . 8 1 1 A 18 18 THR CB C 1786 69.719 68.895 0.824 1 1 188 . 8 1 1 A 18 18 THR N N 1786 115.267 115.641 -0.374 1 1 189 . 8 1 1 A 19 19 SER H H 1787 8.148 7.969 0.179 1 1 190 . 8 1 1 A 19 19 SER HA H 1787 4.542 4.601 -0.059 1 1 193 . 8 1 1 A 19 19 SER CA C 1787 59.096 57.916 1.180 1 1 194 . 8 1 1 A 19 19 SER CB C 1787 63.993 62.327 1.666 1 1 195 . 8 1 1 A 19 19 SER N N 1787 118.576 115.367 3.209 1 1 196 . 8 1 1 A 20 20 LEU H H 1788 8.263 7.375 0.888 1 1 197 . 8 1 1 A 20 20 LEU HA H 1788 4.243 4.843 -0.600 1 1 207 . 8 1 1 A 20 20 LEU CA C 1788 54.087 54.046 0.041 1 1 208 . 8 1 1 A 20 20 LEU CB C 1788 43.006 44.453 -1.447 1 1 212 . 8 1 1 A 20 20 LEU N N 1788 125.834 125.494 0.340 1 1 213 . 8 1 1 A 21 21 ARG H H 1789 8.191 7.955 0.236 1 1 214 . 8 1 1 A 21 21 ARG HA H 1789 4.080 4.293 -0.213 1 1 222 . 8 1 1 A 21 21 ARG CA C 1789 54.894 54.214 0.680 1 1 223 . 8 1 1 A 21 21 ARG CB C 1789 30.881 30.514 0.367 1 1 226 . 8 1 1 A 21 21 ARG N N 1789 127.213 127.500 -0.287 1 1 228 . 8 1 1 A 22 22 PRO HA H 1790 4.441 4.641 -0.200 1 1 233 . 8 1 1 A 22 22 PRO CA C 1790 62.882 62.528 0.354 1 1 234 . 8 1 1 A 22 22 PRO CB C 1790 32.204 32.074 0.130 1 1 237 . 8 1 1 A 23 23 PHE H H 1791 8.336 8.313 0.023 1 1 238 . 8 1 1 A 23 23 PHE HA H 1791 4.701 5.091 -0.390 1 1 246 . 8 1 1 A 23 23 PHE CA C 1791 57.504 56.810 0.694 1 1 247 . 8 1 1 A 23 23 PHE CB C 1791 42.192 42.312 -0.120 1 1 251 . 8 1 1 A 23 23 PHE N N 1791 122.145 122.447 -0.302 1 1 252 . 8 1 1 A 24 24 ASP H H 1792 6.954 8.936 -1.982 1 1 253 . 8 1 1 A 24 24 ASP HA H 1792 5.039 5.229 -0.190 1 1 256 . 8 1 1 A 24 24 ASP CA C 1792 52.871 52.380 0.491 1 1 257 . 8 1 1 A 24 24 ASP CB C 1792 44.696 44.680 0.016 1 1 258 . 8 1 1 A 24 24 ASP N N 1792 127.481 125.774 1.707 1 1 259 . 8 1 1 A 25 25 LEU H H 1793 8.372 8.709 -0.337 1 1 260 . 8 1 1 A 25 25 LEU HA H 1793 4.336 4.916 -0.580 1 1 270 . 8 1 1 A 25 25 LEU CA C 1793 54.860 53.219 1.641 1 1 271 . 8 1 1 A 25 25 LEU CB C 1793 47.575 46.433 1.142 1 1 274 . 8 1 1 A 25 25 LEU N N 1793 123.241 122.042 1.199 1 1 275 . 8 1 1 A 26 26 VAL H H 1794 8.489 8.969 -0.480 1 1 276 . 8 1 1 A 26 26 VAL HA H 1794 4.903 5.126 -0.223 1 1 284 . 8 1 1 A 26 26 VAL CA C 1794 61.669 59.575 2.094 1 1 285 . 8 1 1 A 26 26 VAL CB C 1794 32.458 35.077 -2.619 1 1 288 . 8 1 1 A 26 26 VAL N N 1794 128.849 121.033 7.816 1 1 289 . 8 1 1 A 27 27 ILE H H 1795 9.101 9.209 -0.108 1 1 290 . 8 1 1 A 27 27 ILE HA H 1795 4.701 4.488 0.213 1 1 300 . 8 1 1 A 27 27 ILE CA C 1795 57.433 57.507 -0.074 1 1 301 . 8 1 1 A 27 27 ILE CB C 1795 41.865 41.488 0.377 1 1 305 . 8 1 1 A 27 27 ILE N N 1795 127.511 127.933 -0.422 1 1 306 . 8 1 1 A 28 28 PRO HA H 1796 4.838 4.613 0.225 1 1 313 . 8 1 1 A 28 28 PRO CA C 1796 62.406 63.027 -0.621 1 1 314 . 8 1 1 A 28 28 PRO CB C 1796 30.684 29.670 1.014 1 1 317 . 8 1 1 A 29 29 PHE H H 1797 8.255 8.172 0.083 1 1 318 . 8 1 1 A 29 29 PHE HA H 1797 4.151 4.773 -0.622 1 1 326 . 8 1 1 A 29 29 PHE CA C 1797 60.405 58.313 2.092 1 1 327 . 8 1 1 A 29 29 PHE CB C 1797 41.395 40.678 0.717 1 1 331 . 8 1 1 A 29 29 PHE N N 1797 128.572 121.896 6.676 1 1 332 . 8 1 1 A 30 30 THR H H 1798 7.433 7.864 -0.431 1 1 333 . 8 1 1 A 30 30 THR HA H 1798 4.108 4.952 -0.844 1 1 338 . 8 1 1 A 30 30 THR CA C 1798 61.473 61.332 0.141 1 1 339 . 8 1 1 A 30 30 THR CB C 1798 69.324 70.677 -1.353 1 1 341 . 8 1 1 A 30 30 THR N N 1798 123.124 119.628 3.496 1 1 342 . 8 1 1 A 31 31 ILE H H 1799 8.402 9.148 -0.746 1 1 343 . 8 1 1 A 31 31 ILE HA H 1799 3.653 4.901 -1.248 1 1 353 . 8 1 1 A 31 31 ILE CA C 1799 61.802 60.330 1.472 1 1 354 . 8 1 1 A 31 31 ILE CB C 1799 38.548 39.535 -0.987 1 1 358 . 8 1 1 A 31 31 ILE N N 1799 128.616 127.811 0.805 1 1 359 . 8 1 1 A 32 32 LYS H H 1800 7.742 8.802 -1.060 1 1 360 . 8 1 1 A 32 32 LYS HA H 1800 4.558 4.590 -0.032 1 1 365 . 8 1 1 A 32 32 LYS CA C 1800 56.566 55.762 0.804 1 1 366 . 8 1 1 A 32 32 LYS CB C 1800 31.982 34.093 -2.111 1 1 368 . 8 1 1 A 32 32 LYS N N 1800 128.656 126.934 1.722 1 1 369 . 8 1 1 A 33 33 LYS HA H 1801 4.531 3.939 0.592 1 1 378 . 8 1 1 A 33 33 LYS CA C 1801 56.310 58.126 -1.816 1 1 379 . 8 1 1 A 33 33 LYS CB C 1801 33.027 30.360 2.667 1 1 383 . 8 1 1 A 34 34 GLY H H 1802 8.088 8.191 -0.103 1 1 384 . 8 1 1 A 34 34 GLY HA2 H 1802 4.159 3.907 0.252 1 1 385 . 8 1 1 A 34 34 GLY HA3 H 1802 3.712 3.992 -0.280 1 1 386 . 8 1 1 A 34 34 GLY CA C 1802 45.302 44.692 0.610 1 1 387 . 8 1 1 A 34 34 GLY N N 1802 110.338 107.998 2.340 1 1 388 . 8 1 1 A 35 35 GLU H H 1803 8.219 8.158 0.061 1 1 389 . 8 1 1 A 35 35 GLU HA H 1803 4.692 4.996 -0.304 1 1 394 . 8 1 1 A 35 35 GLU CA C 1803 55.160 54.968 0.192 1 1 395 . 8 1 1 A 35 35 GLU CB C 1803 32.407 32.787 -0.380 1 1 397 . 8 1 1 A 35 35 GLU N N 1803 119.576 120.241 -0.665 1 1 398 . 8 1 1 A 36 36 ILE H H 1804 8.869 8.773 0.096 1 1 399 . 8 1 1 A 36 36 ILE HA H 1804 5.468 5.227 0.241 1 1 409 . 8 1 1 A 36 36 ILE CA C 1804 58.861 58.977 -0.116 1 1 410 . 8 1 1 A 36 36 ILE CB C 1804 41.007 41.643 -0.636 1 1 414 . 8 1 1 A 36 36 ILE N N 1804 128.141 125.602 2.539 1 1 415 . 8 1 1 A 37 37 THR H H 1805 9.075 8.900 0.175 1 1 416 . 8 1 1 A 37 37 THR HA H 1805 4.703 5.162 -0.459 1 1 421 . 8 1 1 A 37 37 THR CA C 1805 59.932 60.014 -0.082 1 1 422 . 8 1 1 A 37 37 THR CB C 1805 72.441 72.454 -0.013 1 1 424 . 8 1 1 A 37 37 THR N N 1805 119.846 116.899 2.947 1 1 425 . 8 1 1 A 38 38 GLY H H 1806 8.468 8.374 0.094 1 1 426 . 8 1 1 A 38 38 GLY HA2 H 1806 5.076 4.279 0.797 1 1 427 . 8 1 1 A 38 38 GLY HA3 H 1806 3.503 4.299 -0.796 1 1 428 . 8 1 1 A 38 38 GLY CA C 1806 45.593 45.799 -0.206 1 1 429 . 8 1 1 A 38 38 GLY N N 1806 107.815 108.448 -0.633 1 1 430 . 8 1 1 A 39 39 GLU H H 1807 8.519 8.655 -0.136 1 1 431 . 8 1 1 A 39 39 GLU HA H 1807 4.713 5.132 -0.419 1 1 436 . 8 1 1 A 39 39 GLU CA C 1807 56.936 55.523 1.413 1 1 437 . 8 1 1 A 39 39 GLU CB C 1807 34.937 33.755 1.182 1 1 439 . 8 1 1 A 39 39 GLU N N 1807 120.173 120.098 0.075 1 1 440 . 8 1 1 A 40 40 VAL H H 1808 9.156 9.366 -0.210 1 1 441 . 8 1 1 A 40 40 VAL HA H 1808 4.778 4.730 0.048 1 1 449 . 8 1 1 A 40 40 VAL CA C 1808 60.574 61.336 -0.762 1 1 450 . 8 1 1 A 40 40 VAL CB C 1808 34.168 32.832 1.336 1 1 452 . 8 1 1 A 40 40 VAL N N 1808 126.330 127.607 -1.277 1 1 453 . 8 1 1 A 41 41 ARG H H 1809 9.044 9.160 -0.116 1 1 454 . 8 1 1 A 41 41 ARG HA H 1809 4.778 4.837 -0.059 1 1 462 . 8 1 1 A 41 41 ARG CA C 1809 55.317 54.055 1.262 1 1 463 . 8 1 1 A 41 41 ARG CB C 1809 31.940 33.223 -1.283 1 1 466 . 8 1 1 A 41 41 ARG N N 1809 127.098 126.361 0.737 1 1 468 . 8 1 1 A 42 42 MET H H 1810 8.264 8.801 -0.537 1 1 469 . 8 1 1 A 42 42 MET HA H 1810 4.050 4.417 -0.367 1 1 477 . 8 1 1 A 42 42 MET CA C 1810 53.716 54.175 -0.459 1 1 478 . 8 1 1 A 42 42 MET CB C 1810 32.779 32.433 0.346 1 1 481 . 8 1 1 A 42 42 MET N N 1810 123.461 123.065 0.396 1 1 482 . 8 1 1 A 43 43 PRO HA H 1811 4.179 4.359 -0.180 1 1 489 . 8 1 1 A 43 43 PRO CA C 1811 66.422 64.083 2.339 1 1 490 . 8 1 1 A 43 43 PRO CB C 1811 31.462 31.672 -0.210 1 1 493 . 8 1 1 A 44 44 SER H H 1812 8.860 7.750 1.110 1 1 494 . 8 1 1 A 44 44 SER HA H 1812 5.516 4.254 1.262 1 1 497 . 8 1 1 A 44 44 SER CA C 1812 59.937 58.714 1.223 1 1 498 . 8 1 1 A 44 44 SER CB C 1812 62.755 63.576 -0.821 1 1 499 . 8 1 1 A 44 44 SER N N 1812 112.267 110.275 1.992 1 1 500 . 8 1 1 A 45 45 GLY H H 1813 8.368 8.934 -0.566 1 1 501 . 8 1 1 A 45 45 GLY HA2 H 1813 4.461 3.911 0.550 1 1 502 . 8 1 1 A 45 45 GLY HA3 H 1813 3.569 3.920 -0.351 1 1 503 . 8 1 1 A 45 45 GLY CA C 1813 44.525 46.505 -1.980 1 1 504 . 8 1 1 A 45 45 GLY N N 1813 112.727 112.185 0.542 1 1 505 . 8 1 1 A 46 46 LYS H H 1814 7.126 7.455 -0.329 1 1 506 . 8 1 1 A 46 46 LYS HA H 1814 4.206 4.904 -0.698 1 1 515 . 8 1 1 A 46 46 LYS CA C 1814 57.460 54.578 2.882 1 1 516 . 8 1 1 A 46 46 LYS CB C 1814 33.453 36.319 -2.866 1 1 520 . 8 1 1 A 46 46 LYS N N 1814 122.101 114.414 7.687 1 1 521 . 8 1 1 A 47 47 VAL H H 1815 8.056 8.611 -0.555 1 1 522 . 8 1 1 A 47 47 VAL HA H 1815 5.400 5.135 0.265 1 1 530 . 8 1 1 A 47 47 VAL CA C 1815 60.048 59.471 0.577 1 1 531 . 8 1 1 A 47 47 VAL CB C 1815 35.044 36.155 -1.111 1 1 534 . 8 1 1 A 47 47 VAL N N 1815 118.680 115.525 3.155 1 1 535 . 8 1 1 A 48 48 ALA H H 1816 9.110 8.501 0.609 1 1 536 . 8 1 1 A 48 48 ALA HA H 1816 4.804 4.905 -0.101 1 1 540 . 8 1 1 A 48 48 ALA CA C 1816 50.808 51.288 -0.480 1 1 541 . 8 1 1 A 48 48 ALA CB C 1816 24.108 23.845 0.263 1 1 542 . 8 1 1 A 48 48 ALA N N 1816 128.274 123.626 4.648 1 1 543 . 8 1 1 A 49 49 GLN H H 1817 8.725 8.463 0.262 1 1 544 . 8 1 1 A 49 49 GLN HA H 1817 5.069 4.867 0.202 1 1 551 . 8 1 1 A 49 49 GLN CA C 1817 53.524 52.368 1.156 1 1 552 . 8 1 1 A 49 49 GLN CB C 1817 30.432 29.732 0.700 1 1 554 . 8 1 1 A 49 49 GLN N N 1817 120.102 118.341 1.761 1 1 556 . 8 1 1 A 50 50 PRO HA H 1818 5.136 4.853 0.283 1 1 563 . 8 1 1 A 50 50 PRO CA C 1818 61.966 62.488 -0.522 1 1 564 . 8 1 1 A 50 50 PRO CB C 1818 32.722 32.561 0.161 1 1 567 . 8 1 1 A 51 51 THR H H 1819 9.072 8.669 0.403 1 1 568 . 8 1 1 A 51 51 THR HA H 1819 4.566 4.809 -0.243 1 1 573 . 8 1 1 A 51 51 THR CA C 1819 62.695 61.047 1.648 1 1 574 . 8 1 1 A 51 51 THR CB C 1819 70.056 69.695 0.361 1 1 576 . 8 1 1 A 51 51 THR N N 1819 117.512 113.856 3.656 1 1 577 . 8 1 1 A 52 52 ILE H H 1820 8.900 9.340 -0.440 1 1 578 . 8 1 1 A 52 52 ILE HA H 1820 4.905 4.843 0.062 1 1 588 . 8 1 1 A 52 52 ILE CA C 1820 60.869 60.035 0.834 1 1 589 . 8 1 1 A 52 52 ILE CB C 1820 39.670 39.360 0.310 1 1 593 . 8 1 1 A 52 52 ILE N N 1820 129.513 129.889 -0.376 1 1 594 . 8 1 1 A 53 53 THR H H 1821 9.200 9.464 -0.264 1 1 595 . 8 1 1 A 53 53 THR HA H 1821 4.541 4.862 -0.321 1 1 600 . 8 1 1 A 53 53 THR CA C 1821 61.084 61.830 -0.746 1 1 601 . 8 1 1 A 53 53 THR CB C 1821 71.410 71.335 0.075 1 1 603 . 8 1 1 A 53 53 THR N N 1821 125.271 123.975 1.296 1 1 604 . 8 1 1 A 54 54 ASP H H 1822 8.918 8.604 0.314 1 1 605 . 8 1 1 A 54 54 ASP HA H 1822 4.756 4.777 -0.021 1 1 608 . 8 1 1 A 54 54 ASP CA C 1822 53.906 54.422 -0.516 1 1 609 . 8 1 1 A 54 54 ASP CB C 1822 41.443 41.535 -0.092 1 1 610 . 8 1 1 A 54 54 ASP N N 1822 126.647 126.415 0.232 1 1 611 . 8 1 1 A 55 55 ASN H H 1823 8.342 8.602 -0.260 1 1 612 . 8 1 1 A 55 55 ASN HA H 1823 4.704 4.650 0.054 1 1 617 . 8 1 1 A 55 55 ASN CA C 1823 54.421 53.119 1.302 1 1 618 . 8 1 1 A 55 55 ASN CB C 1823 38.557 38.935 -0.378 1 1 619 . 8 1 1 A 55 55 ASN N N 1823 126.271 124.447 1.824 1 1 621 . 8 1 1 A 56 56 LYS H H 1824 9.232 7.969 1.263 1 1 622 . 8 1 1 A 56 56 LYS HA H 1824 4.099 3.934 0.165 1 1 631 . 8 1 1 A 56 56 LYS CA C 1824 58.015 57.759 0.256 1 1 632 . 8 1 1 A 56 56 LYS CB C 1824 28.691 32.224 -3.533 1 1 636 . 8 1 1 A 56 56 LYS N N 1824 115.352 118.186 -2.834 1 1 637 . 8 1 1 A 57 57 ASP H H 1825 7.905 8.078 -0.173 1 1 638 . 8 1 1 A 57 57 ASP HA H 1825 4.791 4.810 -0.019 1 1 641 . 8 1 1 A 57 57 ASP CA C 1825 52.401 53.712 -1.311 1 1 642 . 8 1 1 A 57 57 ASP CB C 1825 41.166 41.014 0.152 1 1 643 . 8 1 1 A 57 57 ASP N N 1825 119.741 119.837 -0.096 1 1 644 . 8 1 1 A 58 58 GLY H H 1826 8.930 9.067 -0.137 1 1 645 . 8 1 1 A 58 58 GLY HA2 H 1826 4.265 3.867 0.398 1 1 646 . 8 1 1 A 58 58 GLY HA3 H 1826 3.712 3.872 -0.160 1 1 647 . 8 1 1 A 58 58 GLY CA C 1826 44.870 45.628 -0.758 1 1 648 . 8 1 1 A 58 58 GLY N N 1826 109.578 108.358 1.220 1 1 649 . 8 1 1 A 59 59 THR H H 1827 8.004 7.617 0.387 1 1 650 . 8 1 1 A 59 59 THR HA H 1827 5.394 4.982 0.412 1 1 655 . 8 1 1 A 59 59 THR CA C 1827 60.262 59.368 0.894 1 1 656 . 8 1 1 A 59 59 THR CB C 1827 73.892 72.686 1.206 1 1 658 . 8 1 1 A 59 59 THR N N 1827 112.179 110.055 2.124 1 1 659 . 8 1 1 A 60 60 VAL H H 1828 8.822 9.279 -0.457 1 1 660 . 8 1 1 A 60 60 VAL HA H 1828 5.124 4.928 0.196 1 1 668 . 8 1 1 A 60 60 VAL CA C 1828 59.430 59.174 0.256 1 1 669 . 8 1 1 A 60 60 VAL CB C 1828 35.088 35.164 -0.076 1 1 672 . 8 1 1 A 60 60 VAL N N 1828 115.300 115.967 -0.667 1 1 673 . 8 1 1 A 61 61 THR H H 1829 9.115 8.807 0.308 1 1 674 . 8 1 1 A 61 61 THR HA H 1829 5.128 5.032 0.096 1 1 679 . 8 1 1 A 61 61 THR CA C 1829 61.934 61.829 0.105 1 1 680 . 8 1 1 A 61 61 THR CB C 1829 70.561 70.674 -0.113 1 1 682 . 8 1 1 A 61 61 THR N N 1829 121.210 119.385 1.825 1 1 683 . 8 1 1 A 62 62 VAL H H 1830 9.530 9.262 0.268 1 1 684 . 8 1 1 A 62 62 VAL HA H 1830 4.803 5.013 -0.210 1 1 692 . 8 1 1 A 62 62 VAL CA C 1830 60.580 60.789 -0.209 1 1 693 . 8 1 1 A 62 62 VAL CB C 1830 33.747 34.375 -0.628 1 1 696 . 8 1 1 A 62 62 VAL N N 1830 129.896 125.863 4.033 1 1 697 . 8 1 1 A 63 63 ARG H H 1831 8.879 9.100 -0.221 1 1 698 . 8 1 1 A 63 63 ARG HA H 1831 5.282 4.963 0.319 1 1 705 . 8 1 1 A 63 63 ARG CA C 1831 54.759 54.007 0.752 1 1 706 . 8 1 1 A 63 63 ARG CB C 1831 34.410 34.367 0.043 1 1 709 . 8 1 1 A 63 63 ARG N N 1831 125.701 126.111 -0.410 1 1 710 . 8 1 1 A 64 64 TYR H H 1832 8.878 8.797 0.081 1 1 711 . 8 1 1 A 64 64 TYR HA H 1832 4.888 4.895 -0.007 1 1 718 . 8 1 1 A 64 64 TYR CA C 1832 57.694 57.966 -0.272 1 1 719 . 8 1 1 A 64 64 TYR CB C 1832 42.389 42.324 0.065 1 1 722 . 8 1 1 A 64 64 TYR N N 1832 122.731 123.435 -0.704 1 1 723 . 8 1 1 A 65 65 ALA H H 1833 7.925 8.311 -0.386 1 1 724 . 8 1 1 A 65 65 ALA HA H 1833 4.736 4.514 0.222 1 1 728 . 8 1 1 A 65 65 ALA CA C 1833 47.938 48.703 -0.765 1 1 729 . 8 1 1 A 65 65 ALA CB C 1833 18.320 19.669 -1.349 1 1 730 . 8 1 1 A 65 65 ALA N N 1833 135.415 128.830 6.585 1 1 731 . 8 1 1 A 66 66 PRO HA H 1834 4.198 4.664 -0.466 1 1 738 . 8 1 1 A 66 66 PRO CA C 1834 62.701 62.301 0.400 1 1 739 . 8 1 1 A 66 66 PRO CB C 1834 34.445 33.331 1.114 1 1 742 . 8 1 1 A 67 67 SER H H 1835 9.019 8.697 0.322 1 1 743 . 8 1 1 A 67 67 SER HA H 1835 4.555 4.700 -0.145 1 1 746 . 8 1 1 A 67 67 SER CA C 1835 57.320 57.483 -0.163 1 1 747 . 8 1 1 A 67 67 SER CB C 1835 64.778 65.697 -0.919 1 1 748 . 8 1 1 A 67 67 SER N N 1835 112.422 115.379 -2.957 1 1 749 . 8 1 1 A 68 68 GLU H H 1836 7.625 7.695 -0.070 1 1 750 . 8 1 1 A 68 68 GLU HA H 1836 4.513 4.711 -0.198 1 1 755 . 8 1 1 A 68 68 GLU CA C 1836 54.777 55.310 -0.533 1 1 756 . 8 1 1 A 68 68 GLU CB C 1836 33.981 32.303 1.678 1 1 758 . 8 1 1 A 68 68 GLU N N 1836 123.025 118.148 4.877 1 1 759 . 8 1 1 A 69 69 ALA H H 1837 8.133 8.126 0.007 1 1 760 . 8 1 1 A 69 69 ALA HA H 1837 4.088 4.356 -0.268 1 1 764 . 8 1 1 A 69 69 ALA CA C 1837 51.070 51.604 -0.534 1 1 765 . 8 1 1 A 69 69 ALA CB C 1837 19.665 20.437 -0.772 1 1 766 . 8 1 1 A 69 69 ALA N N 1837 122.311 123.846 -1.535 1 1 767 . 8 1 1 A 70 70 GLY H H 1838 9.120 8.100 1.020 1 1 768 . 8 1 1 A 70 70 GLY HA2 H 1838 4.453 3.846 0.607 1 1 769 . 8 1 1 A 70 70 GLY HA3 H 1838 2.953 4.000 -1.047 1 1 770 . 8 1 1 A 70 70 GLY CA C 1838 43.362 43.490 -0.128 1 1 771 . 8 1 1 A 70 70 GLY N N 1838 107.031 105.703 1.328 1 1 772 . 8 1 1 A 71 71 LEU H H 1839 9.096 8.275 0.821 1 1 773 . 8 1 1 A 71 71 LEU HA H 1839 4.336 4.562 -0.226 1 1 783 . 8 1 1 A 71 71 LEU CA C 1839 56.657 54.731 1.926 1 1 784 . 8 1 1 A 71 71 LEU CB C 1839 42.032 43.126 -1.094 1 1 788 . 8 1 1 A 71 71 LEU N N 1839 127.931 121.468 6.463 1 1 789 . 8 1 1 A 72 72 HIS H H 1840 9.359 9.185 0.174 1 1 790 . 8 1 1 A 72 72 HIS HA H 1840 4.595 5.117 -0.522 1 1 796 . 8 1 1 A 72 72 HIS CA C 1840 54.539 53.909 0.630 1 1 797 . 8 1 1 A 72 72 HIS CB C 1840 31.421 33.747 -2.326 1 1 800 . 8 1 1 A 72 72 HIS N N 1840 128.527 125.458 3.069 1 1 802 . 8 1 1 A 73 73 GLU H H 1841 7.925 8.817 -0.892 1 1 803 . 8 1 1 A 73 73 GLU HA H 1841 5.142 5.348 -0.206 1 1 808 . 8 1 1 A 73 73 GLU CA C 1841 54.381 54.849 -0.468 1 1 809 . 8 1 1 A 73 73 GLU CB C 1841 34.043 33.948 0.095 1 1 811 . 8 1 1 A 73 73 GLU N N 1841 119.347 118.586 0.761 1 1 812 . 8 1 1 A 74 74 MET H H 1842 9.383 9.117 0.266 1 1 813 . 8 1 1 A 74 74 MET HA H 1842 5.548 5.356 0.192 1 1 821 . 8 1 1 A 74 74 MET CA C 1842 53.859 54.359 -0.500 1 1 822 . 8 1 1 A 74 74 MET CB C 1842 38.571 36.128 2.443 1 1 825 . 8 1 1 A 74 74 MET N N 1842 124.747 121.106 3.641 1 1 826 . 8 1 1 A 75 75 ASP H H 1843 9.005 9.167 -0.162 1 1 827 . 8 1 1 A 75 75 ASP HA H 1843 5.277 5.583 -0.306 1 1 830 . 8 1 1 A 75 75 ASP CA C 1843 52.774 52.892 -0.118 1 1 831 . 8 1 1 A 75 75 ASP CB C 1843 43.493 43.617 -0.124 1 1 832 . 8 1 1 A 75 75 ASP N N 1843 128.148 125.181 2.967 1 1 833 . 8 1 1 A 76 76 ILE H H 1844 9.434 8.895 0.539 1 1 834 . 8 1 1 A 76 76 ILE HA H 1844 4.672 4.876 -0.204 1 1 844 . 8 1 1 A 76 76 ILE CA C 1844 60.715 59.837 0.878 1 1 845 . 8 1 1 A 76 76 ILE CB C 1844 39.470 41.562 -2.092 1 1 849 . 8 1 1 A 76 76 ILE N N 1844 124.097 122.884 1.213 1 1 850 . 8 1 1 A 77 77 ARG H H 1845 8.888 9.095 -0.207 1 1 851 . 8 1 1 A 77 77 ARG HA H 1845 5.050 4.837 0.213 1 1 859 . 8 1 1 A 77 77 ARG CA C 1845 53.780 54.272 -0.492 1 1 860 . 8 1 1 A 77 77 ARG CB C 1845 34.564 33.571 0.993 1 1 863 . 8 1 1 A 77 77 ARG N N 1845 124.944 124.253 0.691 1 1 865 . 8 1 1 A 78 78 TYR H H 1846 8.974 9.209 -0.235 1 1 866 . 8 1 1 A 78 78 TYR HA H 1846 5.151 4.895 0.256 1 1 873 . 8 1 1 A 78 78 TYR CA C 1846 55.909 57.579 -1.670 1 1 874 . 8 1 1 A 78 78 TYR CB C 1846 41.732 40.703 1.029 1 1 877 . 8 1 1 A 78 78 TYR N N 1846 121.774 124.146 -2.372 1 1 878 . 8 1 1 A 79 79 ASP H H 1847 9.026 9.301 -0.275 1 1 879 . 8 1 1 A 79 79 ASP HA H 1847 4.127 4.197 -0.070 1 1 882 . 8 1 1 A 79 79 ASP CA C 1847 55.808 55.045 0.763 1 1 883 . 8 1 1 A 79 79 ASP CB C 1847 39.181 39.509 -0.328 1 1 884 . 8 1 1 A 79 79 ASP N N 1847 131.304 127.776 3.528 1 1 885 . 8 1 1 A 80 80 ASN H H 1848 8.608 8.554 0.054 1 1 886 . 8 1 1 A 80 80 ASN HA H 1848 3.990 4.327 -0.337 1 1 891 . 8 1 1 A 80 80 ASN CA C 1848 55.149 54.850 0.299 1 1 892 . 8 1 1 A 80 80 ASN CB C 1848 38.470 36.921 1.549 1 1 893 . 8 1 1 A 80 80 ASN N N 1848 108.490 109.518 -1.028 1 1 895 . 8 1 1 A 81 81 MET H H 1849 7.820 7.910 -0.090 1 1 896 . 8 1 1 A 81 81 MET HA H 1849 4.819 4.818 0.001 1 1 904 . 8 1 1 A 81 81 MET CA C 1849 53.852 54.593 -0.741 1 1 905 . 8 1 1 A 81 81 MET CB C 1849 34.665 34.423 0.242 1 1 908 . 8 1 1 A 81 81 MET N N 1849 121.878 119.165 2.713 1 1 909 . 8 1 1 A 82 82 HIS H H 1850 8.575 8.794 -0.219 1 1 910 . 8 1 1 A 82 82 HIS HA H 1850 4.539 4.735 -0.196 1 1 915 . 8 1 1 A 82 82 HIS CA C 1850 58.819 57.305 1.514 1 1 916 . 8 1 1 A 82 82 HIS CB C 1850 32.419 30.604 1.815 1 1 919 . 8 1 1 A 82 82 HIS N N 1850 124.291 124.821 -0.530 1 1 920 . 8 1 1 A 83 83 ILE H H 1851 8.333 8.386 -0.053 1 1 921 . 8 1 1 A 83 83 ILE HA H 1851 4.608 4.503 0.105 1 1 931 . 8 1 1 A 83 83 ILE CA C 1851 60.727 59.793 0.934 1 1 932 . 8 1 1 A 83 83 ILE CB C 1851 35.928 37.483 -1.555 1 1 936 . 8 1 1 A 83 83 ILE N N 1851 120.786 120.989 -0.203 1 1 937 . 8 1 1 A 84 84 PRO HA H 1852 4.426 4.481 -0.055 1 1 944 . 8 1 1 A 84 84 PRO CA C 1852 65.249 64.292 0.957 1 1 945 . 8 1 1 A 84 84 PRO CB C 1852 31.120 31.855 -0.735 1 1 948 . 8 1 1 A 85 85 GLY H H 1853 8.498 8.608 -0.110 1 1 949 . 8 1 1 A 85 85 GLY HA2 H 1853 4.284 3.985 0.299 1 1 950 . 8 1 1 A 85 85 GLY HA3 H 1853 3.397 4.094 -0.697 1 1 951 . 8 1 1 A 85 85 GLY CA C 1853 44.913 45.209 -0.296 1 1 952 . 8 1 1 A 85 85 GLY N N 1853 114.093 106.988 7.105 1 1 953 . 8 1 1 A 86 86 SER H H 1854 7.823 7.917 -0.094 1 1 954 . 8 1 1 A 86 86 SER HA H 1854 4.834 4.768 0.066 1 1 957 . 8 1 1 A 86 86 SER CA C 1854 55.628 54.945 0.683 1 1 958 . 8 1 1 A 86 86 SER CB C 1854 63.063 64.954 -1.891 1 1 959 . 8 1 1 A 86 86 SER N N 1854 112.722 116.595 -3.873 1 1 960 . 8 1 1 A 87 87 PRO HA H 1855 5.681 4.841 0.840 1 1 967 . 8 1 1 A 87 87 PRO CA C 1855 63.079 62.402 0.677 1 1 968 . 8 1 1 A 87 87 PRO CB C 1855 34.406 33.045 1.361 1 1 971 . 8 1 1 A 88 88 LEU H H 1856 9.168 8.674 0.494 1 1 972 . 8 1 1 A 88 88 LEU HA H 1856 4.909 5.201 -0.292 1 1 982 . 8 1 1 A 88 88 LEU CA C 1856 53.839 53.258 0.581 1 1 983 . 8 1 1 A 88 88 LEU CB C 1856 45.558 45.767 -0.209 1 1 987 . 8 1 1 A 88 88 LEU N N 1856 122.495 121.053 1.442 1 1 988 . 8 1 1 A 89 89 GLN H H 1857 9.583 8.796 0.787 1 1 989 . 8 1 1 A 89 89 GLN HA H 1857 5.508 5.426 0.082 1 1 996 . 8 1 1 A 89 89 GLN CA C 1857 54.609 54.219 0.390 1 1 997 . 8 1 1 A 89 89 GLN CB C 1857 32.840 32.664 0.176 1 1 999 . 8 1 1 A 89 89 GLN N N 1857 119.151 119.627 -0.476 1 1 1001 . 8 1 1 A 90 90 PHE H H 1858 8.600 8.883 -0.283 1 1 1002 . 8 1 1 A 90 90 PHE HA H 1858 5.095 5.177 -0.082 1 1 1010 . 8 1 1 A 90 90 PHE CA C 1858 56.161 56.273 -0.112 1 1 1011 . 8 1 1 A 90 90 PHE CB C 1858 41.411 40.962 0.449 1 1 1015 . 8 1 1 A 90 90 PHE N N 1858 118.242 118.356 -0.114 1 1 1016 . 8 1 1 A 91 91 TYR H H 1859 9.892 8.933 0.959 1 1 1017 . 8 1 1 A 91 91 TYR HA H 1859 4.790 5.021 -0.231 1 1 1024 . 8 1 1 A 91 91 TYR CA C 1859 58.205 56.610 1.595 1 1 1025 . 8 1 1 A 91 91 TYR CB C 1859 40.867 41.674 -0.807 1 1 1028 . 8 1 1 A 91 91 TYR N N 1859 127.393 122.608 4.785 1 1 1029 . 8 1 1 A 92 92 VAL H H 1860 8.072 8.234 -0.162 1 1 1030 . 8 1 1 A 92 92 VAL HA H 1860 4.377 4.680 -0.303 1 1 1038 . 8 1 1 A 92 92 VAL CA C 1860 62.583 60.535 2.048 1 1 1039 . 8 1 1 A 92 92 VAL CB C 1860 33.609 33.910 -0.301 1 1 1042 . 8 1 1 A 92 92 VAL N N 1860 132.007 126.349 5.658 1 1 1043 . 8 1 1 A 93 93 ASP H H 1861 8.438 8.462 -0.024 1 1 1044 . 8 1 1 A 93 93 ASP HA H 1861 5.024 4.669 0.355 1 1 1047 . 8 1 1 A 93 93 ASP CA C 1861 50.678 53.381 -2.703 1 1 1048 . 8 1 1 A 93 93 ASP CB C 1861 46.086 45.270 0.816 1 1 1049 . 8 1 1 A 93 93 ASP N N 1861 130.459 125.291 5.168 1 1 1050 . 8 1 1 A 94 94 TYR H H 1862 9.674 8.530 1.144 1 1 1051 . 8 1 1 A 94 94 TYR HA H 1862 4.606 4.552 0.054 1 1 1058 . 8 1 1 A 94 94 TYR CA C 1862 58.983 58.672 0.311 1 1 1059 . 8 1 1 A 94 94 TYR CB C 1862 39.727 38.986 0.741 1 1 1062 . 8 1 1 A 94 94 TYR N N 1862 120.069 122.931 -2.862 1 1 1063 . 8 1 1 A 95 95 VAL H H 1863 8.371 9.136 -0.765 1 1 1064 . 8 1 1 A 95 95 VAL HA H 1863 3.654 4.009 -0.355 1 1 1072 . 8 1 1 A 95 95 VAL CA C 1863 64.922 64.116 0.806 1 1 1073 . 8 1 1 A 95 95 VAL CB C 1863 32.270 31.983 0.287 1 1 1076 . 8 1 1 A 95 95 VAL N N 1863 121.770 124.220 -2.450 1 1 1077 . 8 1 1 A 96 96 ASN H H 1864 8.729 7.799 0.930 1 1 1078 . 8 1 1 A 96 96 ASN HA H 1864 4.901 4.733 0.168 1 1 1083 . 8 1 1 A 96 96 ASN CA C 1864 52.652 54.730 -2.078 1 1 1084 . 8 1 1 A 96 96 ASN CB C 1864 38.160 38.940 -0.780 1 1 1085 . 8 1 1 A 96 96 ASN N N 1864 120.006 119.047 0.959 1 1 1087 . 8 1 1 A 97 97 CYS H H 1865 7.875 7.260 0.615 1 1 1088 . 8 1 1 A 97 97 CYS HA H 1865 4.575 4.300 0.275 1 1 1091 . 8 1 1 A 97 97 CYS CA C 1865 57.009 59.871 -2.862 1 1 1092 . 8 1 1 A 97 97 CYS CB C 1865 29.845 27.044 2.801 1 1 1093 . 8 1 1 A 97 97 CYS N N 1865 117.023 117.960 -0.937 1 1 1094 . 8 1 1 A 98 98 GLY HA2 H 1866 4.045 3.914 0.131 1 1 1095 . 8 1 1 A 98 98 GLY HA3 H 1866 3.866 3.919 -0.053 1 1 1096 . 8 1 1 A 98 98 GLY CA C 1866 46.078 46.901 -0.823 1 1 1097 . 8 1 1 A 99 99 HIS H H 1867 7.144 8.077 -0.933 1 1 1098 . 8 1 1 A 99 99 HIS HA H 1867 4.940 5.072 -0.132 1 1 1103 . 8 1 1 A 99 99 HIS CA C 1867 53.843 54.769 -0.926 1 1 1104 . 8 1 1 A 99 99 HIS CB C 1867 31.584 31.515 0.069 1 1 1107 . 8 1 1 A 99 99 HIS N N 1867 115.591 117.658 -2.067 1 1 1108 . 8 1 1 A 100 100 VAL H H 1868 8.434 8.472 -0.038 1 1 1109 . 8 1 1 A 100 100 VAL HA H 1868 4.143 4.370 -0.227 1 1 1117 . 8 1 1 A 100 100 VAL CA C 1868 63.974 63.055 0.919 1 1 1118 . 8 1 1 A 100 100 VAL CB C 1868 31.525 32.089 -0.564 1 1 1121 . 8 1 1 A 100 100 VAL N N 1868 122.851 121.174 1.677 1 1 1122 . 8 1 1 A 101 101 THR H H 1869 7.869 8.465 -0.596 1 1 1123 . 8 1 1 A 101 101 THR HA H 1869 5.217 4.834 0.383 1 1 1128 . 8 1 1 A 101 101 THR CA C 1869 59.495 60.959 -1.464 1 1 1129 . 8 1 1 A 101 101 THR CB C 1869 72.402 70.494 1.908 1 1 1131 . 8 1 1 A 101 101 THR N N 1869 118.578 121.790 -3.212 1 1 1132 . 8 1 1 A 102 102 ALA H H 1870 8.512 8.976 -0.464 1 1 1133 . 8 1 1 A 102 102 ALA HA H 1870 5.687 5.388 0.299 1 1 1137 . 8 1 1 A 102 102 ALA CA C 1870 50.497 50.723 -0.226 1 1 1138 . 8 1 1 A 102 102 ALA CB C 1870 23.128 23.660 -0.532 1 1 1139 . 8 1 1 A 102 102 ALA N N 1870 125.193 126.150 -0.957 1 1 1140 . 8 1 1 A 103 103 TYR H H 1871 8.753 8.889 -0.136 1 1 1141 . 8 1 1 A 103 103 TYR HA H 1871 5.019 5.182 -0.163 1 1 1148 . 8 1 1 A 103 103 TYR CA C 1871 56.303 56.174 0.129 1 1 1149 . 8 1 1 A 103 103 TYR CB C 1871 39.347 41.315 -1.968 1 1 1152 . 8 1 1 A 103 103 TYR N N 1871 119.968 116.496 3.472 1 1 1153 . 8 1 1 A 104 104 GLY H H 1872 9.006 8.651 0.355 1 1 1154 . 8 1 1 A 104 104 GLY HA2 H 1872 5.326 4.380 0.946 1 1 1155 . 8 1 1 A 104 104 GLY HA3 H 1872 4.226 4.405 -0.179 1 1 1156 . 8 1 1 A 104 104 GLY CA C 1872 44.624 44.393 0.231 1 1 1157 . 8 1 1 A 104 104 GLY N N 1872 109.622 106.954 2.668 1 1 1158 . 8 1 1 A 105 105 PRO HA H 1873 4.450 4.459 -0.009 1 1 1165 . 8 1 1 A 105 105 PRO CA C 1873 66.676 65.040 1.636 1 1 1166 . 8 1 1 A 105 105 PRO CB C 1873 32.425 32.105 0.320 1 1 1169 . 8 1 1 A 106 106 GLY H H 1874 9.251 8.604 0.647 1 1 1170 . 8 1 1 A 106 106 GLY HA2 H 1874 4.600 3.877 0.723 1 1 1171 . 8 1 1 A 106 106 GLY HA3 H 1874 3.521 4.107 -0.586 1 1 1172 . 8 1 1 A 106 106 GLY CA C 1874 46.454 47.124 -0.670 1 1 1173 . 8 1 1 A 106 106 GLY N N 1874 105.282 105.535 -0.253 1 1 1174 . 8 1 1 A 107 107 LEU H H 1875 7.161 7.899 -0.738 1 1 1175 . 8 1 1 A 107 107 LEU HA H 1875 4.062 3.935 0.127 1 1 1185 . 8 1 1 A 107 107 LEU CA C 1875 55.592 56.251 -0.659 1 1 1186 . 8 1 1 A 107 107 LEU CB C 1875 41.516 40.769 0.747 1 1 1190 . 8 1 1 A 107 107 LEU N N 1875 117.141 119.471 -2.330 1 1 1191 . 8 1 1 A 108 108 THR H H 1876 8.298 7.834 0.464 1 1 1192 . 8 1 1 A 108 108 THR HA H 1876 5.038 4.395 0.643 1 1 1197 . 8 1 1 A 108 108 THR CA C 1876 64.551 64.262 0.289 1 1 1198 . 8 1 1 A 108 108 THR CB C 1876 72.706 70.727 1.979 1 1 1200 . 8 1 1 A 108 108 THR N N 1876 114.411 112.467 1.944 1 1 1201 . 8 1 1 A 109 109 HIS H H 1877 9.030 8.186 0.844 1 1 1202 . 8 1 1 A 109 109 HIS HA H 1877 5.854 5.137 0.717 1 1 1207 . 8 1 1 A 109 109 HIS CA C 1877 56.127 54.242 1.885 1 1 1208 . 8 1 1 A 109 109 HIS CB C 1877 36.258 33.431 2.827 1 1 1211 . 8 1 1 A 109 109 HIS N N 1877 125.809 117.704 8.105 1 1 1212 . 8 1 1 A 110 110 GLY H H 1878 7.497 8.322 -0.825 1 1 1213 . 8 1 1 A 110 110 GLY HA2 H 1878 4.075 4.012 0.063 1 1 1214 . 8 1 1 A 110 110 GLY HA3 H 1878 3.512 4.053 -0.541 1 1 1215 . 8 1 1 A 110 110 GLY CA C 1878 44.559 43.749 0.810 1 1 1216 . 8 1 1 A 110 110 GLY N N 1878 111.907 111.582 0.325 1 1 1217 . 8 1 1 A 111 111 VAL H H 1879 8.776 8.380 0.396 1 1 1218 . 8 1 1 A 111 111 VAL HA H 1879 4.741 4.743 -0.002 1 1 1226 . 8 1 1 A 111 111 VAL CA C 1879 60.188 60.305 -0.117 1 1 1227 . 8 1 1 A 111 111 VAL CB C 1879 35.130 35.422 -0.292 1 1 1230 . 8 1 1 A 111 111 VAL N N 1879 119.617 120.227 -0.610 1 1 1231 . 8 1 1 A 112 112 VAL H H 1880 7.841 8.490 -0.649 1 1 1232 . 8 1 1 A 112 112 VAL HA H 1880 3.343 3.927 -0.584 1 1 1240 . 8 1 1 A 112 112 VAL CA C 1880 63.553 62.457 1.096 1 1 1241 . 8 1 1 A 112 112 VAL CB C 1880 32.257 31.712 0.545 1 1 1243 . 8 1 1 A 112 112 VAL N N 1880 122.070 126.281 -4.211 1 1 1244 . 8 1 1 A 113 113 ASN H H 1881 8.822 8.972 -0.150 1 1 1245 . 8 1 1 A 113 113 ASN HA H 1881 4.079 4.337 -0.258 1 1 1250 . 8 1 1 A 113 113 ASN CA C 1881 55.459 54.827 0.632 1 1 1251 . 8 1 1 A 113 113 ASN CB C 1881 37.330 37.204 0.126 1 1 1252 . 8 1 1 A 113 113 ASN N N 1881 115.063 117.891 -2.828 1 1 1254 . 8 1 1 A 114 114 LYS H H 1882 8.073 7.300 0.773 1 1 1255 . 8 1 1 A 114 114 LYS HA H 1882 4.818 4.696 0.122 1 1 1260 . 8 1 1 A 114 114 LYS CA C 1882 53.039 52.724 0.315 1 1 1261 . 8 1 1 A 114 114 LYS CB C 1882 34.020 33.561 0.459 1 1 1263 . 8 1 1 A 114 114 LYS N N 1882 121.439 118.784 2.655 1 1 1264 . 8 1 1 A 115 115 PRO HA H 1883 4.409 4.741 -0.332 1 1 1271 . 8 1 1 A 115 115 PRO CA C 1883 63.121 62.602 0.519 1 1 1272 . 8 1 1 A 115 115 PRO CB C 1883 31.515 31.844 -0.329 1 1 1275 . 8 1 1 A 116 116 ALA H H 1884 8.868 8.044 0.824 1 1 1276 . 8 1 1 A 116 116 ALA HA H 1884 4.804 4.845 -0.041 1 1 1280 . 8 1 1 A 116 116 ALA CA C 1884 50.620 50.600 0.020 1 1 1281 . 8 1 1 A 116 116 ALA CB C 1884 19.426 20.817 -1.391 1 1 1282 . 8 1 1 A 116 116 ALA N N 1884 132.329 125.303 7.026 1 1 1283 . 8 1 1 A 117 117 THR H H 1885 8.433 8.794 -0.361 1 1 1284 . 8 1 1 A 117 117 THR HA H 1885 5.747 5.430 0.317 1 1 1289 . 8 1 1 A 117 117 THR CA C 1885 60.364 59.862 0.502 1 1 1290 . 8 1 1 A 117 117 THR CB C 1885 72.204 71.940 0.264 1 1 1292 . 8 1 1 A 117 117 THR N N 1885 113.428 111.123 2.305 1 1 1293 . 8 1 1 A 118 118 PHE H H 1886 9.069 8.539 0.530 1 1 1294 . 8 1 1 A 118 118 PHE HA H 1886 5.123 5.191 -0.068 1 1 1301 . 8 1 1 A 118 118 PHE CA C 1886 57.059 56.070 0.989 1 1 1302 . 8 1 1 A 118 118 PHE CB C 1886 39.994 41.187 -1.193 1 1 1305 . 8 1 1 A 118 118 PHE N N 1886 119.166 117.592 1.574 1 1 1306 . 8 1 1 A 119 119 THR H H 1887 9.451 8.977 0.474 1 1 1307 . 8 1 1 A 119 119 THR HA H 1887 5.097 5.106 -0.009 1 1 1312 . 8 1 1 A 119 119 THR CA C 1887 62.050 61.333 0.717 1 1 1313 . 8 1 1 A 119 119 THR CB C 1887 71.696 72.544 -0.848 1 1 1315 . 8 1 1 A 119 119 THR N N 1887 119.436 114.471 4.965 1 1 1316 . 8 1 1 A 120 120 VAL H H 1888 8.812 9.380 -0.568 1 1 1317 . 8 1 1 A 120 120 VAL HA H 1888 4.807 4.505 0.302 1 1 1325 . 8 1 1 A 120 120 VAL CA C 1888 61.140 61.138 0.002 1 1 1326 . 8 1 1 A 120 120 VAL CB C 1888 34.059 33.474 0.585 1 1 1329 . 8 1 1 A 120 120 VAL N N 1888 124.304 126.710 -2.406 1 1 1330 . 8 1 1 A 121 121 ASN H H 1889 9.291 9.171 0.120 1 1 1331 . 8 1 1 A 121 121 ASN HA H 1889 5.177 5.211 -0.034 1 1 1336 . 8 1 1 A 121 121 ASN CA C 1889 52.470 52.628 -0.158 1 1 1337 . 8 1 1 A 121 121 ASN CB C 1889 39.766 40.314 -0.548 1 1 1338 . 8 1 1 A 121 121 ASN N N 1889 128.674 125.810 2.864 1 1 1340 . 8 1 1 A 122 122 THR H H 1890 8.553 8.609 -0.056 1 1 1341 . 8 1 1 A 122 122 THR HA H 1890 4.236 4.901 -0.665 1 1 1346 . 8 1 1 A 122 122 THR CA C 1890 61.062 61.064 -0.002 1 1 1347 . 8 1 1 A 122 122 THR CB C 1890 68.437 69.761 -1.324 1 1 1349 . 8 1 1 A 122 122 THR N N 1890 116.203 113.676 2.527 1 1 1350 . 8 1 1 A 123 123 LYS H H 1891 8.210 7.600 0.610 1 1 1351 . 8 1 1 A 123 123 LYS HA H 1891 4.019 4.070 -0.051 1 1 1360 . 8 1 1 A 123 123 LYS CA C 1891 58.646 59.485 -0.839 1 1 1361 . 8 1 1 A 123 123 LYS CB C 1891 31.868 32.247 -0.379 1 1 1365 . 8 1 1 A 123 123 LYS N N 1891 124.070 122.598 1.472 1 1 1366 . 8 1 1 A 124 124 ASP H H 1892 8.596 7.939 0.657 1 1 1367 . 8 1 1 A 124 124 ASP HA H 1892 4.638 4.830 -0.192 1 1 1370 . 8 1 1 A 124 124 ASP CA C 1892 54.928 53.015 1.913 1 1 1371 . 8 1 1 A 124 124 ASP CB C 1892 40.725 41.089 -0.364 1 1 1372 . 8 1 1 A 124 124 ASP N N 1892 119.838 117.396 2.442 1 1 1373 . 8 1 1 A 125 125 ALA H H 1893 7.792 7.856 -0.064 1 1 1374 . 8 1 1 A 125 125 ALA HA H 1893 4.248 4.197 0.051 1 1 1378 . 8 1 1 A 125 125 ALA CA C 1893 52.852 52.091 0.761 1 1 1379 . 8 1 1 A 125 125 ALA CB C 1893 20.199 19.541 0.658 1 1 1380 . 8 1 1 A 125 125 ALA N N 1893 122.999 121.304 1.695 1 1 1381 . 8 1 1 A 126 126 GLY H H 1894 8.214 7.843 0.371 1 1 1382 . 8 1 1 A 126 126 GLY HA2 H 1894 4.183 3.908 0.275 1 1 1383 . 8 1 1 A 126 126 GLY HA3 H 1894 3.993 3.959 0.034 1 1 1384 . 8 1 1 A 126 126 GLY CA C 1894 44.725 46.527 -1.802 1 1 1385 . 8 1 1 A 126 126 GLY N N 1894 108.359 106.100 2.259 1 1 1386 . 8 1 1 A 127 127 GLU H H 1895 8.633 8.420 0.213 1 1 1387 . 8 1 1 A 127 127 GLU HA H 1895 4.318 5.269 -0.951 1 1 1392 . 8 1 1 A 127 127 GLU CA C 1895 57.280 55.785 1.495 1 1 1393 . 8 1 1 A 127 127 GLU CB C 1895 30.434 32.955 -2.521 1 1 1395 . 8 1 1 A 127 127 GLU N N 1895 122.934 122.480 0.454 1 1 1396 . 8 1 1 A 128 128 GLY H H 1896 8.351 8.526 -0.175 1 1 1397 . 8 1 1 A 128 128 GLY HA2 H 1896 3.853 4.339 -0.486 1 1 1398 . 8 1 1 A 128 128 GLY HA3 H 1896 3.853 4.375 -0.522 1 1 1399 . 8 1 1 A 128 128 GLY CA C 1896 45.766 46.262 -0.496 1 1 1400 . 8 1 1 A 128 128 GLY N N 1896 111.048 111.329 -0.281 1 1 1401 . 8 1 1 A 129 129 GLY H H 1897 7.580 8.055 -0.475 1 1 1402 . 8 1 1 A 129 129 GLY HA2 H 1897 4.170 4.112 0.058 1 1 1403 . 8 1 1 A 129 129 GLY HA3 H 1897 3.463 4.131 -0.668 1 1 1404 . 8 1 1 A 129 129 GLY CA C 1897 44.670 45.624 -0.954 1 1 1405 . 8 1 1 A 129 129 GLY N N 1897 106.306 105.225 1.081 1 1 1406 . 8 1 1 A 130 130 LEU H H 1898 8.416 8.513 -0.097 1 1 1407 . 8 1 1 A 130 130 LEU HA H 1898 5.077 4.445 0.632 1 1 1417 . 8 1 1 A 130 130 LEU CA C 1898 54.526 54.190 0.336 1 1 1418 . 8 1 1 A 130 130 LEU CB C 1898 44.499 42.990 1.509 1 1 1422 . 8 1 1 A 130 130 LEU N N 1898 126.737 125.992 0.745 1 1 1423 . 8 1 1 A 131 131 SER H H 1899 9.254 9.161 0.093 1 1 1424 . 8 1 1 A 131 131 SER HA H 1899 4.803 5.386 -0.583 1 1 1427 . 8 1 1 A 131 131 SER CA C 1899 57.293 57.155 0.138 1 1 1428 . 8 1 1 A 131 131 SER CB C 1899 65.376 66.435 -1.059 1 1 1429 . 8 1 1 A 131 131 SER N N 1899 123.028 123.699 -0.671 1 1 1430 . 8 1 1 A 132 132 LEU H H 1900 8.410 8.497 -0.087 1 1 1431 . 8 1 1 A 132 132 LEU HA H 1900 5.452 4.952 0.500 1 1 1441 . 8 1 1 A 132 132 LEU CA C 1900 53.045 54.274 -1.229 1 1 1442 . 8 1 1 A 132 132 LEU CB C 1900 46.982 46.120 0.862 1 1 1446 . 8 1 1 A 132 132 LEU N N 1900 126.218 122.958 3.260 1 1 1447 . 8 1 1 A 133 133 ALA H H 1901 8.708 8.605 0.103 1 1 1448 . 8 1 1 A 133 133 ALA HA H 1901 4.591 4.935 -0.344 1 1 1452 . 8 1 1 A 133 133 ALA CA C 1901 52.140 51.238 0.902 1 1 1453 . 8 1 1 A 133 133 ALA CB C 1901 22.653 23.814 -1.161 1 1 1454 . 8 1 1 A 133 133 ALA N N 1901 124.744 126.049 -1.305 1 1 1455 . 8 1 1 A 134 134 ILE H H 1902 8.641 8.576 0.065 1 1 1456 . 8 1 1 A 134 134 ILE HA H 1902 5.256 5.089 0.167 1 1 1466 . 8 1 1 A 134 134 ILE CA C 1902 59.873 59.890 -0.017 1 1 1467 . 8 1 1 A 134 134 ILE CB C 1902 41.214 41.947 -0.733 1 1 1471 . 8 1 1 A 134 134 ILE N N 1902 121.132 120.039 1.093 1 1 1472 . 8 1 1 A 135 135 GLU H H 1903 9.294 8.995 0.299 1 1 1473 . 8 1 1 A 135 135 GLU HA H 1903 4.869 5.171 -0.302 1 1 1478 . 8 1 1 A 135 135 GLU CA C 1903 54.307 54.699 -0.392 1 1 1479 . 8 1 1 A 135 135 GLU CB C 1903 32.474 32.246 0.228 1 1 1481 . 8 1 1 A 135 135 GLU N N 1903 129.644 124.857 4.787 1 1 1482 . 8 1 1 A 136 136 GLY H H 1904 8.347 8.518 -0.171 1 1 1483 . 8 1 1 A 136 136 GLY HA2 H 1904 4.005 3.522 0.483 1 1 1484 . 8 1 1 A 136 136 GLY HA3 H 1904 3.629 3.834 -0.205 1 1 1485 . 8 1 1 A 136 136 GLY CA C 1904 45.530 43.992 1.538 1 1 1486 . 8 1 1 A 136 136 GLY N N 1904 112.326 111.314 1.012 1 1 1487 . 8 1 1 A 137 137 PRO HA H 1905 4.268 4.335 -0.067 1 1 1494 . 8 1 1 A 137 137 PRO CA C 1905 64.189 64.039 0.150 1 1 1495 . 8 1 1 A 137 137 PRO CB C 1905 32.482 31.979 0.503 1 1 1498 . 8 1 1 A 138 138 SER H H 1906 7.060 7.391 -0.331 1 1 1499 . 8 1 1 A 138 138 SER HA H 1906 4.603 4.848 -0.245 1 1 1502 . 8 1 1 A 138 138 SER CA C 1906 56.433 56.609 -0.176 1 1 1503 . 8 1 1 A 138 138 SER CB C 1906 66.672 65.691 0.981 1 1 1504 . 8 1 1 A 138 138 SER N N 1906 109.100 111.941 -2.841 1 1 1505 . 8 1 1 A 139 139 LYS H H 1907 8.479 8.358 0.121 1 1 1506 . 8 1 1 A 139 139 LYS HA H 1907 4.413 4.418 -0.005 1 1 1515 . 8 1 1 A 139 139 LYS CA C 1907 56.638 56.807 -0.169 1 1 1516 . 8 1 1 A 139 139 LYS CB C 1907 31.873 32.819 -0.946 1 1 1520 . 8 1 1 A 139 139 LYS N N 1907 124.545 125.971 -1.426 1 1 1521 . 8 1 1 A 140 140 ALA H H 1908 8.358 8.568 -0.210 1 1 1522 . 8 1 1 A 140 140 ALA HA H 1908 4.706 4.583 0.123 1 1 1526 . 8 1 1 A 140 140 ALA CA C 1908 51.081 52.310 -1.229 1 1 1527 . 8 1 1 A 140 140 ALA CB C 1908 20.724 19.397 1.327 1 1 1528 . 8 1 1 A 140 140 ALA N N 1908 131.020 129.546 1.474 1 1 1529 . 8 1 1 A 141 141 GLU H H 1909 8.625 8.460 0.165 1 1 1530 . 8 1 1 A 141 141 GLU HA H 1909 4.248 4.835 -0.587 1 1 1535 . 8 1 1 A 141 141 GLU CA C 1909 56.991 56.249 0.742 1 1 1536 . 8 1 1 A 141 141 GLU CB C 1909 30.453 31.334 -0.881 1 1 1538 . 8 1 1 A 141 141 GLU N N 1909 124.862 121.104 3.758 1 1 1539 . 8 1 1 A 142 142 ILE H H 1910 8.588 8.677 -0.089 1 1 1540 . 8 1 1 A 142 142 ILE HA H 1910 4.871 5.147 -0.276 1 1 1550 . 8 1 1 A 142 142 ILE CA C 1910 60.733 59.966 0.767 1 1 1551 . 8 1 1 A 142 142 ILE CB C 1910 41.494 41.945 -0.451 1 1 1555 . 8 1 1 A 142 142 ILE N N 1910 126.220 124.188 2.032 1 1 1556 . 8 1 1 A 143 143 SER H H 1911 9.269 9.052 0.217 1 1 1557 . 8 1 1 A 143 143 SER HA H 1911 4.804 5.245 -0.441 1 1 1560 . 8 1 1 A 143 143 SER CA C 1911 56.988 56.968 0.020 1 1 1561 . 8 1 1 A 143 143 SER CB C 1911 65.172 66.056 -0.884 1 1 1562 . 8 1 1 A 143 143 SER N N 1911 124.083 120.626 3.457 1 1 1563 . 8 1 1 A 144 144 CYS H H 1912 8.773 8.788 -0.015 1 1 1564 . 8 1 1 A 144 144 CYS HA H 1912 5.200 5.186 0.014 1 1 1567 . 8 1 1 A 144 144 CYS CA C 1912 57.256 56.495 0.761 1 1 1568 . 8 1 1 A 144 144 CYS CB C 1912 29.137 31.351 -2.214 1 1 1569 . 8 1 1 A 144 144 CYS N N 1912 125.729 120.258 5.471 1 1 1570 . 8 1 1 A 145 145 THR H H 1913 8.976 8.784 0.192 1 1 1571 . 8 1 1 A 145 145 THR HA H 1913 4.510 4.979 -0.469 1 1 1576 . 8 1 1 A 145 145 THR CA C 1913 61.388 61.607 -0.219 1 1 1577 . 8 1 1 A 145 145 THR CB C 1913 71.558 71.553 0.005 1 1 1579 . 8 1 1 A 145 145 THR N N 1913 124.914 117.687 7.227 1 1 1580 . 8 1 1 A 146 146 ASP H H 1914 8.843 9.132 -0.289 1 1 1581 . 8 1 1 A 146 146 ASP HA H 1914 4.842 4.839 0.003 1 1 1584 . 8 1 1 A 146 146 ASP CA C 1914 54.307 54.130 0.177 1 1 1585 . 8 1 1 A 146 146 ASP CB C 1914 41.262 42.131 -0.869 1 1 1586 . 8 1 1 A 146 146 ASP N N 1914 128.084 128.561 -0.477 1 1 1587 . 8 1 1 A 147 147 ASN H H 1915 8.700 8.927 -0.227 1 1 1588 . 8 1 1 A 147 147 ASN HA H 1915 4.798 5.122 -0.324 1 1 1593 . 8 1 1 A 147 147 ASN CA C 1915 54.283 51.965 2.318 1 1 1594 . 8 1 1 A 147 147 ASN CB C 1915 38.986 40.856 -1.870 1 1 1595 . 8 1 1 A 147 147 ASN N N 1915 125.720 122.952 2.768 1 1 1597 . 8 1 1 A 148 148 GLN HA H 1916 4.057 4.121 -0.064 1 1 1602 . 8 1 1 A 148 148 GLN CA C 1916 57.839 58.540 -0.701 1 1 1603 . 8 1 1 A 148 148 GLN CB C 1916 26.281 28.391 -2.110 1 1 1605 . 8 1 1 A 149 149 ASP H H 1917 7.892 8.017 -0.125 1 1 1606 . 8 1 1 A 149 149 ASP HA H 1917 4.755 4.590 0.165 1 1 1609 . 8 1 1 A 149 149 ASP CA C 1917 52.659 54.245 -1.586 1 1 1610 . 8 1 1 A 149 149 ASP CB C 1917 41.111 41.032 0.079 1 1 1611 . 8 1 1 A 149 149 ASP N N 1917 118.769 117.272 1.497 1 1 1612 . 8 1 1 A 150 150 GLY H H 1918 8.673 8.779 -0.106 1 1 1613 . 8 1 1 A 150 150 GLY HA2 H 1918 4.358 3.940 0.418 1 1 1614 . 8 1 1 A 150 150 GLY HA3 H 1918 3.700 3.945 -0.245 1 1 1615 . 8 1 1 A 150 150 GLY CA C 1918 45.319 46.229 -0.910 1 1 1616 . 8 1 1 A 150 150 GLY N N 1918 110.464 108.714 1.750 1 1 1617 . 8 1 1 A 151 151 THR H H 1919 8.154 7.555 0.599 1 1 1618 . 8 1 1 A 151 151 THR HA H 1919 4.109 5.170 -1.061 1 1 1623 . 8 1 1 A 151 151 THR CA C 1919 60.041 59.688 0.353 1 1 1624 . 8 1 1 A 151 151 THR CB C 1919 73.422 72.762 0.660 1 1 1626 . 8 1 1 A 151 151 THR N N 1919 111.043 109.730 1.313 1 1 1627 . 8 1 1 A 152 152 CYS H H 1920 9.088 9.185 -0.097 1 1 1628 . 8 1 1 A 152 152 CYS HA H 1920 5.362 5.370 -0.008 1 1 1631 . 8 1 1 A 152 152 CYS CA C 1920 56.990 57.116 -0.126 1 1 1632 . 8 1 1 A 152 152 CYS CB C 1920 30.740 30.727 0.013 1 1 1633 . 8 1 1 A 152 152 CYS N N 1920 118.508 121.026 -2.518 1 1 1634 . 8 1 1 A 153 153 SER H H 1921 9.102 8.940 0.162 1 1 1635 . 8 1 1 A 153 153 SER HA H 1921 4.865 4.975 -0.110 1 1 1638 . 8 1 1 A 153 153 SER CA C 1921 58.023 57.427 0.596 1 1 1639 . 8 1 1 A 153 153 SER CB C 1921 64.133 64.290 -0.157 1 1 1640 . 8 1 1 A 153 153 SER N N 1921 122.048 123.295 -1.247 1 1 1641 . 8 1 1 A 154 154 VAL H H 1922 8.983 8.812 0.171 1 1 1642 . 8 1 1 A 154 154 VAL HA H 1922 4.608 4.769 -0.161 1 1 1650 . 8 1 1 A 154 154 VAL CA C 1922 60.575 59.721 0.854 1 1 1651 . 8 1 1 A 154 154 VAL CB C 1922 32.710 34.721 -2.011 1 1 1654 . 8 1 1 A 154 154 VAL N N 1922 130.262 125.499 4.763 1 1 1655 . 8 1 1 A 155 155 SER H H 1923 8.737 8.714 0.023 1 1 1656 . 8 1 1 A 155 155 SER HA H 1923 5.680 5.483 0.197 1 1 1659 . 8 1 1 A 155 155 SER CA C 1923 55.991 56.803 -0.812 1 1 1660 . 8 1 1 A 155 155 SER CB C 1923 66.306 65.927 0.379 1 1 1661 . 8 1 1 A 155 155 SER N N 1923 121.504 123.144 -1.640 1 1 1662 . 8 1 1 A 156 156 TYR H H 1924 9.061 8.997 0.064 1 1 1663 . 8 1 1 A 156 156 TYR HA H 1924 5.790 5.615 0.175 1 1 1671 . 8 1 1 A 156 156 TYR CA C 1924 55.118 55.816 -0.698 1 1 1672 . 8 1 1 A 156 156 TYR CB C 1924 42.344 41.958 0.386 1 1 1675 . 8 1 1 A 156 156 TYR N N 1924 121.858 120.834 1.024 1 1 1676 . 8 1 1 A 157 157 LEU H H 1925 7.505 9.332 -1.827 1 1 1677 . 8 1 1 A 157 157 LEU HA H 1925 4.996 4.770 0.226 1 1 1687 . 8 1 1 A 157 157 LEU CA C 1925 50.476 51.109 -0.633 1 1 1688 . 8 1 1 A 157 157 LEU CB C 1925 43.334 43.421 -0.087 1 1 1692 . 8 1 1 A 157 157 LEU N N 1925 123.272 121.815 1.457 1 1 1693 . 8 1 1 A 158 158 PRO HA H 1926 4.691 4.904 -0.213 1 1 1700 . 8 1 1 A 158 158 PRO CA C 1926 61.808 62.322 -0.514 1 1 1701 . 8 1 1 A 158 158 PRO CB C 1926 32.551 33.263 -0.712 1 1 1704 . 8 1 1 A 159 159 VAL H H 1927 8.388 8.353 0.035 1 1 1705 . 8 1 1 A 159 159 VAL HA H 1927 4.510 4.332 0.178 1 1 1713 . 8 1 1 A 159 159 VAL CA C 1927 61.778 62.244 -0.466 1 1 1714 . 8 1 1 A 159 159 VAL CB C 1927 32.432 34.744 -2.312 1 1 1717 . 8 1 1 A 159 159 VAL N N 1927 115.680 120.751 -5.071 1 1 1718 . 8 1 1 A 160 160 LEU H H 1928 6.931 7.297 -0.366 1 1 1719 . 8 1 1 A 160 160 LEU HA H 1928 4.931 5.109 -0.178 1 1 1729 . 8 1 1 A 160 160 LEU CA C 1928 51.971 51.359 0.612 1 1 1730 . 8 1 1 A 160 160 LEU CB C 1928 45.905 44.568 1.337 1 1 1734 . 8 1 1 A 160 160 LEU N N 1928 120.258 118.832 1.426 1 1 1735 . 8 1 1 A 161 161 PRO HA H 1929 4.317 4.633 -0.316 1 1 1742 . 8 1 1 A 161 161 PRO CA C 1929 62.809 63.447 -0.638 1 1 1743 . 8 1 1 A 161 161 PRO CB C 1929 32.662 32.373 0.289 1 1 1746 . 8 1 1 A 162 162 GLY H H 1930 8.916 8.177 0.739 1 1 1747 . 8 1 1 A 162 162 GLY HA2 H 1930 4.461 4.224 0.237 1 1 1748 . 8 1 1 A 162 162 GLY HA3 H 1930 3.852 4.233 -0.381 1 1 1749 . 8 1 1 A 162 162 GLY CA C 1930 44.496 44.913 -0.417 1 1 1750 . 8 1 1 A 162 162 GLY N N 1930 107.609 108.218 -0.609 1 1 1751 . 8 1 1 A 163 163 ASP H H 1931 8.245 8.568 -0.323 1 1 1752 . 8 1 1 A 163 163 ASP HA H 1931 5.565 5.495 0.070 1 1 1755 . 8 1 1 A 163 163 ASP CA C 1931 53.628 53.290 0.338 1 1 1756 . 8 1 1 A 163 163 ASP CB C 1931 41.058 42.410 -1.352 1 1 1757 . 8 1 1 A 163 163 ASP N N 1931 121.979 118.147 3.832 1 1 1758 . 8 1 1 A 164 164 TYR H H 1932 9.606 9.463 0.143 1 1 1759 . 8 1 1 A 164 164 TYR HA H 1932 4.896 5.174 -0.278 1 1 1767 . 8 1 1 A 164 164 TYR CA C 1932 56.955 56.476 0.479 1 1 1768 . 8 1 1 A 164 164 TYR CB C 1932 40.339 41.300 -0.961 1 1 1771 . 8 1 1 A 164 164 TYR N N 1932 125.257 122.087 3.170 1 1 1772 . 8 1 1 A 165 165 SER H H 1933 9.095 9.322 -0.227 1 1 1773 . 8 1 1 A 165 165 SER HA H 1933 5.500 5.156 0.344 1 1 1776 . 8 1 1 A 165 165 SER CA C 1933 56.509 58.430 -1.921 1 1 1777 . 8 1 1 A 165 165 SER CB C 1933 64.486 63.969 0.517 1 1 1778 . 8 1 1 A 165 165 SER N N 1933 119.162 120.598 -1.436 1 1 1779 . 8 1 1 A 166 166 ILE H H 1934 9.598 9.399 0.199 1 1 1780 . 8 1 1 A 166 166 ILE HA H 1934 4.541 4.825 -0.284 1 1 1790 . 8 1 1 A 166 166 ILE CA C 1934 61.080 60.089 0.991 1 1 1791 . 8 1 1 A 166 166 ILE CB C 1934 39.282 39.069 0.213 1 1 1795 . 8 1 1 A 166 166 ILE N N 1934 128.701 128.448 0.253 1 1 1796 . 8 1 1 A 167 167 LEU H H 1935 9.359 9.347 0.012 1 1 1797 . 8 1 1 A 167 167 LEU HA H 1935 4.779 5.282 -0.503 1 1 1807 . 8 1 1 A 167 167 LEU CA C 1935 55.921 53.300 2.621 1 1 1808 . 8 1 1 A 167 167 LEU CB C 1935 42.473 45.117 -2.644 1 1 1811 . 8 1 1 A 167 167 LEU N N 1935 131.315 130.603 0.712 1 1 1812 . 8 1 1 A 168 168 VAL H H 1936 9.425 9.023 0.402 1 1 1813 . 8 1 1 A 168 168 VAL HA H 1936 4.617 4.869 -0.252 1 1 1821 . 8 1 1 A 168 168 VAL CA C 1936 61.418 60.922 0.496 1 1 1822 . 8 1 1 A 168 168 VAL CB C 1936 33.616 34.916 -1.300 1 1 1824 . 8 1 1 A 168 168 VAL N N 1936 126.961 126.355 0.606 1 1 1825 . 8 1 1 A 169 169 LYS H H 1937 8.643 8.382 0.261 1 1 1826 . 8 1 1 A 169 169 LYS HA H 1937 5.067 4.892 0.175 1 1 1835 . 8 1 1 A 169 169 LYS CA C 1937 53.949 55.511 -1.562 1 1 1836 . 8 1 1 A 169 169 LYS CB C 1937 36.691 36.378 0.313 1 1 1840 . 8 1 1 A 169 169 LYS N N 1937 124.773 127.291 -2.518 1 1 1841 . 8 1 1 A 170 170 TYR H H 1938 8.877 9.294 -0.417 1 1 1842 . 8 1 1 A 170 170 TYR HA H 1938 5.137 5.017 0.120 1 1 1849 . 8 1 1 A 170 170 TYR CA C 1938 57.034 57.631 -0.597 1 1 1850 . 8 1 1 A 170 170 TYR CB C 1938 42.105 41.876 0.229 1 1 1853 . 8 1 1 A 170 170 TYR N N 1938 122.371 126.973 -4.602 1 1 1854 . 8 1 1 A 171 171 ASN H H 1939 8.933 9.871 -0.938 1 1 1855 . 8 1 1 A 171 171 ASN HA H 1939 4.405 4.450 -0.045 1 1 1860 . 8 1 1 A 171 171 ASN CA C 1939 54.512 54.272 0.240 1 1 1861 . 8 1 1 A 171 171 ASN CB C 1939 37.025 37.262 -0.237 1 1 1862 . 8 1 1 A 171 171 ASN N N 1939 129.922 126.509 3.413 1 1 1864 . 8 1 1 A 172 172 GLU H H 1940 8.857 8.857 0.000 1 1 1865 . 8 1 1 A 172 172 GLU HA H 1940 3.511 4.061 -0.550 1 1 1870 . 8 1 1 A 172 172 GLU CA C 1940 57.910 57.626 0.284 1 1 1871 . 8 1 1 A 172 172 GLU CB C 1940 27.139 27.485 -0.346 1 1 1873 . 8 1 1 A 172 172 GLU N N 1940 107.943 116.274 -8.331 1 1 1874 . 8 1 1 A 173 173 GLN H H 1941 7.544 7.473 0.071 1 1 1875 . 8 1 1 A 173 173 GLN HA H 1941 4.749 4.843 -0.094 1 1 1882 . 8 1 1 A 173 173 GLN CA C 1941 53.770 54.159 -0.389 1 1 1883 . 8 1 1 A 173 173 GLN CB C 1941 31.078 31.218 -0.140 1 1 1885 . 8 1 1 A 173 173 GLN N N 1941 119.865 120.147 -0.282 1 1 1887 . 8 1 1 A 174 174 HIS H H 1942 8.848 8.930 -0.082 1 1 1888 . 8 1 1 A 174 174 HIS HA H 1942 4.513 4.684 -0.171 1 1 1893 . 8 1 1 A 174 174 HIS CA C 1942 58.893 56.970 1.923 1 1 1894 . 8 1 1 A 174 174 HIS CB C 1942 32.196 30.316 1.880 1 1 1897 . 8 1 1 A 174 174 HIS N N 1942 126.437 121.821 4.616 1 1 1898 . 8 1 1 A 175 175 VAL H H 1943 8.483 8.356 0.127 1 1 1899 . 8 1 1 A 175 175 VAL HA H 1943 4.643 4.295 0.348 1 1 1907 . 8 1 1 A 175 175 VAL CA C 1943 60.025 60.945 -0.920 1 1 1908 . 8 1 1 A 175 175 VAL CB C 1943 29.439 31.803 -2.364 1 1 1911 . 8 1 1 A 175 175 VAL N N 1943 121.671 121.028 0.643 1 1 1912 . 8 1 1 A 176 176 PRO HA H 1944 4.045 4.047 -0.002 1 1 1919 . 8 1 1 A 176 176 PRO CA C 1944 64.943 63.500 1.443 1 1 1920 . 8 1 1 A 176 176 PRO CB C 1944 31.120 31.039 0.081 1 1 1923 . 8 1 1 A 177 177 GLY H H 1945 7.579 8.447 -0.868 1 1 1924 . 8 1 1 A 177 177 GLY HA2 H 1945 3.210 3.367 -0.157 1 1 1925 . 8 1 1 A 177 177 GLY HA3 H 1945 2.311 3.616 -1.305 1 1 1926 . 8 1 1 A 177 177 GLY CA C 1945 44.184 44.606 -0.422 1 1 1927 . 8 1 1 A 177 177 GLY N N 1945 113.696 112.815 0.881 1 1 1928 . 8 1 1 A 178 178 SER H H 1946 7.469 7.430 0.039 1 1 1929 . 8 1 1 A 178 178 SER HA H 1946 4.023 3.594 0.429 1 1 1932 . 8 1 1 A 178 178 SER CA C 1946 54.593 55.047 -0.454 1 1 1933 . 8 1 1 A 178 178 SER CB C 1946 62.282 63.793 -1.511 1 1 1934 . 8 1 1 A 178 178 SER N N 1946 113.219 116.684 -3.465 1 1 1935 . 8 1 1 A 179 179 PRO HA H 1947 5.314 4.731 0.583 1 1 1942 . 8 1 1 A 179 179 PRO CA C 1947 62.198 62.285 -0.087 1 1 1943 . 8 1 1 A 179 179 PRO CB C 1947 33.923 32.944 0.979 1 1 1946 . 8 1 1 A 180 180 PHE H H 1948 9.395 8.619 0.776 1 1 1947 . 8 1 1 A 180 180 PHE HA H 1948 4.706 4.968 -0.262 1 1 1955 . 8 1 1 A 180 180 PHE CA C 1948 57.298 57.540 -0.242 1 1 1956 . 8 1 1 A 180 180 PHE CB C 1948 41.116 40.873 0.243 1 1 1960 . 8 1 1 A 180 180 PHE N N 1948 127.510 120.633 6.877 1 1 1961 . 8 1 1 A 181 181 THR H H 1949 9.111 8.883 0.228 1 1 1962 . 8 1 1 A 181 181 THR HA H 1949 5.091 5.044 0.047 1 1 1967 . 8 1 1 A 181 181 THR CA C 1949 62.668 61.273 1.395 1 1 1968 . 8 1 1 A 181 181 THR CB C 1949 70.354 70.567 -0.213 1 1 1970 . 8 1 1 A 181 181 THR N N 1949 120.325 115.182 5.143 1 1 1971 . 8 1 1 A 182 182 ALA H H 1950 8.992 9.359 -0.367 1 1 1972 . 8 1 1 A 182 182 ALA HA H 1950 4.521 5.032 -0.511 1 1 1976 . 8 1 1 A 182 182 ALA CA C 1950 50.080 51.248 -1.168 1 1 1977 . 8 1 1 A 182 182 ALA CB C 1950 21.717 20.331 1.386 1 1 1978 . 8 1 1 A 182 182 ALA N N 1950 130.794 130.687 0.107 1 1 1979 . 8 1 1 A 183 183 ARG H H 1951 7.764 8.509 -0.745 1 1 1980 . 8 1 1 A 183 183 ARG HA H 1951 5.001 5.185 -0.184 1 1 1988 . 8 1 1 A 183 183 ARG CA C 1951 55.116 54.745 0.371 1 1 1989 . 8 1 1 A 183 183 ARG CB C 1951 30.631 33.555 -2.924 1 1 1992 . 8 1 1 A 183 183 ARG N N 1951 121.920 121.419 0.501 1 1 1994 . 8 1 1 A 184 184 VAL H H 1952 9.121 9.589 -0.468 1 1 1995 . 8 1 1 A 184 184 VAL HA H 1952 4.865 4.830 0.035 1 1 2003 . 8 1 1 A 184 184 VAL CA C 1952 60.375 61.146 -0.771 1 1 2004 . 8 1 1 A 184 184 VAL CB C 1952 32.179 33.291 -1.112 1 1 2007 . 8 1 1 A 184 184 VAL N N 1952 125.421 127.601 -2.180 1 1 2008 . 8 1 1 A 185 185 THR H H 1953 8.799 8.897 -0.098 1 1 2009 . 8 1 1 A 185 185 THR HA H 1953 4.829 5.332 -0.503 1 1 2014 . 8 1 1 A 185 185 THR CA C 1953 60.316 59.974 0.342 1 1 2015 . 8 1 1 A 185 185 THR CB C 1953 70.825 71.680 -0.855 1 1 2017 . 8 1 1 A 185 185 THR N N 1953 121.794 118.307 3.487 1 1 2018 . 8 1 1 A 186 186 GLY H H 1954 8.586 8.463 0.123 1 1 2019 . 8 1 1 A 186 186 GLY HA2 H 1954 4.261 4.077 0.184 1 1 2020 . 8 1 1 A 186 186 GLY HA3 H 1954 4.033 4.082 -0.049 1 1 2021 . 8 1 1 A 186 186 GLY CA C 1954 45.038 45.344 -0.306 1 1 2022 . 8 1 1 A 186 186 GLY N N 1954 107.588 108.485 -0.897 1 1 2023 . 8 1 1 A 187 187 ASP H H 1955 8.386 9.076 -0.690 1 1 2024 . 8 1 1 A 187 187 ASP HA H 1955 4.772 4.663 0.109 1 1 2027 . 8 1 1 A 187 187 ASP CA C 1955 53.909 54.995 -1.086 1 1 2028 . 8 1 1 A 187 187 ASP CB C 1955 41.510 42.051 -0.541 1 1 2029 . 8 1 1 A 187 187 ASP N N 1955 121.829 121.625 0.204 1 1 4 . 9 1 1 A 2 2 ALA HA H -2 4.368 4.086 0.282 1 1 8 . 9 1 1 A 2 2 ALA CA C -2 52.604 54.026 -1.422 1 1 9 . 9 1 1 A 2 2 ALA CB C -2 19.551 18.587 0.964 1 1 32 . 9 1 1 A 5 5 PRO HA H 1773 4.433 4.547 -0.114 1 1 39 . 9 1 1 A 5 5 PRO CA C 1773 63.017 62.412 0.605 1 1 40 . 9 1 1 A 5 5 PRO CB C 1773 32.155 32.516 -0.361 1 1 43 . 9 1 1 A 6 6 GLU H H 1774 8.495 8.547 -0.052 1 1 44 . 9 1 1 A 6 6 GLU HA H 1774 4.242 4.450 -0.208 1 1 49 . 9 1 1 A 6 6 GLU CA C 1774 56.735 56.756 -0.021 1 1 50 . 9 1 1 A 6 6 GLU CB C 1774 30.401 30.092 0.309 1 1 52 . 9 1 1 A 6 6 GLU N N 1774 122.494 120.904 1.590 1 1 53 . 9 1 1 A 7 7 ARG H H 1775 8.275 8.238 0.037 1 1 54 . 9 1 1 A 7 7 ARG HA H 1775 4.648 4.349 0.299 1 1 61 . 9 1 1 A 7 7 ARG CA C 1775 53.827 54.337 -0.510 1 1 62 . 9 1 1 A 7 7 ARG CB C 1775 30.417 30.874 -0.457 1 1 65 . 9 1 1 A 7 7 ARG N N 1775 124.017 123.147 0.870 1 1 66 . 9 1 1 A 8 8 PRO HA H 1776 4.433 4.622 -0.189 1 1 73 . 9 1 1 A 8 8 PRO CA C 1776 63.036 62.468 0.568 1 1 74 . 9 1 1 A 8 8 PRO CB C 1776 32.201 32.783 -0.582 1 1 77 . 9 1 1 A 9 9 LEU H H 1777 8.349 8.309 0.040 1 1 78 . 9 1 1 A 9 9 LEU HA H 1777 4.365 4.195 0.170 1 1 88 . 9 1 1 A 9 9 LEU CA C 1777 55.275 55.242 0.033 1 1 89 . 9 1 1 A 9 9 LEU CB C 1777 42.376 41.102 1.274 1 1 93 . 9 1 1 A 9 9 LEU N N 1777 123.820 118.263 5.557 1 1 94 . 9 1 1 A 10 10 VAL H H 1778 7.989 7.661 0.328 1 1 95 . 9 1 1 A 10 10 VAL HA H 1778 4.182 4.504 -0.322 1 1 103 . 9 1 1 A 10 10 VAL CA C 1778 62.141 60.103 2.038 1 1 104 . 9 1 1 A 10 10 VAL CB C 1778 33.175 34.717 -1.542 1 1 106 . 9 1 1 A 10 10 VAL N N 1778 121.714 117.940 3.774 1 1 107 . 9 1 1 A 11 11 GLY H H 1779 8.450 8.383 0.067 1 1 108 . 9 1 1 A 11 11 GLY HA2 H 1779 4.002 4.278 -0.276 1 1 109 . 9 1 1 A 11 11 GLY HA3 H 1779 4.002 4.278 -0.276 1 1 110 . 9 1 1 A 11 11 GLY CA C 1779 45.297 45.019 0.278 1 1 111 . 9 1 1 A 11 11 GLY N N 1779 113.826 112.753 1.073 1 1 112 . 9 1 1 A 12 12 VAL H H 1780 8.013 8.742 -0.729 1 1 113 . 9 1 1 A 12 12 VAL HA H 1780 4.136 4.053 0.083 1 1 121 . 9 1 1 A 12 12 VAL CA C 1780 62.466 62.889 -0.423 1 1 122 . 9 1 1 A 12 12 VAL CB C 1780 32.752 31.538 1.214 1 1 125 . 9 1 1 A 12 12 VAL N N 1780 120.109 120.709 -0.600 1 1 126 . 9 1 1 A 13 13 ASN H H 1781 8.528 9.172 -0.644 1 1 127 . 9 1 1 A 13 13 ASN HA H 1781 4.712 4.548 0.164 1 1 132 . 9 1 1 A 13 13 ASN CA C 1781 53.485 53.394 0.091 1 1 133 . 9 1 1 A 13 13 ASN CB C 1781 38.996 39.477 -0.481 1 1 134 . 9 1 1 A 13 13 ASN N N 1781 122.648 126.307 -3.659 1 1 136 . 9 1 1 A 14 14 GLY H H 1782 8.283 7.904 0.379 1 1 137 . 9 1 1 A 14 14 GLY HA2 H 1782 3.929 3.899 0.030 1 1 138 . 9 1 1 A 14 14 GLY HA3 H 1782 3.929 3.901 0.028 1 1 139 . 9 1 1 A 14 14 GLY CA C 1782 45.531 46.007 -0.476 1 1 140 . 9 1 1 A 14 14 GLY N N 1782 110.229 107.822 2.407 1 1 141 . 9 1 1 A 15 15 LEU H H 1783 7.925 7.727 0.198 1 1 142 . 9 1 1 A 15 15 LEU HA H 1783 4.340 4.183 0.157 1 1 152 . 9 1 1 A 15 15 LEU CA C 1783 55.045 55.221 -0.176 1 1 153 . 9 1 1 A 15 15 LEU CB C 1783 42.682 42.164 0.518 1 1 157 . 9 1 1 A 15 15 LEU N N 1783 122.626 121.083 1.543 1 1 158 . 9 1 1 A 16 16 ASP H H 1784 8.360 8.747 -0.387 1 1 159 . 9 1 1 A 16 16 ASP HA H 1784 4.747 4.907 -0.160 1 1 162 . 9 1 1 A 16 16 ASP CA C 1784 53.939 53.037 0.902 1 1 163 . 9 1 1 A 16 16 ASP CB C 1784 41.150 41.987 -0.837 1 1 164 . 9 1 1 A 16 16 ASP N N 1784 122.868 124.839 -1.971 1 1 165 . 9 1 1 A 17 17 VAL H H 1785 8.201 7.523 0.678 1 1 166 . 9 1 1 A 17 17 VAL HA H 1785 4.237 3.989 0.248 1 1 174 . 9 1 1 A 17 17 VAL CA C 1785 62.881 61.809 1.072 1 1 175 . 9 1 1 A 17 17 VAL CB C 1785 31.967 32.679 -0.712 1 1 178 . 9 1 1 A 17 17 VAL N N 1785 121.110 118.405 2.705 1 1 179 . 9 1 1 A 18 18 THR H H 1786 8.291 8.919 -0.628 1 1 180 . 9 1 1 A 18 18 THR HA H 1786 4.466 4.561 -0.095 1 1 185 . 9 1 1 A 18 18 THR CA C 1786 62.388 62.980 -0.592 1 1 186 . 9 1 1 A 18 18 THR CB C 1786 69.719 71.436 -1.717 1 1 188 . 9 1 1 A 18 18 THR N N 1786 115.267 119.692 -4.425 1 1 189 . 9 1 1 A 19 19 SER H H 1787 8.148 8.313 -0.165 1 1 190 . 9 1 1 A 19 19 SER HA H 1787 4.542 4.510 0.032 1 1 193 . 9 1 1 A 19 19 SER CA C 1787 59.096 58.109 0.987 1 1 194 . 9 1 1 A 19 19 SER CB C 1787 63.993 61.603 2.390 1 1 195 . 9 1 1 A 19 19 SER N N 1787 118.576 117.374 1.202 1 1 196 . 9 1 1 A 20 20 LEU H H 1788 8.263 8.011 0.252 1 1 197 . 9 1 1 A 20 20 LEU HA H 1788 4.243 4.253 -0.010 1 1 207 . 9 1 1 A 20 20 LEU CA C 1788 54.087 54.825 -0.738 1 1 208 . 9 1 1 A 20 20 LEU CB C 1788 43.006 42.121 0.885 1 1 212 . 9 1 1 A 20 20 LEU N N 1788 125.834 126.340 -0.506 1 1 213 . 9 1 1 A 21 21 ARG H H 1789 8.191 8.125 0.066 1 1 214 . 9 1 1 A 21 21 ARG HA H 1789 4.080 4.183 -0.103 1 1 222 . 9 1 1 A 21 21 ARG CA C 1789 54.894 54.194 0.700 1 1 223 . 9 1 1 A 21 21 ARG CB C 1789 30.881 30.831 0.050 1 1 226 . 9 1 1 A 21 21 ARG N N 1789 127.213 122.628 4.585 1 1 228 . 9 1 1 A 22 22 PRO HA H 1790 4.441 4.663 -0.222 1 1 233 . 9 1 1 A 22 22 PRO CA C 1790 62.882 62.916 -0.034 1 1 234 . 9 1 1 A 22 22 PRO CB C 1790 32.204 32.300 -0.096 1 1 237 . 9 1 1 A 23 23 PHE H H 1791 8.336 8.673 -0.337 1 1 238 . 9 1 1 A 23 23 PHE HA H 1791 4.701 5.136 -0.435 1 1 246 . 9 1 1 A 23 23 PHE CA C 1791 57.504 56.644 0.860 1 1 247 . 9 1 1 A 23 23 PHE CB C 1791 42.192 42.087 0.105 1 1 251 . 9 1 1 A 23 23 PHE N N 1791 122.145 124.085 -1.940 1 1 252 . 9 1 1 A 24 24 ASP H H 1792 6.954 8.504 -1.550 1 1 253 . 9 1 1 A 24 24 ASP HA H 1792 5.039 5.037 0.002 1 1 256 . 9 1 1 A 24 24 ASP CA C 1792 52.871 52.365 0.506 1 1 257 . 9 1 1 A 24 24 ASP CB C 1792 44.696 45.023 -0.327 1 1 258 . 9 1 1 A 24 24 ASP N N 1792 127.481 125.367 2.114 1 1 259 . 9 1 1 A 25 25 LEU H H 1793 8.372 8.684 -0.312 1 1 260 . 9 1 1 A 25 25 LEU HA H 1793 4.336 4.827 -0.491 1 1 270 . 9 1 1 A 25 25 LEU CA C 1793 54.860 53.140 1.720 1 1 271 . 9 1 1 A 25 25 LEU CB C 1793 47.575 46.143 1.432 1 1 274 . 9 1 1 A 25 25 LEU N N 1793 123.241 121.566 1.675 1 1 275 . 9 1 1 A 26 26 VAL H H 1794 8.489 8.778 -0.289 1 1 276 . 9 1 1 A 26 26 VAL HA H 1794 4.903 5.062 -0.159 1 1 284 . 9 1 1 A 26 26 VAL CA C 1794 61.669 59.406 2.263 1 1 285 . 9 1 1 A 26 26 VAL CB C 1794 32.458 34.713 -2.255 1 1 288 . 9 1 1 A 26 26 VAL N N 1794 128.849 120.726 8.123 1 1 289 . 9 1 1 A 27 27 ILE H H 1795 9.101 9.343 -0.242 1 1 290 . 9 1 1 A 27 27 ILE HA H 1795 4.701 4.572 0.129 1 1 300 . 9 1 1 A 27 27 ILE CA C 1795 57.433 57.454 -0.021 1 1 301 . 9 1 1 A 27 27 ILE CB C 1795 41.865 41.771 0.094 1 1 305 . 9 1 1 A 27 27 ILE N N 1795 127.511 128.164 -0.653 1 1 306 . 9 1 1 A 28 28 PRO HA H 1796 4.838 4.862 -0.024 1 1 313 . 9 1 1 A 28 28 PRO CA C 1796 62.406 62.744 -0.338 1 1 314 . 9 1 1 A 28 28 PRO CB C 1796 30.684 31.652 -0.968 1 1 317 . 9 1 1 A 29 29 PHE H H 1797 8.255 8.492 -0.237 1 1 318 . 9 1 1 A 29 29 PHE HA H 1797 4.151 4.944 -0.793 1 1 326 . 9 1 1 A 29 29 PHE CA C 1797 60.405 58.247 2.158 1 1 327 . 9 1 1 A 29 29 PHE CB C 1797 41.395 42.153 -0.758 1 1 331 . 9 1 1 A 29 29 PHE N N 1797 128.572 123.103 5.469 1 1 332 . 9 1 1 A 30 30 THR H H 1798 7.433 7.830 -0.397 1 1 333 . 9 1 1 A 30 30 THR HA H 1798 4.108 4.962 -0.854 1 1 338 . 9 1 1 A 30 30 THR CA C 1798 61.473 61.114 0.359 1 1 339 . 9 1 1 A 30 30 THR CB C 1798 69.324 71.603 -2.279 1 1 341 . 9 1 1 A 30 30 THR N N 1798 123.124 118.839 4.285 1 1 342 . 9 1 1 A 31 31 ILE H H 1799 8.402 8.991 -0.589 1 1 343 . 9 1 1 A 31 31 ILE HA H 1799 3.653 4.459 -0.806 1 1 353 . 9 1 1 A 31 31 ILE CA C 1799 61.802 61.744 0.058 1 1 354 . 9 1 1 A 31 31 ILE CB C 1799 38.548 37.542 1.006 1 1 358 . 9 1 1 A 31 31 ILE N N 1799 128.616 127.953 0.663 1 1 359 . 9 1 1 A 32 32 LYS H H 1800 7.742 8.553 -0.811 1 1 360 . 9 1 1 A 32 32 LYS HA H 1800 4.558 4.749 -0.191 1 1 365 . 9 1 1 A 32 32 LYS CA C 1800 56.566 55.018 1.548 1 1 366 . 9 1 1 A 32 32 LYS CB C 1800 31.982 34.448 -2.466 1 1 368 . 9 1 1 A 32 32 LYS N N 1800 128.656 126.547 2.109 1 1 369 . 9 1 1 A 33 33 LYS HA H 1801 4.531 4.412 0.119 1 1 378 . 9 1 1 A 33 33 LYS CA C 1801 56.310 57.918 -1.608 1 1 379 . 9 1 1 A 33 33 LYS CB C 1801 33.027 32.818 0.209 1 1 383 . 9 1 1 A 34 34 GLY H H 1802 8.088 8.609 -0.521 1 1 384 . 9 1 1 A 34 34 GLY HA2 H 1802 4.159 4.086 0.073 1 1 385 . 9 1 1 A 34 34 GLY HA3 H 1802 3.712 4.153 -0.441 1 1 386 . 9 1 1 A 34 34 GLY CA C 1802 45.302 44.412 0.890 1 1 387 . 9 1 1 A 34 34 GLY N N 1802 110.338 113.297 -2.959 1 1 388 . 9 1 1 A 35 35 GLU H H 1803 8.219 7.925 0.294 1 1 389 . 9 1 1 A 35 35 GLU HA H 1803 4.692 4.915 -0.223 1 1 394 . 9 1 1 A 35 35 GLU CA C 1803 55.160 55.216 -0.056 1 1 395 . 9 1 1 A 35 35 GLU CB C 1803 32.407 33.924 -1.517 1 1 397 . 9 1 1 A 35 35 GLU N N 1803 119.576 120.050 -0.474 1 1 398 . 9 1 1 A 36 36 ILE H H 1804 8.869 8.804 0.065 1 1 399 . 9 1 1 A 36 36 ILE HA H 1804 5.468 5.197 0.271 1 1 409 . 9 1 1 A 36 36 ILE CA C 1804 58.861 58.748 0.113 1 1 410 . 9 1 1 A 36 36 ILE CB C 1804 41.007 41.440 -0.433 1 1 414 . 9 1 1 A 36 36 ILE N N 1804 128.141 123.902 4.239 1 1 415 . 9 1 1 A 37 37 THR H H 1805 9.075 8.903 0.172 1 1 416 . 9 1 1 A 37 37 THR HA H 1805 4.703 5.136 -0.433 1 1 421 . 9 1 1 A 37 37 THR CA C 1805 59.932 60.054 -0.122 1 1 422 . 9 1 1 A 37 37 THR CB C 1805 72.441 72.291 0.150 1 1 424 . 9 1 1 A 37 37 THR N N 1805 119.846 116.817 3.029 1 1 425 . 9 1 1 A 38 38 GLY H H 1806 8.468 8.379 0.089 1 1 426 . 9 1 1 A 38 38 GLY HA2 H 1806 5.076 4.295 0.781 1 1 427 . 9 1 1 A 38 38 GLY HA3 H 1806 3.503 4.326 -0.823 1 1 428 . 9 1 1 A 38 38 GLY CA C 1806 45.593 45.812 -0.219 1 1 429 . 9 1 1 A 38 38 GLY N N 1806 107.815 108.360 -0.545 1 1 430 . 9 1 1 A 39 39 GLU H H 1807 8.519 8.613 -0.094 1 1 431 . 9 1 1 A 39 39 GLU HA H 1807 4.713 5.201 -0.488 1 1 436 . 9 1 1 A 39 39 GLU CA C 1807 56.936 55.485 1.451 1 1 437 . 9 1 1 A 39 39 GLU CB C 1807 34.937 33.841 1.096 1 1 439 . 9 1 1 A 39 39 GLU N N 1807 120.173 119.915 0.258 1 1 440 . 9 1 1 A 40 40 VAL H H 1808 9.156 9.319 -0.163 1 1 441 . 9 1 1 A 40 40 VAL HA H 1808 4.778 5.068 -0.290 1 1 449 . 9 1 1 A 40 40 VAL CA C 1808 60.574 60.960 -0.386 1 1 450 . 9 1 1 A 40 40 VAL CB C 1808 34.168 34.214 -0.046 1 1 452 . 9 1 1 A 40 40 VAL N N 1808 126.330 125.896 0.434 1 1 453 . 9 1 1 A 41 41 ARG H H 1809 9.044 8.948 0.096 1 1 454 . 9 1 1 A 41 41 ARG HA H 1809 4.778 4.854 -0.076 1 1 462 . 9 1 1 A 41 41 ARG CA C 1809 55.317 54.576 0.741 1 1 463 . 9 1 1 A 41 41 ARG CB C 1809 31.940 33.006 -1.066 1 1 466 . 9 1 1 A 41 41 ARG N N 1809 127.098 126.520 0.578 1 1 468 . 9 1 1 A 42 42 MET H H 1810 8.264 8.727 -0.463 1 1 469 . 9 1 1 A 42 42 MET HA H 1810 4.050 4.605 -0.555 1 1 477 . 9 1 1 A 42 42 MET CA C 1810 53.716 53.721 -0.005 1 1 478 . 9 1 1 A 42 42 MET CB C 1810 32.779 33.221 -0.442 1 1 481 . 9 1 1 A 42 42 MET N N 1810 123.461 122.866 0.595 1 1 482 . 9 1 1 A 43 43 PRO HA H 1811 4.179 4.154 0.025 1 1 489 . 9 1 1 A 43 43 PRO CA C 1811 66.422 64.717 1.705 1 1 490 . 9 1 1 A 43 43 PRO CB C 1811 31.462 31.765 -0.303 1 1 493 . 9 1 1 A 44 44 SER H H 1812 8.860 7.739 1.121 1 1 494 . 9 1 1 A 44 44 SER HA H 1812 5.516 4.484 1.032 1 1 497 . 9 1 1 A 44 44 SER CA C 1812 59.937 58.559 1.378 1 1 498 . 9 1 1 A 44 44 SER CB C 1812 62.755 63.388 -0.633 1 1 499 . 9 1 1 A 44 44 SER N N 1812 112.267 111.667 0.600 1 1 500 . 9 1 1 A 45 45 GLY H H 1813 8.368 8.964 -0.596 1 1 501 . 9 1 1 A 45 45 GLY HA2 H 1813 4.461 3.909 0.552 1 1 502 . 9 1 1 A 45 45 GLY HA3 H 1813 3.569 3.917 -0.348 1 1 503 . 9 1 1 A 45 45 GLY CA C 1813 44.525 46.289 -1.764 1 1 504 . 9 1 1 A 45 45 GLY N N 1813 112.727 110.489 2.238 1 1 505 . 9 1 1 A 46 46 LYS H H 1814 7.126 7.427 -0.301 1 1 506 . 9 1 1 A 46 46 LYS HA H 1814 4.206 4.931 -0.725 1 1 515 . 9 1 1 A 46 46 LYS CA C 1814 57.460 54.291 3.169 1 1 516 . 9 1 1 A 46 46 LYS CB C 1814 33.453 36.621 -3.168 1 1 520 . 9 1 1 A 46 46 LYS N N 1814 122.101 114.981 7.120 1 1 521 . 9 1 1 A 47 47 VAL H H 1815 8.056 8.653 -0.597 1 1 522 . 9 1 1 A 47 47 VAL HA H 1815 5.400 5.140 0.260 1 1 530 . 9 1 1 A 47 47 VAL CA C 1815 60.048 59.410 0.638 1 1 531 . 9 1 1 A 47 47 VAL CB C 1815 35.044 36.256 -1.212 1 1 534 . 9 1 1 A 47 47 VAL N N 1815 118.680 115.643 3.037 1 1 535 . 9 1 1 A 48 48 ALA H H 1816 9.110 8.600 0.510 1 1 536 . 9 1 1 A 48 48 ALA HA H 1816 4.804 4.908 -0.104 1 1 540 . 9 1 1 A 48 48 ALA CA C 1816 50.808 51.219 -0.411 1 1 541 . 9 1 1 A 48 48 ALA CB C 1816 24.108 23.902 0.206 1 1 542 . 9 1 1 A 48 48 ALA N N 1816 128.274 123.936 4.338 1 1 543 . 9 1 1 A 49 49 GLN H H 1817 8.725 8.506 0.219 1 1 544 . 9 1 1 A 49 49 GLN HA H 1817 5.069 4.819 0.250 1 1 551 . 9 1 1 A 49 49 GLN CA C 1817 53.524 52.226 1.298 1 1 552 . 9 1 1 A 49 49 GLN CB C 1817 30.432 30.334 0.098 1 1 554 . 9 1 1 A 49 49 GLN N N 1817 120.102 117.288 2.814 1 1 556 . 9 1 1 A 50 50 PRO HA H 1818 5.136 4.864 0.272 1 1 563 . 9 1 1 A 50 50 PRO CA C 1818 61.966 62.462 -0.496 1 1 564 . 9 1 1 A 50 50 PRO CB C 1818 32.722 32.756 -0.034 1 1 567 . 9 1 1 A 51 51 THR H H 1819 9.072 8.685 0.387 1 1 568 . 9 1 1 A 51 51 THR HA H 1819 4.566 5.050 -0.484 1 1 573 . 9 1 1 A 51 51 THR CA C 1819 62.695 60.923 1.772 1 1 574 . 9 1 1 A 51 51 THR CB C 1819 70.056 70.656 -0.600 1 1 576 . 9 1 1 A 51 51 THR N N 1819 117.512 113.453 4.059 1 1 577 . 9 1 1 A 52 52 ILE H H 1820 8.900 9.283 -0.383 1 1 578 . 9 1 1 A 52 52 ILE HA H 1820 4.905 5.156 -0.251 1 1 588 . 9 1 1 A 52 52 ILE CA C 1820 60.869 59.564 1.305 1 1 589 . 9 1 1 A 52 52 ILE CB C 1820 39.670 40.232 -0.562 1 1 593 . 9 1 1 A 52 52 ILE N N 1820 129.513 128.438 1.075 1 1 594 . 9 1 1 A 53 53 THR H H 1821 9.200 9.359 -0.159 1 1 595 . 9 1 1 A 53 53 THR HA H 1821 4.541 4.848 -0.307 1 1 600 . 9 1 1 A 53 53 THR CA C 1821 61.084 61.778 -0.694 1 1 601 . 9 1 1 A 53 53 THR CB C 1821 71.410 71.803 -0.393 1 1 603 . 9 1 1 A 53 53 THR N N 1821 125.271 123.627 1.644 1 1 604 . 9 1 1 A 54 54 ASP H H 1822 8.918 8.735 0.183 1 1 605 . 9 1 1 A 54 54 ASP HA H 1822 4.756 4.798 -0.042 1 1 608 . 9 1 1 A 54 54 ASP CA C 1822 53.906 54.478 -0.572 1 1 609 . 9 1 1 A 54 54 ASP CB C 1822 41.443 41.490 -0.047 1 1 610 . 9 1 1 A 54 54 ASP N N 1822 126.647 127.006 -0.359 1 1 611 . 9 1 1 A 55 55 ASN H H 1823 8.342 9.029 -0.687 1 1 612 . 9 1 1 A 55 55 ASN HA H 1823 4.704 4.686 0.018 1 1 617 . 9 1 1 A 55 55 ASN CA C 1823 54.421 52.984 1.437 1 1 618 . 9 1 1 A 55 55 ASN CB C 1823 38.557 38.875 -0.318 1 1 619 . 9 1 1 A 55 55 ASN N N 1823 126.271 124.186 2.085 1 1 621 . 9 1 1 A 56 56 LYS H H 1824 9.232 7.777 1.455 1 1 622 . 9 1 1 A 56 56 LYS HA H 1824 4.099 4.004 0.095 1 1 631 . 9 1 1 A 56 56 LYS CA C 1824 58.015 57.942 0.073 1 1 632 . 9 1 1 A 56 56 LYS CB C 1824 28.691 30.236 -1.545 1 1 636 . 9 1 1 A 56 56 LYS N N 1824 115.352 115.022 0.330 1 1 637 . 9 1 1 A 57 57 ASP H H 1825 7.905 8.094 -0.189 1 1 638 . 9 1 1 A 57 57 ASP HA H 1825 4.791 4.802 -0.011 1 1 641 . 9 1 1 A 57 57 ASP CA C 1825 52.401 53.768 -1.367 1 1 642 . 9 1 1 A 57 57 ASP CB C 1825 41.166 41.040 0.126 1 1 643 . 9 1 1 A 57 57 ASP N N 1825 119.741 118.965 0.776 1 1 644 . 9 1 1 A 58 58 GLY H H 1826 8.930 8.918 0.012 1 1 645 . 9 1 1 A 58 58 GLY HA2 H 1826 4.265 3.914 0.351 1 1 646 . 9 1 1 A 58 58 GLY HA3 H 1826 3.712 3.918 -0.206 1 1 647 . 9 1 1 A 58 58 GLY CA C 1826 44.870 45.486 -0.616 1 1 648 . 9 1 1 A 58 58 GLY N N 1826 109.578 108.234 1.344 1 1 649 . 9 1 1 A 59 59 THR H H 1827 8.004 7.661 0.343 1 1 650 . 9 1 1 A 59 59 THR HA H 1827 5.394 5.102 0.292 1 1 655 . 9 1 1 A 59 59 THR CA C 1827 60.262 59.196 1.066 1 1 656 . 9 1 1 A 59 59 THR CB C 1827 73.892 72.510 1.382 1 1 658 . 9 1 1 A 59 59 THR N N 1827 112.179 110.285 1.894 1 1 659 . 9 1 1 A 60 60 VAL H H 1828 8.822 9.368 -0.546 1 1 660 . 9 1 1 A 60 60 VAL HA H 1828 5.124 4.944 0.180 1 1 668 . 9 1 1 A 60 60 VAL CA C 1828 59.430 59.787 -0.357 1 1 669 . 9 1 1 A 60 60 VAL CB C 1828 35.088 34.349 0.739 1 1 672 . 9 1 1 A 60 60 VAL N N 1828 115.300 117.359 -2.059 1 1 673 . 9 1 1 A 61 61 THR H H 1829 9.115 9.121 -0.006 1 1 674 . 9 1 1 A 61 61 THR HA H 1829 5.128 4.940 0.188 1 1 679 . 9 1 1 A 61 61 THR CA C 1829 61.934 62.062 -0.128 1 1 680 . 9 1 1 A 61 61 THR CB C 1829 70.561 70.072 0.489 1 1 682 . 9 1 1 A 61 61 THR N N 1829 121.210 120.417 0.793 1 1 683 . 9 1 1 A 62 62 VAL H H 1830 9.530 9.269 0.261 1 1 684 . 9 1 1 A 62 62 VAL HA H 1830 4.803 5.079 -0.276 1 1 692 . 9 1 1 A 62 62 VAL CA C 1830 60.580 60.594 -0.014 1 1 693 . 9 1 1 A 62 62 VAL CB C 1830 33.747 34.316 -0.569 1 1 696 . 9 1 1 A 62 62 VAL N N 1830 129.896 126.150 3.746 1 1 697 . 9 1 1 A 63 63 ARG H H 1831 8.879 9.171 -0.292 1 1 698 . 9 1 1 A 63 63 ARG HA H 1831 5.282 4.960 0.322 1 1 705 . 9 1 1 A 63 63 ARG CA C 1831 54.759 54.046 0.713 1 1 706 . 9 1 1 A 63 63 ARG CB C 1831 34.410 34.167 0.243 1 1 709 . 9 1 1 A 63 63 ARG N N 1831 125.701 125.915 -0.214 1 1 710 . 9 1 1 A 64 64 TYR H H 1832 8.878 8.574 0.304 1 1 711 . 9 1 1 A 64 64 TYR HA H 1832 4.888 5.013 -0.125 1 1 718 . 9 1 1 A 64 64 TYR CA C 1832 57.694 57.760 -0.066 1 1 719 . 9 1 1 A 64 64 TYR CB C 1832 42.389 41.900 0.489 1 1 722 . 9 1 1 A 64 64 TYR N N 1832 122.731 123.749 -1.018 1 1 723 . 9 1 1 A 65 65 ALA H H 1833 7.925 8.325 -0.400 1 1 724 . 9 1 1 A 65 65 ALA HA H 1833 4.736 4.264 0.472 1 1 728 . 9 1 1 A 65 65 ALA CA C 1833 47.938 49.646 -1.708 1 1 729 . 9 1 1 A 65 65 ALA CB C 1833 18.320 19.333 -1.013 1 1 730 . 9 1 1 A 65 65 ALA N N 1833 135.415 129.991 5.424 1 1 731 . 9 1 1 A 66 66 PRO HA H 1834 4.198 4.430 -0.232 1 1 738 . 9 1 1 A 66 66 PRO CA C 1834 62.701 62.206 0.495 1 1 739 . 9 1 1 A 66 66 PRO CB C 1834 34.445 31.994 2.451 1 1 742 . 9 1 1 A 67 67 SER H H 1835 9.019 8.183 0.836 1 1 743 . 9 1 1 A 67 67 SER HA H 1835 4.555 4.603 -0.048 1 1 746 . 9 1 1 A 67 67 SER CA C 1835 57.320 58.055 -0.735 1 1 747 . 9 1 1 A 67 67 SER CB C 1835 64.778 64.286 0.492 1 1 748 . 9 1 1 A 67 67 SER N N 1835 112.422 114.169 -1.747 1 1 749 . 9 1 1 A 68 68 GLU H H 1836 7.625 7.709 -0.084 1 1 750 . 9 1 1 A 68 68 GLU HA H 1836 4.513 4.727 -0.214 1 1 755 . 9 1 1 A 68 68 GLU CA C 1836 54.777 54.791 -0.014 1 1 756 . 9 1 1 A 68 68 GLU CB C 1836 33.981 34.901 -0.920 1 1 758 . 9 1 1 A 68 68 GLU N N 1836 123.025 119.750 3.275 1 1 759 . 9 1 1 A 69 69 ALA H H 1837 8.133 8.465 -0.332 1 1 760 . 9 1 1 A 69 69 ALA HA H 1837 4.088 4.437 -0.349 1 1 764 . 9 1 1 A 69 69 ALA CA C 1837 51.070 51.814 -0.744 1 1 765 . 9 1 1 A 69 69 ALA CB C 1837 19.665 19.964 -0.299 1 1 766 . 9 1 1 A 69 69 ALA N N 1837 122.311 124.352 -2.041 1 1 767 . 9 1 1 A 70 70 GLY H H 1838 9.120 8.290 0.830 1 1 768 . 9 1 1 A 70 70 GLY HA2 H 1838 4.453 4.064 0.389 1 1 769 . 9 1 1 A 70 70 GLY HA3 H 1838 2.953 4.132 -1.179 1 1 770 . 9 1 1 A 70 70 GLY CA C 1838 43.362 43.531 -0.169 1 1 771 . 9 1 1 A 70 70 GLY N N 1838 107.031 105.920 1.111 1 1 772 . 9 1 1 A 71 71 LEU H H 1839 9.096 8.346 0.750 1 1 773 . 9 1 1 A 71 71 LEU HA H 1839 4.336 4.831 -0.495 1 1 783 . 9 1 1 A 71 71 LEU CA C 1839 56.657 53.842 2.815 1 1 784 . 9 1 1 A 71 71 LEU CB C 1839 42.032 44.041 -2.009 1 1 788 . 9 1 1 A 71 71 LEU N N 1839 127.931 122.005 5.926 1 1 789 . 9 1 1 A 72 72 HIS H H 1840 9.359 9.395 -0.036 1 1 790 . 9 1 1 A 72 72 HIS HA H 1840 4.595 5.020 -0.425 1 1 796 . 9 1 1 A 72 72 HIS CA C 1840 54.539 53.759 0.780 1 1 797 . 9 1 1 A 72 72 HIS CB C 1840 31.421 33.363 -1.942 1 1 800 . 9 1 1 A 72 72 HIS N N 1840 128.527 124.785 3.742 1 1 802 . 9 1 1 A 73 73 GLU H H 1841 7.925 8.523 -0.598 1 1 803 . 9 1 1 A 73 73 GLU HA H 1841 5.142 5.269 -0.127 1 1 808 . 9 1 1 A 73 73 GLU CA C 1841 54.381 54.644 -0.263 1 1 809 . 9 1 1 A 73 73 GLU CB C 1841 34.043 33.684 0.359 1 1 811 . 9 1 1 A 73 73 GLU N N 1841 119.347 118.236 1.111 1 1 812 . 9 1 1 A 74 74 MET H H 1842 9.383 9.271 0.112 1 1 813 . 9 1 1 A 74 74 MET HA H 1842 5.548 5.341 0.207 1 1 821 . 9 1 1 A 74 74 MET CA C 1842 53.859 54.339 -0.480 1 1 822 . 9 1 1 A 74 74 MET CB C 1842 38.571 35.725 2.846 1 1 825 . 9 1 1 A 74 74 MET N N 1842 124.747 121.163 3.584 1 1 826 . 9 1 1 A 75 75 ASP H H 1843 9.005 9.190 -0.185 1 1 827 . 9 1 1 A 75 75 ASP HA H 1843 5.277 5.296 -0.019 1 1 830 . 9 1 1 A 75 75 ASP CA C 1843 52.774 53.723 -0.949 1 1 831 . 9 1 1 A 75 75 ASP CB C 1843 43.493 42.897 0.596 1 1 832 . 9 1 1 A 75 75 ASP N N 1843 128.148 126.053 2.095 1 1 833 . 9 1 1 A 76 76 ILE H H 1844 9.434 8.711 0.723 1 1 834 . 9 1 1 A 76 76 ILE HA H 1844 4.672 4.919 -0.247 1 1 844 . 9 1 1 A 76 76 ILE CA C 1844 60.715 59.794 0.921 1 1 845 . 9 1 1 A 76 76 ILE CB C 1844 39.470 41.647 -2.177 1 1 849 . 9 1 1 A 76 76 ILE N N 1844 124.097 123.073 1.024 1 1 850 . 9 1 1 A 77 77 ARG H H 1845 8.888 9.148 -0.260 1 1 851 . 9 1 1 A 77 77 ARG HA H 1845 5.050 4.838 0.212 1 1 859 . 9 1 1 A 77 77 ARG CA C 1845 53.780 54.123 -0.343 1 1 860 . 9 1 1 A 77 77 ARG CB C 1845 34.564 33.587 0.977 1 1 863 . 9 1 1 A 77 77 ARG N N 1845 124.944 124.258 0.686 1 1 865 . 9 1 1 A 78 78 TYR H H 1846 8.974 9.213 -0.239 1 1 866 . 9 1 1 A 78 78 TYR HA H 1846 5.151 4.927 0.224 1 1 873 . 9 1 1 A 78 78 TYR CA C 1846 55.909 57.597 -1.688 1 1 874 . 9 1 1 A 78 78 TYR CB C 1846 41.732 40.859 0.873 1 1 877 . 9 1 1 A 78 78 TYR N N 1846 121.774 124.158 -2.384 1 1 878 . 9 1 1 A 79 79 ASP H H 1847 9.026 9.268 -0.242 1 1 879 . 9 1 1 A 79 79 ASP HA H 1847 4.127 4.197 -0.070 1 1 882 . 9 1 1 A 79 79 ASP CA C 1847 55.808 55.063 0.745 1 1 883 . 9 1 1 A 79 79 ASP CB C 1847 39.181 39.546 -0.365 1 1 884 . 9 1 1 A 79 79 ASP N N 1847 131.304 127.958 3.346 1 1 885 . 9 1 1 A 80 80 ASN H H 1848 8.608 8.558 0.050 1 1 886 . 9 1 1 A 80 80 ASN HA H 1848 3.990 4.308 -0.318 1 1 891 . 9 1 1 A 80 80 ASN CA C 1848 55.149 54.885 0.264 1 1 892 . 9 1 1 A 80 80 ASN CB C 1848 38.470 37.022 1.448 1 1 893 . 9 1 1 A 80 80 ASN N N 1848 108.490 109.241 -0.751 1 1 895 . 9 1 1 A 81 81 MET H H 1849 7.820 7.956 -0.136 1 1 896 . 9 1 1 A 81 81 MET HA H 1849 4.819 4.833 -0.014 1 1 904 . 9 1 1 A 81 81 MET CA C 1849 53.852 54.161 -0.309 1 1 905 . 9 1 1 A 81 81 MET CB C 1849 34.665 33.317 1.348 1 1 908 . 9 1 1 A 81 81 MET N N 1849 121.878 118.863 3.015 1 1 909 . 9 1 1 A 82 82 HIS H H 1850 8.575 8.831 -0.256 1 1 910 . 9 1 1 A 82 82 HIS HA H 1850 4.539 4.662 -0.123 1 1 915 . 9 1 1 A 82 82 HIS CA C 1850 58.819 57.286 1.533 1 1 916 . 9 1 1 A 82 82 HIS CB C 1850 32.419 30.585 1.834 1 1 919 . 9 1 1 A 82 82 HIS N N 1850 124.291 121.983 2.308 1 1 920 . 9 1 1 A 83 83 ILE H H 1851 8.333 8.104 0.229 1 1 921 . 9 1 1 A 83 83 ILE HA H 1851 4.608 4.399 0.209 1 1 931 . 9 1 1 A 83 83 ILE CA C 1851 60.727 59.745 0.982 1 1 932 . 9 1 1 A 83 83 ILE CB C 1851 35.928 37.774 -1.846 1 1 936 . 9 1 1 A 83 83 ILE N N 1851 120.786 121.248 -0.462 1 1 937 . 9 1 1 A 84 84 PRO HA H 1852 4.426 4.329 0.097 1 1 944 . 9 1 1 A 84 84 PRO CA C 1852 65.249 64.204 1.045 1 1 945 . 9 1 1 A 84 84 PRO CB C 1852 31.120 31.495 -0.375 1 1 948 . 9 1 1 A 85 85 GLY H H 1853 8.498 8.837 -0.339 1 1 949 . 9 1 1 A 85 85 GLY HA2 H 1853 4.284 3.950 0.334 1 1 950 . 9 1 1 A 85 85 GLY HA3 H 1853 3.397 3.956 -0.559 1 1 951 . 9 1 1 A 85 85 GLY CA C 1853 44.913 45.300 -0.387 1 1 952 . 9 1 1 A 85 85 GLY N N 1853 114.093 113.196 0.897 1 1 953 . 9 1 1 A 86 86 SER H H 1854 7.823 8.180 -0.357 1 1 954 . 9 1 1 A 86 86 SER HA H 1854 4.834 4.717 0.117 1 1 957 . 9 1 1 A 86 86 SER CA C 1854 55.628 55.726 -0.098 1 1 958 . 9 1 1 A 86 86 SER CB C 1854 63.063 64.175 -1.112 1 1 959 . 9 1 1 A 86 86 SER N N 1854 112.722 116.868 -4.146 1 1 960 . 9 1 1 A 87 87 PRO HA H 1855 5.681 4.844 0.837 1 1 967 . 9 1 1 A 87 87 PRO CA C 1855 63.079 62.349 0.730 1 1 968 . 9 1 1 A 87 87 PRO CB C 1855 34.406 32.976 1.430 1 1 971 . 9 1 1 A 88 88 LEU H H 1856 9.168 8.729 0.439 1 1 972 . 9 1 1 A 88 88 LEU HA H 1856 4.909 5.120 -0.211 1 1 982 . 9 1 1 A 88 88 LEU CA C 1856 53.839 53.374 0.465 1 1 983 . 9 1 1 A 88 88 LEU CB C 1856 45.558 45.389 0.169 1 1 987 . 9 1 1 A 88 88 LEU N N 1856 122.495 121.307 1.188 1 1 988 . 9 1 1 A 89 89 GLN H H 1857 9.583 8.828 0.755 1 1 989 . 9 1 1 A 89 89 GLN HA H 1857 5.508 5.554 -0.046 1 1 996 . 9 1 1 A 89 89 GLN CA C 1857 54.609 54.562 0.047 1 1 997 . 9 1 1 A 89 89 GLN CB C 1857 32.840 33.468 -0.628 1 1 999 . 9 1 1 A 89 89 GLN N N 1857 119.151 121.831 -2.680 1 1 1001 . 9 1 1 A 90 90 PHE H H 1858 8.600 8.835 -0.235 1 1 1002 . 9 1 1 A 90 90 PHE HA H 1858 5.095 5.176 -0.081 1 1 1010 . 9 1 1 A 90 90 PHE CA C 1858 56.161 56.112 0.049 1 1 1011 . 9 1 1 A 90 90 PHE CB C 1858 41.411 41.305 0.106 1 1 1015 . 9 1 1 A 90 90 PHE N N 1858 118.242 120.356 -2.114 1 1 1016 . 9 1 1 A 91 91 TYR H H 1859 9.892 9.002 0.890 1 1 1017 . 9 1 1 A 91 91 TYR HA H 1859 4.790 5.297 -0.507 1 1 1024 . 9 1 1 A 91 91 TYR CA C 1859 58.205 56.584 1.621 1 1 1025 . 9 1 1 A 91 91 TYR CB C 1859 40.867 41.702 -0.835 1 1 1028 . 9 1 1 A 91 91 TYR N N 1859 127.393 122.910 4.483 1 1 1029 . 9 1 1 A 92 92 VAL H H 1860 8.072 8.063 0.009 1 1 1030 . 9 1 1 A 92 92 VAL HA H 1860 4.377 4.788 -0.411 1 1 1038 . 9 1 1 A 92 92 VAL CA C 1860 62.583 60.290 2.293 1 1 1039 . 9 1 1 A 92 92 VAL CB C 1860 33.609 34.661 -1.052 1 1 1042 . 9 1 1 A 92 92 VAL N N 1860 132.007 125.471 6.536 1 1 1043 . 9 1 1 A 93 93 ASP H H 1861 8.438 8.953 -0.515 1 1 1044 . 9 1 1 A 93 93 ASP HA H 1861 5.024 5.063 -0.039 1 1 1047 . 9 1 1 A 93 93 ASP CA C 1861 50.678 52.608 -1.930 1 1 1048 . 9 1 1 A 93 93 ASP CB C 1861 46.086 45.130 0.956 1 1 1049 . 9 1 1 A 93 93 ASP N N 1861 130.459 124.018 6.441 1 1 1050 . 9 1 1 A 94 94 TYR H H 1862 9.674 8.709 0.965 1 1 1051 . 9 1 1 A 94 94 TYR HA H 1862 4.606 4.681 -0.075 1 1 1058 . 9 1 1 A 94 94 TYR CA C 1862 58.983 58.942 0.041 1 1 1059 . 9 1 1 A 94 94 TYR CB C 1862 39.727 38.609 1.118 1 1 1062 . 9 1 1 A 94 94 TYR N N 1862 120.069 121.433 -1.364 1 1 1063 . 9 1 1 A 95 95 VAL H H 1863 8.371 9.057 -0.686 1 1 1064 . 9 1 1 A 95 95 VAL HA H 1863 3.654 4.023 -0.369 1 1 1072 . 9 1 1 A 95 95 VAL CA C 1863 64.922 64.590 0.332 1 1 1073 . 9 1 1 A 95 95 VAL CB C 1863 32.270 31.893 0.377 1 1 1076 . 9 1 1 A 95 95 VAL N N 1863 121.770 126.433 -4.663 1 1 1077 . 9 1 1 A 96 96 ASN H H 1864 8.729 8.330 0.399 1 1 1078 . 9 1 1 A 96 96 ASN HA H 1864 4.901 4.568 0.333 1 1 1083 . 9 1 1 A 96 96 ASN CA C 1864 52.652 55.798 -3.146 1 1 1084 . 9 1 1 A 96 96 ASN CB C 1864 38.160 38.769 -0.609 1 1 1085 . 9 1 1 A 96 96 ASN N N 1864 120.006 119.455 0.551 1 1 1087 . 9 1 1 A 97 97 CYS H H 1865 7.875 8.021 -0.146 1 1 1088 . 9 1 1 A 97 97 CYS HA H 1865 4.575 4.521 0.054 1 1 1091 . 9 1 1 A 97 97 CYS CA C 1865 57.009 59.513 -2.504 1 1 1092 . 9 1 1 A 97 97 CYS CB C 1865 29.845 28.104 1.741 1 1 1093 . 9 1 1 A 97 97 CYS N N 1865 117.023 115.890 1.133 1 1 1094 . 9 1 1 A 98 98 GLY HA2 H 1866 4.045 4.015 0.030 1 1 1095 . 9 1 1 A 98 98 GLY HA3 H 1866 3.866 4.037 -0.171 1 1 1096 . 9 1 1 A 98 98 GLY CA C 1866 46.078 45.931 0.147 1 1 1097 . 9 1 1 A 99 99 HIS H H 1867 7.144 7.985 -0.841 1 1 1098 . 9 1 1 A 99 99 HIS HA H 1867 4.940 4.675 0.265 1 1 1103 . 9 1 1 A 99 99 HIS CA C 1867 53.843 55.704 -1.861 1 1 1104 . 9 1 1 A 99 99 HIS CB C 1867 31.584 30.668 0.916 1 1 1107 . 9 1 1 A 99 99 HIS N N 1867 115.591 118.466 -2.875 1 1 1108 . 9 1 1 A 100 100 VAL H H 1868 8.434 8.423 0.011 1 1 1109 . 9 1 1 A 100 100 VAL HA H 1868 4.143 4.118 0.025 1 1 1117 . 9 1 1 A 100 100 VAL CA C 1868 63.974 63.869 0.105 1 1 1118 . 9 1 1 A 100 100 VAL CB C 1868 31.525 31.810 -0.285 1 1 1121 . 9 1 1 A 100 100 VAL N N 1868 122.851 121.171 1.680 1 1 1122 . 9 1 1 A 101 101 THR H H 1869 7.869 8.612 -0.743 1 1 1123 . 9 1 1 A 101 101 THR HA H 1869 5.217 4.990 0.227 1 1 1128 . 9 1 1 A 101 101 THR CA C 1869 59.495 60.959 -1.464 1 1 1129 . 9 1 1 A 101 101 THR CB C 1869 72.402 70.374 2.028 1 1 1131 . 9 1 1 A 101 101 THR N N 1869 118.578 120.536 -1.958 1 1 1132 . 9 1 1 A 102 102 ALA H H 1870 8.512 9.014 -0.502 1 1 1133 . 9 1 1 A 102 102 ALA HA H 1870 5.687 5.369 0.318 1 1 1137 . 9 1 1 A 102 102 ALA CA C 1870 50.497 50.955 -0.458 1 1 1138 . 9 1 1 A 102 102 ALA CB C 1870 23.128 24.076 -0.948 1 1 1139 . 9 1 1 A 102 102 ALA N N 1870 125.193 125.839 -0.646 1 1 1140 . 9 1 1 A 103 103 TYR H H 1871 8.753 8.731 0.022 1 1 1141 . 9 1 1 A 103 103 TYR HA H 1871 5.019 5.240 -0.221 1 1 1148 . 9 1 1 A 103 103 TYR CA C 1871 56.303 56.175 0.128 1 1 1149 . 9 1 1 A 103 103 TYR CB C 1871 39.347 41.050 -1.703 1 1 1152 . 9 1 1 A 103 103 TYR N N 1871 119.968 116.336 3.632 1 1 1153 . 9 1 1 A 104 104 GLY H H 1872 9.006 8.660 0.346 1 1 1154 . 9 1 1 A 104 104 GLY HA2 H 1872 5.326 4.327 0.999 1 1 1155 . 9 1 1 A 104 104 GLY HA3 H 1872 4.226 4.347 -0.121 1 1 1156 . 9 1 1 A 104 104 GLY CA C 1872 44.624 44.354 0.270 1 1 1157 . 9 1 1 A 104 104 GLY N N 1872 109.622 106.974 2.648 1 1 1158 . 9 1 1 A 105 105 PRO HA H 1873 4.450 4.426 0.024 1 1 1165 . 9 1 1 A 105 105 PRO CA C 1873 66.676 64.917 1.759 1 1 1166 . 9 1 1 A 105 105 PRO CB C 1873 32.425 32.017 0.408 1 1 1169 . 9 1 1 A 106 106 GLY H H 1874 9.251 8.642 0.609 1 1 1170 . 9 1 1 A 106 106 GLY HA2 H 1874 4.600 3.928 0.672 1 1 1171 . 9 1 1 A 106 106 GLY HA3 H 1874 3.521 4.127 -0.606 1 1 1172 . 9 1 1 A 106 106 GLY CA C 1874 46.454 47.044 -0.590 1 1 1173 . 9 1 1 A 106 106 GLY N N 1874 105.282 105.707 -0.425 1 1 1174 . 9 1 1 A 107 107 LEU H H 1875 7.161 7.930 -0.769 1 1 1175 . 9 1 1 A 107 107 LEU HA H 1875 4.062 4.003 0.059 1 1 1185 . 9 1 1 A 107 107 LEU CA C 1875 55.592 55.902 -0.310 1 1 1186 . 9 1 1 A 107 107 LEU CB C 1875 41.516 40.413 1.103 1 1 1190 . 9 1 1 A 107 107 LEU N N 1875 117.141 119.255 -2.114 1 1 1191 . 9 1 1 A 108 108 THR H H 1876 8.298 7.903 0.395 1 1 1192 . 9 1 1 A 108 108 THR HA H 1876 5.038 4.617 0.421 1 1 1197 . 9 1 1 A 108 108 THR CA C 1876 64.551 63.633 0.918 1 1 1198 . 9 1 1 A 108 108 THR CB C 1876 72.706 71.023 1.683 1 1 1200 . 9 1 1 A 108 108 THR N N 1876 114.411 112.319 2.092 1 1 1201 . 9 1 1 A 109 109 HIS H H 1877 9.030 7.913 1.117 1 1 1202 . 9 1 1 A 109 109 HIS HA H 1877 5.854 5.007 0.847 1 1 1207 . 9 1 1 A 109 109 HIS CA C 1877 56.127 55.311 0.816 1 1 1208 . 9 1 1 A 109 109 HIS CB C 1877 36.258 32.945 3.313 1 1 1211 . 9 1 1 A 109 109 HIS N N 1877 125.809 117.104 8.705 1 1 1212 . 9 1 1 A 110 110 GLY H H 1878 7.497 8.195 -0.698 1 1 1213 . 9 1 1 A 110 110 GLY HA2 H 1878 4.075 4.187 -0.112 1 1 1214 . 9 1 1 A 110 110 GLY HA3 H 1878 3.512 4.281 -0.769 1 1 1215 . 9 1 1 A 110 110 GLY CA C 1878 44.559 45.008 -0.449 1 1 1216 . 9 1 1 A 110 110 GLY N N 1878 111.907 111.750 0.157 1 1 1217 . 9 1 1 A 111 111 VAL H H 1879 8.776 8.302 0.474 1 1 1218 . 9 1 1 A 111 111 VAL HA H 1879 4.741 4.742 -0.001 1 1 1226 . 9 1 1 A 111 111 VAL CA C 1879 60.188 60.506 -0.318 1 1 1227 . 9 1 1 A 111 111 VAL CB C 1879 35.130 35.651 -0.521 1 1 1230 . 9 1 1 A 111 111 VAL N N 1879 119.617 119.883 -0.266 1 1 1231 . 9 1 1 A 112 112 VAL H H 1880 7.841 8.688 -0.847 1 1 1232 . 9 1 1 A 112 112 VAL HA H 1880 3.343 3.943 -0.600 1 1 1240 . 9 1 1 A 112 112 VAL CA C 1880 63.553 62.806 0.747 1 1 1241 . 9 1 1 A 112 112 VAL CB C 1880 32.257 31.544 0.713 1 1 1243 . 9 1 1 A 112 112 VAL N N 1880 122.070 125.816 -3.746 1 1 1244 . 9 1 1 A 113 113 ASN H H 1881 8.822 8.979 -0.157 1 1 1245 . 9 1 1 A 113 113 ASN HA H 1881 4.079 4.361 -0.282 1 1 1250 . 9 1 1 A 113 113 ASN CA C 1881 55.459 54.983 0.476 1 1 1251 . 9 1 1 A 113 113 ASN CB C 1881 37.330 37.111 0.219 1 1 1252 . 9 1 1 A 113 113 ASN N N 1881 115.063 117.831 -2.768 1 1 1254 . 9 1 1 A 114 114 LYS H H 1882 8.073 7.640 0.433 1 1 1255 . 9 1 1 A 114 114 LYS HA H 1882 4.818 4.590 0.228 1 1 1260 . 9 1 1 A 114 114 LYS CA C 1882 53.039 53.126 -0.087 1 1 1261 . 9 1 1 A 114 114 LYS CB C 1882 34.020 32.904 1.116 1 1 1263 . 9 1 1 A 114 114 LYS N N 1882 121.439 119.312 2.127 1 1 1264 . 9 1 1 A 115 115 PRO HA H 1883 4.409 4.744 -0.335 1 1 1271 . 9 1 1 A 115 115 PRO CA C 1883 63.121 62.568 0.553 1 1 1272 . 9 1 1 A 115 115 PRO CB C 1883 31.515 31.824 -0.309 1 1 1275 . 9 1 1 A 116 116 ALA H H 1884 8.868 8.133 0.735 1 1 1276 . 9 1 1 A 116 116 ALA HA H 1884 4.804 4.984 -0.180 1 1 1280 . 9 1 1 A 116 116 ALA CA C 1884 50.620 50.421 0.199 1 1 1281 . 9 1 1 A 116 116 ALA CB C 1884 19.426 21.824 -2.398 1 1 1282 . 9 1 1 A 116 116 ALA N N 1884 132.329 125.512 6.817 1 1 1283 . 9 1 1 A 117 117 THR H H 1885 8.433 8.753 -0.320 1 1 1284 . 9 1 1 A 117 117 THR HA H 1885 5.747 5.402 0.345 1 1 1289 . 9 1 1 A 117 117 THR CA C 1885 60.364 59.956 0.408 1 1 1290 . 9 1 1 A 117 117 THR CB C 1885 72.204 72.034 0.170 1 1 1292 . 9 1 1 A 117 117 THR N N 1885 113.428 111.159 2.269 1 1 1293 . 9 1 1 A 118 118 PHE H H 1886 9.069 8.539 0.530 1 1 1294 . 9 1 1 A 118 118 PHE HA H 1886 5.123 5.177 -0.054 1 1 1301 . 9 1 1 A 118 118 PHE CA C 1886 57.059 56.013 1.046 1 1 1302 . 9 1 1 A 118 118 PHE CB C 1886 39.994 41.032 -1.038 1 1 1305 . 9 1 1 A 118 118 PHE N N 1886 119.166 117.617 1.549 1 1 1306 . 9 1 1 A 119 119 THR H H 1887 9.451 8.950 0.501 1 1 1307 . 9 1 1 A 119 119 THR HA H 1887 5.097 5.252 -0.155 1 1 1312 . 9 1 1 A 119 119 THR CA C 1887 62.050 61.247 0.803 1 1 1313 . 9 1 1 A 119 119 THR CB C 1887 71.696 71.905 -0.209 1 1 1315 . 9 1 1 A 119 119 THR N N 1887 119.436 114.387 5.049 1 1 1316 . 9 1 1 A 120 120 VAL H H 1888 8.812 9.331 -0.519 1 1 1317 . 9 1 1 A 120 120 VAL HA H 1888 4.807 4.621 0.186 1 1 1325 . 9 1 1 A 120 120 VAL CA C 1888 61.140 60.906 0.234 1 1 1326 . 9 1 1 A 120 120 VAL CB C 1888 34.059 34.284 -0.225 1 1 1329 . 9 1 1 A 120 120 VAL N N 1888 124.304 125.925 -1.621 1 1 1330 . 9 1 1 A 121 121 ASN H H 1889 9.291 9.141 0.150 1 1 1331 . 9 1 1 A 121 121 ASN HA H 1889 5.177 5.260 -0.083 1 1 1336 . 9 1 1 A 121 121 ASN CA C 1889 52.470 52.525 -0.055 1 1 1337 . 9 1 1 A 121 121 ASN CB C 1889 39.766 40.208 -0.442 1 1 1338 . 9 1 1 A 121 121 ASN N N 1889 128.674 125.375 3.299 1 1 1340 . 9 1 1 A 122 122 THR H H 1890 8.553 8.454 0.099 1 1 1341 . 9 1 1 A 122 122 THR HA H 1890 4.236 4.930 -0.694 1 1 1346 . 9 1 1 A 122 122 THR CA C 1890 61.062 61.100 -0.038 1 1 1347 . 9 1 1 A 122 122 THR CB C 1890 68.437 70.401 -1.964 1 1 1349 . 9 1 1 A 122 122 THR N N 1890 116.203 113.446 2.757 1 1 1350 . 9 1 1 A 123 123 LYS H H 1891 8.210 7.645 0.565 1 1 1351 . 9 1 1 A 123 123 LYS HA H 1891 4.019 4.028 -0.009 1 1 1360 . 9 1 1 A 123 123 LYS CA C 1891 58.646 60.016 -1.370 1 1 1361 . 9 1 1 A 123 123 LYS CB C 1891 31.868 32.127 -0.259 1 1 1365 . 9 1 1 A 123 123 LYS N N 1891 124.070 122.521 1.549 1 1 1366 . 9 1 1 A 124 124 ASP H H 1892 8.596 7.870 0.726 1 1 1367 . 9 1 1 A 124 124 ASP HA H 1892 4.638 4.836 -0.198 1 1 1370 . 9 1 1 A 124 124 ASP CA C 1892 54.928 52.973 1.955 1 1 1371 . 9 1 1 A 124 124 ASP CB C 1892 40.725 41.137 -0.412 1 1 1372 . 9 1 1 A 124 124 ASP N N 1892 119.838 117.275 2.563 1 1 1373 . 9 1 1 A 125 125 ALA H H 1893 7.792 7.599 0.193 1 1 1374 . 9 1 1 A 125 125 ALA HA H 1893 4.248 4.092 0.156 1 1 1378 . 9 1 1 A 125 125 ALA CA C 1893 52.852 52.966 -0.114 1 1 1379 . 9 1 1 A 125 125 ALA CB C 1893 20.199 19.302 0.897 1 1 1380 . 9 1 1 A 125 125 ALA N N 1893 122.999 121.332 1.667 1 1 1381 . 9 1 1 A 126 126 GLY H H 1894 8.214 7.733 0.481 1 1 1382 . 9 1 1 A 126 126 GLY HA2 H 1894 4.183 3.954 0.229 1 1 1383 . 9 1 1 A 126 126 GLY HA3 H 1894 3.993 4.004 -0.011 1 1 1384 . 9 1 1 A 126 126 GLY CA C 1894 44.725 44.644 0.081 1 1 1385 . 9 1 1 A 126 126 GLY N N 1894 108.359 104.058 4.301 1 1 1386 . 9 1 1 A 127 127 GLU H H 1895 8.633 8.427 0.206 1 1 1387 . 9 1 1 A 127 127 GLU HA H 1895 4.318 4.484 -0.166 1 1 1392 . 9 1 1 A 127 127 GLU CA C 1895 57.280 57.127 0.153 1 1 1393 . 9 1 1 A 127 127 GLU CB C 1895 30.434 30.797 -0.363 1 1 1395 . 9 1 1 A 127 127 GLU N N 1895 122.934 120.788 2.146 1 1 1396 . 9 1 1 A 128 128 GLY H H 1896 8.351 8.586 -0.235 1 1 1397 . 9 1 1 A 128 128 GLY HA2 H 1896 3.853 4.084 -0.231 1 1 1398 . 9 1 1 A 128 128 GLY HA3 H 1896 3.853 4.086 -0.233 1 1 1399 . 9 1 1 A 128 128 GLY CA C 1896 45.766 45.546 0.220 1 1 1400 . 9 1 1 A 128 128 GLY N N 1896 111.048 113.451 -2.403 1 1 1401 . 9 1 1 A 129 129 GLY H H 1897 7.580 7.643 -0.063 1 1 1402 . 9 1 1 A 129 129 GLY HA2 H 1897 4.170 4.126 0.044 1 1 1403 . 9 1 1 A 129 129 GLY HA3 H 1897 3.463 4.137 -0.674 1 1 1404 . 9 1 1 A 129 129 GLY CA C 1897 44.670 45.502 -0.832 1 1 1405 . 9 1 1 A 129 129 GLY N N 1897 106.306 106.749 -0.443 1 1 1406 . 9 1 1 A 130 130 LEU H H 1898 8.416 8.512 -0.096 1 1 1407 . 9 1 1 A 130 130 LEU HA H 1898 5.077 4.381 0.696 1 1 1417 . 9 1 1 A 130 130 LEU CA C 1898 54.526 54.415 0.111 1 1 1418 . 9 1 1 A 130 130 LEU CB C 1898 44.499 42.525 1.974 1 1 1422 . 9 1 1 A 130 130 LEU N N 1898 126.737 125.937 0.800 1 1 1423 . 9 1 1 A 131 131 SER H H 1899 9.254 9.099 0.155 1 1 1424 . 9 1 1 A 131 131 SER HA H 1899 4.803 5.291 -0.488 1 1 1427 . 9 1 1 A 131 131 SER CA C 1899 57.293 56.556 0.737 1 1 1428 . 9 1 1 A 131 131 SER CB C 1899 65.376 66.431 -1.055 1 1 1429 . 9 1 1 A 131 131 SER N N 1899 123.028 121.504 1.524 1 1 1430 . 9 1 1 A 132 132 LEU H H 1900 8.410 8.582 -0.172 1 1 1431 . 9 1 1 A 132 132 LEU HA H 1900 5.452 4.936 0.516 1 1 1441 . 9 1 1 A 132 132 LEU CA C 1900 53.045 54.343 -1.298 1 1 1442 . 9 1 1 A 132 132 LEU CB C 1900 46.982 46.081 0.901 1 1 1446 . 9 1 1 A 132 132 LEU N N 1900 126.218 124.925 1.293 1 1 1447 . 9 1 1 A 133 133 ALA H H 1901 8.708 8.445 0.263 1 1 1448 . 9 1 1 A 133 133 ALA HA H 1901 4.591 4.944 -0.353 1 1 1452 . 9 1 1 A 133 133 ALA CA C 1901 52.140 51.403 0.737 1 1 1453 . 9 1 1 A 133 133 ALA CB C 1901 22.653 23.648 -0.995 1 1 1454 . 9 1 1 A 133 133 ALA N N 1901 124.744 125.715 -0.971 1 1 1455 . 9 1 1 A 134 134 ILE H H 1902 8.641 8.546 0.095 1 1 1456 . 9 1 1 A 134 134 ILE HA H 1902 5.256 5.130 0.126 1 1 1466 . 9 1 1 A 134 134 ILE CA C 1902 59.873 59.985 -0.112 1 1 1467 . 9 1 1 A 134 134 ILE CB C 1902 41.214 42.081 -0.867 1 1 1471 . 9 1 1 A 134 134 ILE N N 1902 121.132 120.058 1.074 1 1 1472 . 9 1 1 A 135 135 GLU H H 1903 9.294 8.807 0.487 1 1 1473 . 9 1 1 A 135 135 GLU HA H 1903 4.869 5.242 -0.373 1 1 1478 . 9 1 1 A 135 135 GLU CA C 1903 54.307 54.706 -0.399 1 1 1479 . 9 1 1 A 135 135 GLU CB C 1903 32.474 33.043 -0.569 1 1 1481 . 9 1 1 A 135 135 GLU N N 1903 129.644 124.646 4.998 1 1 1482 . 9 1 1 A 136 136 GLY H H 1904 8.347 8.105 0.242 1 1 1483 . 9 1 1 A 136 136 GLY HA2 H 1904 4.005 3.404 0.601 1 1 1484 . 9 1 1 A 136 136 GLY HA3 H 1904 3.629 3.900 -0.271 1 1 1485 . 9 1 1 A 136 136 GLY CA C 1904 45.530 44.929 0.601 1 1 1486 . 9 1 1 A 136 136 GLY N N 1904 112.326 109.571 2.755 1 1 1487 . 9 1 1 A 137 137 PRO HA H 1905 4.268 4.319 -0.051 1 1 1494 . 9 1 1 A 137 137 PRO CA C 1905 64.189 64.191 -0.002 1 1 1495 . 9 1 1 A 137 137 PRO CB C 1905 32.482 32.086 0.396 1 1 1498 . 9 1 1 A 138 138 SER H H 1906 7.060 7.454 -0.394 1 1 1499 . 9 1 1 A 138 138 SER HA H 1906 4.603 4.850 -0.247 1 1 1502 . 9 1 1 A 138 138 SER CA C 1906 56.433 56.577 -0.144 1 1 1503 . 9 1 1 A 138 138 SER CB C 1906 66.672 65.802 0.870 1 1 1504 . 9 1 1 A 138 138 SER N N 1906 109.100 111.980 -2.880 1 1 1505 . 9 1 1 A 139 139 LYS H H 1907 8.479 8.336 0.143 1 1 1506 . 9 1 1 A 139 139 LYS HA H 1907 4.413 4.432 -0.019 1 1 1515 . 9 1 1 A 139 139 LYS CA C 1907 56.638 56.782 -0.144 1 1 1516 . 9 1 1 A 139 139 LYS CB C 1907 31.873 33.000 -1.127 1 1 1520 . 9 1 1 A 139 139 LYS N N 1907 124.545 125.464 -0.919 1 1 1521 . 9 1 1 A 140 140 ALA H H 1908 8.358 8.491 -0.133 1 1 1522 . 9 1 1 A 140 140 ALA HA H 1908 4.706 4.481 0.225 1 1 1526 . 9 1 1 A 140 140 ALA CA C 1908 51.081 52.545 -1.464 1 1 1527 . 9 1 1 A 140 140 ALA CB C 1908 20.724 19.415 1.309 1 1 1528 . 9 1 1 A 140 140 ALA N N 1908 131.020 129.605 1.415 1 1 1529 . 9 1 1 A 141 141 GLU H H 1909 8.625 8.462 0.163 1 1 1530 . 9 1 1 A 141 141 GLU HA H 1909 4.248 4.675 -0.427 1 1 1535 . 9 1 1 A 141 141 GLU CA C 1909 56.991 56.268 0.723 1 1 1536 . 9 1 1 A 141 141 GLU CB C 1909 30.453 30.617 -0.164 1 1 1538 . 9 1 1 A 141 141 GLU N N 1909 124.862 121.173 3.689 1 1 1539 . 9 1 1 A 142 142 ILE H H 1910 8.588 8.771 -0.183 1 1 1540 . 9 1 1 A 142 142 ILE HA H 1910 4.871 5.156 -0.285 1 1 1550 . 9 1 1 A 142 142 ILE CA C 1910 60.733 59.816 0.917 1 1 1551 . 9 1 1 A 142 142 ILE CB C 1910 41.494 41.395 0.099 1 1 1555 . 9 1 1 A 142 142 ILE N N 1910 126.220 124.965 1.255 1 1 1556 . 9 1 1 A 143 143 SER H H 1911 9.269 9.066 0.203 1 1 1557 . 9 1 1 A 143 143 SER HA H 1911 4.804 5.070 -0.266 1 1 1560 . 9 1 1 A 143 143 SER CA C 1911 56.988 57.009 -0.021 1 1 1561 . 9 1 1 A 143 143 SER CB C 1911 65.172 65.235 -0.063 1 1 1562 . 9 1 1 A 143 143 SER N N 1911 124.083 120.252 3.831 1 1 1563 . 9 1 1 A 144 144 CYS H H 1912 8.773 8.782 -0.009 1 1 1564 . 9 1 1 A 144 144 CYS HA H 1912 5.200 5.199 0.001 1 1 1567 . 9 1 1 A 144 144 CYS CA C 1912 57.256 56.510 0.746 1 1 1568 . 9 1 1 A 144 144 CYS CB C 1912 29.137 31.466 -2.329 1 1 1569 . 9 1 1 A 144 144 CYS N N 1912 125.729 120.387 5.342 1 1 1570 . 9 1 1 A 145 145 THR H H 1913 8.976 8.809 0.167 1 1 1571 . 9 1 1 A 145 145 THR HA H 1913 4.510 4.927 -0.417 1 1 1576 . 9 1 1 A 145 145 THR CA C 1913 61.388 61.317 0.071 1 1 1577 . 9 1 1 A 145 145 THR CB C 1913 71.558 71.981 -0.423 1 1 1579 . 9 1 1 A 145 145 THR N N 1913 124.914 117.317 7.597 1 1 1580 . 9 1 1 A 146 146 ASP H H 1914 8.843 8.986 -0.143 1 1 1581 . 9 1 1 A 146 146 ASP HA H 1914 4.842 4.818 0.024 1 1 1584 . 9 1 1 A 146 146 ASP CA C 1914 54.307 54.285 0.022 1 1 1585 . 9 1 1 A 146 146 ASP CB C 1914 41.262 42.030 -0.768 1 1 1586 . 9 1 1 A 146 146 ASP N N 1914 128.084 128.572 -0.488 1 1 1587 . 9 1 1 A 147 147 ASN H H 1915 8.700 9.128 -0.428 1 1 1588 . 9 1 1 A 147 147 ASN HA H 1915 4.798 5.016 -0.218 1 1 1593 . 9 1 1 A 147 147 ASN CA C 1915 54.283 51.969 2.314 1 1 1594 . 9 1 1 A 147 147 ASN CB C 1915 38.986 40.868 -1.882 1 1 1595 . 9 1 1 A 147 147 ASN N N 1915 125.720 122.864 2.856 1 1 1597 . 9 1 1 A 148 148 GLN HA H 1916 4.057 4.097 -0.040 1 1 1602 . 9 1 1 A 148 148 GLN CA C 1916 57.839 58.623 -0.784 1 1 1603 . 9 1 1 A 148 148 GLN CB C 1916 26.281 28.269 -1.988 1 1 1605 . 9 1 1 A 149 149 ASP H H 1917 7.892 7.793 0.099 1 1 1606 . 9 1 1 A 149 149 ASP HA H 1917 4.755 4.693 0.062 1 1 1609 . 9 1 1 A 149 149 ASP CA C 1917 52.659 54.467 -1.808 1 1 1610 . 9 1 1 A 149 149 ASP CB C 1917 41.111 41.397 -0.286 1 1 1611 . 9 1 1 A 149 149 ASP N N 1917 118.769 117.489 1.280 1 1 1612 . 9 1 1 A 150 150 GLY H H 1918 8.673 8.193 0.480 1 1 1613 . 9 1 1 A 150 150 GLY HA2 H 1918 4.358 4.018 0.340 1 1 1614 . 9 1 1 A 150 150 GLY HA3 H 1918 3.700 4.020 -0.320 1 1 1615 . 9 1 1 A 150 150 GLY CA C 1918 45.319 46.099 -0.780 1 1 1616 . 9 1 1 A 150 150 GLY N N 1918 110.464 107.303 3.161 1 1 1617 . 9 1 1 A 151 151 THR H H 1919 8.154 7.560 0.594 1 1 1618 . 9 1 1 A 151 151 THR HA H 1919 4.109 5.036 -0.927 1 1 1623 . 9 1 1 A 151 151 THR CA C 1919 60.041 59.621 0.420 1 1 1624 . 9 1 1 A 151 151 THR CB C 1919 73.422 72.746 0.676 1 1 1626 . 9 1 1 A 151 151 THR N N 1919 111.043 109.137 1.906 1 1 1627 . 9 1 1 A 152 152 CYS H H 1920 9.088 9.008 0.080 1 1 1628 . 9 1 1 A 152 152 CYS HA H 1920 5.362 5.447 -0.085 1 1 1631 . 9 1 1 A 152 152 CYS CA C 1920 56.990 56.903 0.087 1 1 1632 . 9 1 1 A 152 152 CYS CB C 1920 30.740 28.881 1.859 1 1 1633 . 9 1 1 A 152 152 CYS N N 1920 118.508 121.656 -3.148 1 1 1634 . 9 1 1 A 153 153 SER H H 1921 9.102 8.978 0.124 1 1 1635 . 9 1 1 A 153 153 SER HA H 1921 4.865 4.818 0.047 1 1 1638 . 9 1 1 A 153 153 SER CA C 1921 58.023 57.861 0.162 1 1 1639 . 9 1 1 A 153 153 SER CB C 1921 64.133 64.039 0.094 1 1 1640 . 9 1 1 A 153 153 SER N N 1921 122.048 120.191 1.857 1 1 1641 . 9 1 1 A 154 154 VAL H H 1922 8.983 8.737 0.246 1 1 1642 . 9 1 1 A 154 154 VAL HA H 1922 4.608 4.754 -0.146 1 1 1650 . 9 1 1 A 154 154 VAL CA C 1922 60.575 59.741 0.834 1 1 1651 . 9 1 1 A 154 154 VAL CB C 1922 32.710 34.711 -2.001 1 1 1654 . 9 1 1 A 154 154 VAL N N 1922 130.262 125.194 5.068 1 1 1655 . 9 1 1 A 155 155 SER H H 1923 8.737 8.973 -0.236 1 1 1656 . 9 1 1 A 155 155 SER HA H 1923 5.680 5.561 0.119 1 1 1659 . 9 1 1 A 155 155 SER CA C 1923 55.991 56.269 -0.278 1 1 1660 . 9 1 1 A 155 155 SER CB C 1923 66.306 66.334 -0.028 1 1 1661 . 9 1 1 A 155 155 SER N N 1923 121.504 119.008 2.496 1 1 1662 . 9 1 1 A 156 156 TYR H H 1924 9.061 8.955 0.106 1 1 1663 . 9 1 1 A 156 156 TYR HA H 1924 5.790 5.625 0.165 1 1 1671 . 9 1 1 A 156 156 TYR CA C 1924 55.118 55.911 -0.793 1 1 1672 . 9 1 1 A 156 156 TYR CB C 1924 42.344 41.691 0.653 1 1 1675 . 9 1 1 A 156 156 TYR N N 1924 121.858 117.769 4.089 1 1 1676 . 9 1 1 A 157 157 LEU H H 1925 7.505 9.315 -1.810 1 1 1677 . 9 1 1 A 157 157 LEU HA H 1925 4.996 4.805 0.191 1 1 1687 . 9 1 1 A 157 157 LEU CA C 1925 50.476 51.088 -0.612 1 1 1688 . 9 1 1 A 157 157 LEU CB C 1925 43.334 43.629 -0.295 1 1 1692 . 9 1 1 A 157 157 LEU N N 1925 123.272 121.289 1.983 1 1 1693 . 9 1 1 A 158 158 PRO HA H 1926 4.691 4.963 -0.272 1 1 1700 . 9 1 1 A 158 158 PRO CA C 1926 61.808 62.384 -0.576 1 1 1701 . 9 1 1 A 158 158 PRO CB C 1926 32.551 33.351 -0.800 1 1 1704 . 9 1 1 A 159 159 VAL H H 1927 8.388 8.469 -0.081 1 1 1705 . 9 1 1 A 159 159 VAL HA H 1927 4.510 4.315 0.195 1 1 1713 . 9 1 1 A 159 159 VAL CA C 1927 61.778 62.325 -0.547 1 1 1714 . 9 1 1 A 159 159 VAL CB C 1927 32.432 35.396 -2.964 1 1 1717 . 9 1 1 A 159 159 VAL N N 1927 115.680 120.324 -4.644 1 1 1718 . 9 1 1 A 160 160 LEU H H 1928 6.931 7.782 -0.851 1 1 1719 . 9 1 1 A 160 160 LEU HA H 1928 4.931 4.745 0.186 1 1 1729 . 9 1 1 A 160 160 LEU CA C 1928 51.971 51.809 0.162 1 1 1730 . 9 1 1 A 160 160 LEU CB C 1928 45.905 43.743 2.162 1 1 1734 . 9 1 1 A 160 160 LEU N N 1928 120.258 124.080 -3.822 1 1 1735 . 9 1 1 A 161 161 PRO HA H 1929 4.317 4.846 -0.529 1 1 1742 . 9 1 1 A 161 161 PRO CA C 1929 62.809 62.899 -0.090 1 1 1743 . 9 1 1 A 161 161 PRO CB C 1929 32.662 33.010 -0.348 1 1 1746 . 9 1 1 A 162 162 GLY H H 1930 8.916 8.378 0.538 1 1 1747 . 9 1 1 A 162 162 GLY HA2 H 1930 4.461 4.161 0.300 1 1 1748 . 9 1 1 A 162 162 GLY HA3 H 1930 3.852 4.178 -0.326 1 1 1749 . 9 1 1 A 162 162 GLY CA C 1930 44.496 44.202 0.294 1 1 1750 . 9 1 1 A 162 162 GLY N N 1930 107.609 107.144 0.465 1 1 1751 . 9 1 1 A 163 163 ASP H H 1931 8.245 8.433 -0.188 1 1 1752 . 9 1 1 A 163 163 ASP HA H 1931 5.565 5.473 0.092 1 1 1755 . 9 1 1 A 163 163 ASP CA C 1931 53.628 53.250 0.378 1 1 1756 . 9 1 1 A 163 163 ASP CB C 1931 41.058 42.279 -1.221 1 1 1757 . 9 1 1 A 163 163 ASP N N 1931 121.979 118.956 3.023 1 1 1758 . 9 1 1 A 164 164 TYR H H 1932 9.606 9.554 0.052 1 1 1759 . 9 1 1 A 164 164 TYR HA H 1932 4.896 5.300 -0.404 1 1 1767 . 9 1 1 A 164 164 TYR CA C 1932 56.955 56.306 0.649 1 1 1768 . 9 1 1 A 164 164 TYR CB C 1932 40.339 41.274 -0.935 1 1 1771 . 9 1 1 A 164 164 TYR N N 1932 125.257 122.010 3.247 1 1 1772 . 9 1 1 A 165 165 SER H H 1933 9.095 9.329 -0.234 1 1 1773 . 9 1 1 A 165 165 SER HA H 1933 5.500 5.150 0.350 1 1 1776 . 9 1 1 A 165 165 SER CA C 1933 56.509 58.442 -1.933 1 1 1777 . 9 1 1 A 165 165 SER CB C 1933 64.486 63.899 0.587 1 1 1778 . 9 1 1 A 165 165 SER N N 1933 119.162 120.610 -1.448 1 1 1779 . 9 1 1 A 166 166 ILE H H 1934 9.598 9.484 0.114 1 1 1780 . 9 1 1 A 166 166 ILE HA H 1934 4.541 4.783 -0.242 1 1 1790 . 9 1 1 A 166 166 ILE CA C 1934 61.080 60.257 0.823 1 1 1791 . 9 1 1 A 166 166 ILE CB C 1934 39.282 38.650 0.632 1 1 1795 . 9 1 1 A 166 166 ILE N N 1934 128.701 128.558 0.143 1 1 1796 . 9 1 1 A 167 167 LEU H H 1935 9.359 9.476 -0.117 1 1 1797 . 9 1 1 A 167 167 LEU HA H 1935 4.779 5.159 -0.380 1 1 1807 . 9 1 1 A 167 167 LEU CA C 1935 55.921 53.297 2.624 1 1 1808 . 9 1 1 A 167 167 LEU CB C 1935 42.473 43.507 -1.034 1 1 1811 . 9 1 1 A 167 167 LEU N N 1935 131.315 128.105 3.210 1 1 1812 . 9 1 1 A 168 168 VAL H H 1936 9.425 8.730 0.695 1 1 1813 . 9 1 1 A 168 168 VAL HA H 1936 4.617 4.816 -0.199 1 1 1821 . 9 1 1 A 168 168 VAL CA C 1936 61.418 61.091 0.327 1 1 1822 . 9 1 1 A 168 168 VAL CB C 1936 33.616 35.163 -1.547 1 1 1824 . 9 1 1 A 168 168 VAL N N 1936 126.961 124.000 2.961 1 1 1825 . 9 1 1 A 169 169 LYS H H 1937 8.643 8.338 0.305 1 1 1826 . 9 1 1 A 169 169 LYS HA H 1937 5.067 4.822 0.245 1 1 1835 . 9 1 1 A 169 169 LYS CA C 1937 53.949 55.449 -1.500 1 1 1836 . 9 1 1 A 169 169 LYS CB C 1937 36.691 36.044 0.647 1 1 1840 . 9 1 1 A 169 169 LYS N N 1937 124.773 127.353 -2.580 1 1 1841 . 9 1 1 A 170 170 TYR H H 1938 8.877 9.261 -0.384 1 1 1842 . 9 1 1 A 170 170 TYR HA H 1938 5.137 5.045 0.092 1 1 1849 . 9 1 1 A 170 170 TYR CA C 1938 57.034 57.633 -0.599 1 1 1850 . 9 1 1 A 170 170 TYR CB C 1938 42.105 41.953 0.152 1 1 1853 . 9 1 1 A 170 170 TYR N N 1938 122.371 126.864 -4.493 1 1 1854 . 9 1 1 A 171 171 ASN H H 1939 8.933 9.774 -0.841 1 1 1855 . 9 1 1 A 171 171 ASN HA H 1939 4.405 4.434 -0.029 1 1 1860 . 9 1 1 A 171 171 ASN CA C 1939 54.512 54.236 0.276 1 1 1861 . 9 1 1 A 171 171 ASN CB C 1939 37.025 37.203 -0.178 1 1 1862 . 9 1 1 A 171 171 ASN N N 1939 129.922 126.485 3.437 1 1 1864 . 9 1 1 A 172 172 GLU H H 1940 8.857 8.852 0.005 1 1 1865 . 9 1 1 A 172 172 GLU HA H 1940 3.511 4.057 -0.546 1 1 1870 . 9 1 1 A 172 172 GLU CA C 1940 57.910 57.620 0.290 1 1 1871 . 9 1 1 A 172 172 GLU CB C 1940 27.139 27.472 -0.333 1 1 1873 . 9 1 1 A 172 172 GLU N N 1940 107.943 116.258 -8.315 1 1 1874 . 9 1 1 A 173 173 GLN H H 1941 7.544 7.413 0.131 1 1 1875 . 9 1 1 A 173 173 GLN HA H 1941 4.749 4.833 -0.084 1 1 1882 . 9 1 1 A 173 173 GLN CA C 1941 53.770 54.242 -0.472 1 1 1883 . 9 1 1 A 173 173 GLN CB C 1941 31.078 31.133 -0.055 1 1 1885 . 9 1 1 A 173 173 GLN N N 1941 119.865 120.063 -0.198 1 1 1887 . 9 1 1 A 174 174 HIS H H 1942 8.848 8.953 -0.105 1 1 1888 . 9 1 1 A 174 174 HIS HA H 1942 4.513 4.808 -0.295 1 1 1893 . 9 1 1 A 174 174 HIS CA C 1942 58.893 56.637 2.256 1 1 1894 . 9 1 1 A 174 174 HIS CB C 1942 32.196 30.268 1.928 1 1 1897 . 9 1 1 A 174 174 HIS N N 1942 126.437 121.940 4.497 1 1 1898 . 9 1 1 A 175 175 VAL H H 1943 8.483 8.111 0.372 1 1 1899 . 9 1 1 A 175 175 VAL HA H 1943 4.643 4.443 0.200 1 1 1907 . 9 1 1 A 175 175 VAL CA C 1943 60.025 60.907 -0.882 1 1 1908 . 9 1 1 A 175 175 VAL CB C 1943 29.439 31.738 -2.299 1 1 1911 . 9 1 1 A 175 175 VAL N N 1943 121.671 120.364 1.307 1 1 1912 . 9 1 1 A 176 176 PRO HA H 1944 4.045 4.461 -0.416 1 1 1919 . 9 1 1 A 176 176 PRO CA C 1944 64.943 64.144 0.799 1 1 1920 . 9 1 1 A 176 176 PRO CB C 1944 31.120 31.892 -0.772 1 1 1923 . 9 1 1 A 177 177 GLY H H 1945 7.579 8.244 -0.665 1 1 1924 . 9 1 1 A 177 177 GLY HA2 H 1945 3.210 2.666 0.544 1 1 1925 . 9 1 1 A 177 177 GLY HA3 H 1945 2.311 3.394 -1.083 1 1 1926 . 9 1 1 A 177 177 GLY CA C 1945 44.184 44.434 -0.250 1 1 1927 . 9 1 1 A 177 177 GLY N N 1945 113.696 106.482 7.214 1 1 1928 . 9 1 1 A 178 178 SER H H 1946 7.469 7.215 0.254 1 1 1929 . 9 1 1 A 178 178 SER HA H 1946 4.023 3.491 0.532 1 1 1932 . 9 1 1 A 178 178 SER CA C 1946 54.593 55.812 -1.219 1 1 1933 . 9 1 1 A 178 178 SER CB C 1946 62.282 63.556 -1.274 1 1 1934 . 9 1 1 A 178 178 SER N N 1946 113.219 113.836 -0.617 1 1 1935 . 9 1 1 A 179 179 PRO HA H 1947 5.314 4.571 0.743 1 1 1942 . 9 1 1 A 179 179 PRO CA C 1947 62.198 62.314 -0.116 1 1 1943 . 9 1 1 A 179 179 PRO CB C 1947 33.923 32.691 1.232 1 1 1946 . 9 1 1 A 180 180 PHE H H 1948 9.395 8.378 1.017 1 1 1947 . 9 1 1 A 180 180 PHE HA H 1948 4.706 4.916 -0.210 1 1 1955 . 9 1 1 A 180 180 PHE CA C 1948 57.298 57.590 -0.292 1 1 1956 . 9 1 1 A 180 180 PHE CB C 1948 41.116 40.422 0.694 1 1 1960 . 9 1 1 A 180 180 PHE N N 1948 127.510 120.530 6.980 1 1 1961 . 9 1 1 A 181 181 THR H H 1949 9.111 8.889 0.222 1 1 1962 . 9 1 1 A 181 181 THR HA H 1949 5.091 5.161 -0.070 1 1 1967 . 9 1 1 A 181 181 THR CA C 1949 62.668 61.258 1.410 1 1 1968 . 9 1 1 A 181 181 THR CB C 1949 70.354 70.918 -0.564 1 1 1970 . 9 1 1 A 181 181 THR N N 1949 120.325 115.446 4.879 1 1 1971 . 9 1 1 A 182 182 ALA H H 1950 8.992 9.324 -0.332 1 1 1972 . 9 1 1 A 182 182 ALA HA H 1950 4.521 4.953 -0.432 1 1 1976 . 9 1 1 A 182 182 ALA CA C 1950 50.080 51.168 -1.088 1 1 1977 . 9 1 1 A 182 182 ALA CB C 1950 21.717 20.393 1.324 1 1 1978 . 9 1 1 A 182 182 ALA N N 1950 130.794 130.686 0.108 1 1 1979 . 9 1 1 A 183 183 ARG H H 1951 7.764 8.429 -0.665 1 1 1980 . 9 1 1 A 183 183 ARG HA H 1951 5.001 5.030 -0.029 1 1 1988 . 9 1 1 A 183 183 ARG CA C 1951 55.116 54.754 0.362 1 1 1989 . 9 1 1 A 183 183 ARG CB C 1951 30.631 33.305 -2.674 1 1 1992 . 9 1 1 A 183 183 ARG N N 1951 121.920 122.403 -0.483 1 1 1994 . 9 1 1 A 184 184 VAL H H 1952 9.121 9.427 -0.306 1 1 1995 . 9 1 1 A 184 184 VAL HA H 1952 4.865 4.855 0.010 1 1 2003 . 9 1 1 A 184 184 VAL CA C 1952 60.375 61.226 -0.851 1 1 2004 . 9 1 1 A 184 184 VAL CB C 1952 32.179 33.909 -1.730 1 1 2007 . 9 1 1 A 184 184 VAL N N 1952 125.421 127.317 -1.896 1 1 2008 . 9 1 1 A 185 185 THR H H 1953 8.799 8.557 0.242 1 1 2009 . 9 1 1 A 185 185 THR HA H 1953 4.829 5.255 -0.426 1 1 2014 . 9 1 1 A 185 185 THR CA C 1953 60.316 59.805 0.511 1 1 2015 . 9 1 1 A 185 185 THR CB C 1953 70.825 71.500 -0.675 1 1 2017 . 9 1 1 A 185 185 THR N N 1953 121.794 117.382 4.412 1 1 2018 . 9 1 1 A 186 186 GLY H H 1954 8.586 8.483 0.103 1 1 2019 . 9 1 1 A 186 186 GLY HA2 H 1954 4.261 4.072 0.189 1 1 2020 . 9 1 1 A 186 186 GLY HA3 H 1954 4.033 4.073 -0.040 1 1 2021 . 9 1 1 A 186 186 GLY CA C 1954 45.038 45.331 -0.293 1 1 2022 . 9 1 1 A 186 186 GLY N N 1954 107.588 108.470 -0.882 1 1 2023 . 9 1 1 A 187 187 ASP H H 1955 8.386 9.078 -0.692 1 1 2024 . 9 1 1 A 187 187 ASP HA H 1955 4.772 4.675 0.097 1 1 2027 . 9 1 1 A 187 187 ASP CA C 1955 53.909 55.225 -1.316 1 1 2028 . 9 1 1 A 187 187 ASP CB C 1955 41.510 42.124 -0.614 1 1 2029 . 9 1 1 A 187 187 ASP N N 1955 121.829 121.409 0.420 1 1 4 . 10 1 1 A 2 2 ALA HA H -2 4.368 4.414 -0.046 1 1 8 . 10 1 1 A 2 2 ALA CA C -2 52.604 51.676 0.928 1 1 9 . 10 1 1 A 2 2 ALA CB C -2 19.551 19.628 -0.077 1 1 32 . 10 1 1 A 5 5 PRO HA H 1773 4.433 4.513 -0.080 1 1 39 . 10 1 1 A 5 5 PRO CA C 1773 63.017 62.328 0.689 1 1 40 . 10 1 1 A 5 5 PRO CB C 1773 32.155 32.266 -0.111 1 1 43 . 10 1 1 A 6 6 GLU H H 1774 8.495 8.566 -0.071 1 1 44 . 10 1 1 A 6 6 GLU HA H 1774 4.242 4.574 -0.332 1 1 49 . 10 1 1 A 6 6 GLU CA C 1774 56.735 56.225 0.510 1 1 50 . 10 1 1 A 6 6 GLU CB C 1774 30.401 30.468 -0.067 1 1 52 . 10 1 1 A 6 6 GLU N N 1774 122.494 121.723 0.771 1 1 53 . 10 1 1 A 7 7 ARG H H 1775 8.275 8.569 -0.294 1 1 54 . 10 1 1 A 7 7 ARG HA H 1775 4.648 4.927 -0.279 1 1 61 . 10 1 1 A 7 7 ARG CA C 1775 53.827 53.251 0.576 1 1 62 . 10 1 1 A 7 7 ARG CB C 1775 30.417 32.791 -2.374 1 1 65 . 10 1 1 A 7 7 ARG N N 1775 124.017 128.093 -4.076 1 1 66 . 10 1 1 A 8 8 PRO HA H 1776 4.433 4.538 -0.105 1 1 73 . 10 1 1 A 8 8 PRO CA C 1776 63.036 62.535 0.501 1 1 74 . 10 1 1 A 8 8 PRO CB C 1776 32.201 32.336 -0.135 1 1 77 . 10 1 1 A 9 9 LEU H H 1777 8.349 8.498 -0.149 1 1 78 . 10 1 1 A 9 9 LEU HA H 1777 4.365 4.430 -0.065 1 1 88 . 10 1 1 A 9 9 LEU CA C 1777 55.275 54.408 0.867 1 1 89 . 10 1 1 A 9 9 LEU CB C 1777 42.376 39.864 2.512 1 1 93 . 10 1 1 A 9 9 LEU N N 1777 123.820 121.965 1.855 1 1 94 . 10 1 1 A 10 10 VAL H H 1778 7.989 8.320 -0.331 1 1 95 . 10 1 1 A 10 10 VAL HA H 1778 4.182 4.359 -0.177 1 1 103 . 10 1 1 A 10 10 VAL CA C 1778 62.141 63.002 -0.861 1 1 104 . 10 1 1 A 10 10 VAL CB C 1778 33.175 34.494 -1.319 1 1 106 . 10 1 1 A 10 10 VAL N N 1778 121.714 120.509 1.205 1 1 107 . 10 1 1 A 11 11 GLY H H 1779 8.450 7.856 0.594 1 1 108 . 10 1 1 A 11 11 GLY HA2 H 1779 4.002 4.023 -0.021 1 1 109 . 10 1 1 A 11 11 GLY HA3 H 1779 4.002 4.023 -0.021 1 1 110 . 10 1 1 A 11 11 GLY CA C 1779 45.297 45.071 0.226 1 1 111 . 10 1 1 A 11 11 GLY N N 1779 113.826 110.888 2.938 1 1 112 . 10 1 1 A 12 12 VAL H H 1780 8.013 8.531 -0.518 1 1 113 . 10 1 1 A 12 12 VAL HA H 1780 4.136 4.778 -0.642 1 1 121 . 10 1 1 A 12 12 VAL CA C 1780 62.466 59.257 3.209 1 1 122 . 10 1 1 A 12 12 VAL CB C 1780 32.752 35.432 -2.680 1 1 125 . 10 1 1 A 12 12 VAL N N 1780 120.109 118.533 1.576 1 1 126 . 10 1 1 A 13 13 ASN H H 1781 8.528 8.830 -0.302 1 1 127 . 10 1 1 A 13 13 ASN HA H 1781 4.712 4.741 -0.029 1 1 132 . 10 1 1 A 13 13 ASN CA C 1781 53.485 53.511 -0.026 1 1 133 . 10 1 1 A 13 13 ASN CB C 1781 38.996 39.058 -0.062 1 1 134 . 10 1 1 A 13 13 ASN N N 1781 122.648 119.703 2.945 1 1 136 . 10 1 1 A 14 14 GLY H H 1782 8.283 8.028 0.255 1 1 137 . 10 1 1 A 14 14 GLY HA2 H 1782 3.929 3.899 0.030 1 1 138 . 10 1 1 A 14 14 GLY HA3 H 1782 3.929 3.900 0.029 1 1 139 . 10 1 1 A 14 14 GLY CA C 1782 45.531 46.458 -0.927 1 1 140 . 10 1 1 A 14 14 GLY N N 1782 110.229 107.242 2.987 1 1 141 . 10 1 1 A 15 15 LEU H H 1783 7.925 8.389 -0.464 1 1 142 . 10 1 1 A 15 15 LEU HA H 1783 4.340 5.103 -0.763 1 1 152 . 10 1 1 A 15 15 LEU CA C 1783 55.045 53.459 1.586 1 1 153 . 10 1 1 A 15 15 LEU CB C 1783 42.682 46.616 -3.934 1 1 157 . 10 1 1 A 15 15 LEU N N 1783 122.626 125.618 -2.992 1 1 158 . 10 1 1 A 16 16 ASP H H 1784 8.360 8.894 -0.534 1 1 159 . 10 1 1 A 16 16 ASP HA H 1784 4.747 5.171 -0.424 1 1 162 . 10 1 1 A 16 16 ASP CA C 1784 53.939 53.173 0.766 1 1 163 . 10 1 1 A 16 16 ASP CB C 1784 41.150 44.665 -3.515 1 1 164 . 10 1 1 A 16 16 ASP N N 1784 122.868 120.073 2.795 1 1 165 . 10 1 1 A 17 17 VAL H H 1785 8.201 8.320 -0.119 1 1 166 . 10 1 1 A 17 17 VAL HA H 1785 4.237 4.548 -0.311 1 1 174 . 10 1 1 A 17 17 VAL CA C 1785 62.881 61.232 1.649 1 1 175 . 10 1 1 A 17 17 VAL CB C 1785 31.967 32.131 -0.164 1 1 178 . 10 1 1 A 17 17 VAL N N 1785 121.110 116.319 4.791 1 1 179 . 10 1 1 A 18 18 THR H H 1786 8.291 7.660 0.631 1 1 180 . 10 1 1 A 18 18 THR HA H 1786 4.466 4.059 0.407 1 1 185 . 10 1 1 A 18 18 THR CA C 1786 62.388 65.018 -2.630 1 1 186 . 10 1 1 A 18 18 THR CB C 1786 69.719 68.912 0.807 1 1 188 . 10 1 1 A 18 18 THR N N 1786 115.267 117.141 -1.874 1 1 189 . 10 1 1 A 19 19 SER H H 1787 8.148 7.787 0.361 1 1 190 . 10 1 1 A 19 19 SER HA H 1787 4.542 4.729 -0.187 1 1 193 . 10 1 1 A 19 19 SER CA C 1787 59.096 58.110 0.986 1 1 194 . 10 1 1 A 19 19 SER CB C 1787 63.993 62.851 1.142 1 1 195 . 10 1 1 A 19 19 SER N N 1787 118.576 114.336 4.240 1 1 196 . 10 1 1 A 20 20 LEU H H 1788 8.263 7.525 0.738 1 1 197 . 10 1 1 A 20 20 LEU HA H 1788 4.243 4.254 -0.011 1 1 207 . 10 1 1 A 20 20 LEU CA C 1788 54.087 55.341 -1.254 1 1 208 . 10 1 1 A 20 20 LEU CB C 1788 43.006 43.248 -0.242 1 1 212 . 10 1 1 A 20 20 LEU N N 1788 125.834 124.056 1.778 1 1 213 . 10 1 1 A 21 21 ARG H H 1789 8.191 8.208 -0.017 1 1 214 . 10 1 1 A 21 21 ARG HA H 1789 4.080 4.291 -0.211 1 1 222 . 10 1 1 A 21 21 ARG CA C 1789 54.894 54.237 0.657 1 1 223 . 10 1 1 A 21 21 ARG CB C 1789 30.881 30.574 0.307 1 1 226 . 10 1 1 A 21 21 ARG N N 1789 127.213 126.856 0.357 1 1 228 . 10 1 1 A 22 22 PRO HA H 1790 4.441 4.719 -0.278 1 1 233 . 10 1 1 A 22 22 PRO CA C 1790 62.882 62.560 0.322 1 1 234 . 10 1 1 A 22 22 PRO CB C 1790 32.204 32.247 -0.043 1 1 237 . 10 1 1 A 23 23 PHE H H 1791 8.336 8.347 -0.011 1 1 238 . 10 1 1 A 23 23 PHE HA H 1791 4.701 5.057 -0.356 1 1 246 . 10 1 1 A 23 23 PHE CA C 1791 57.504 56.668 0.836 1 1 247 . 10 1 1 A 23 23 PHE CB C 1791 42.192 42.236 -0.044 1 1 251 . 10 1 1 A 23 23 PHE N N 1791 122.145 122.229 -0.084 1 1 252 . 10 1 1 A 24 24 ASP H H 1792 6.954 9.045 -2.091 1 1 253 . 10 1 1 A 24 24 ASP HA H 1792 5.039 5.364 -0.325 1 1 256 . 10 1 1 A 24 24 ASP CA C 1792 52.871 52.444 0.427 1 1 257 . 10 1 1 A 24 24 ASP CB C 1792 44.696 44.607 0.089 1 1 258 . 10 1 1 A 24 24 ASP N N 1792 127.481 125.912 1.569 1 1 259 . 10 1 1 A 25 25 LEU H H 1793 8.372 8.603 -0.231 1 1 260 . 10 1 1 A 25 25 LEU HA H 1793 4.336 5.060 -0.724 1 1 270 . 10 1 1 A 25 25 LEU CA C 1793 54.860 53.573 1.287 1 1 271 . 10 1 1 A 25 25 LEU CB C 1793 47.575 46.073 1.502 1 1 274 . 10 1 1 A 25 25 LEU N N 1793 123.241 122.356 0.885 1 1 275 . 10 1 1 A 26 26 VAL H H 1794 8.489 9.072 -0.583 1 1 276 . 10 1 1 A 26 26 VAL HA H 1794 4.903 5.007 -0.104 1 1 284 . 10 1 1 A 26 26 VAL CA C 1794 61.669 60.524 1.145 1 1 285 . 10 1 1 A 26 26 VAL CB C 1794 32.458 34.168 -1.710 1 1 288 . 10 1 1 A 26 26 VAL N N 1794 128.849 124.079 4.770 1 1 289 . 10 1 1 A 27 27 ILE H H 1795 9.101 9.098 0.003 1 1 290 . 10 1 1 A 27 27 ILE HA H 1795 4.701 4.430 0.271 1 1 300 . 10 1 1 A 27 27 ILE CA C 1795 57.433 57.478 -0.045 1 1 301 . 10 1 1 A 27 27 ILE CB C 1795 41.865 41.633 0.232 1 1 305 . 10 1 1 A 27 27 ILE N N 1795 127.511 128.079 -0.568 1 1 306 . 10 1 1 A 28 28 PRO HA H 1796 4.838 4.853 -0.015 1 1 313 . 10 1 1 A 28 28 PRO CA C 1796 62.406 62.694 -0.288 1 1 314 . 10 1 1 A 28 28 PRO CB C 1796 30.684 31.604 -0.920 1 1 317 . 10 1 1 A 29 29 PHE H H 1797 8.255 8.756 -0.501 1 1 318 . 10 1 1 A 29 29 PHE HA H 1797 4.151 4.934 -0.783 1 1 326 . 10 1 1 A 29 29 PHE CA C 1797 60.405 58.229 2.176 1 1 327 . 10 1 1 A 29 29 PHE CB C 1797 41.395 42.217 -0.822 1 1 331 . 10 1 1 A 29 29 PHE N N 1797 128.572 122.686 5.886 1 1 332 . 10 1 1 A 30 30 THR H H 1798 7.433 7.609 -0.176 1 1 333 . 10 1 1 A 30 30 THR HA H 1798 4.108 4.912 -0.804 1 1 338 . 10 1 1 A 30 30 THR CA C 1798 61.473 61.212 0.261 1 1 339 . 10 1 1 A 30 30 THR CB C 1798 69.324 71.848 -2.524 1 1 341 . 10 1 1 A 30 30 THR N N 1798 123.124 118.160 4.964 1 1 342 . 10 1 1 A 31 31 ILE H H 1799 8.402 9.156 -0.754 1 1 343 . 10 1 1 A 31 31 ILE HA H 1799 3.653 4.187 -0.534 1 1 353 . 10 1 1 A 31 31 ILE CA C 1799 61.802 61.657 0.145 1 1 354 . 10 1 1 A 31 31 ILE CB C 1799 38.548 37.296 1.252 1 1 358 . 10 1 1 A 31 31 ILE N N 1799 128.616 127.291 1.325 1 1 359 . 10 1 1 A 32 32 LYS H H 1800 7.742 8.904 -1.162 1 1 360 . 10 1 1 A 32 32 LYS HA H 1800 4.558 4.454 0.104 1 1 365 . 10 1 1 A 32 32 LYS CA C 1800 56.566 57.566 -1.000 1 1 366 . 10 1 1 A 32 32 LYS CB C 1800 31.982 33.029 -1.047 1 1 368 . 10 1 1 A 32 32 LYS N N 1800 128.656 128.059 0.597 1 1 369 . 10 1 1 A 33 33 LYS HA H 1801 4.531 4.844 -0.313 1 1 378 . 10 1 1 A 33 33 LYS CA C 1801 56.310 55.902 0.408 1 1 379 . 10 1 1 A 33 33 LYS CB C 1801 33.027 35.952 -2.925 1 1 383 . 10 1 1 A 34 34 GLY H H 1802 8.088 8.479 -0.391 1 1 384 . 10 1 1 A 34 34 GLY HA2 H 1802 4.159 4.143 0.016 1 1 385 . 10 1 1 A 34 34 GLY HA3 H 1802 3.712 4.245 -0.533 1 1 386 . 10 1 1 A 34 34 GLY CA C 1802 45.302 44.451 0.851 1 1 387 . 10 1 1 A 34 34 GLY N N 1802 110.338 112.864 -2.526 1 1 388 . 10 1 1 A 35 35 GLU H H 1803 8.219 8.106 0.113 1 1 389 . 10 1 1 A 35 35 GLU HA H 1803 4.692 4.896 -0.204 1 1 394 . 10 1 1 A 35 35 GLU CA C 1803 55.160 55.131 0.029 1 1 395 . 10 1 1 A 35 35 GLU CB C 1803 32.407 34.070 -1.663 1 1 397 . 10 1 1 A 35 35 GLU N N 1803 119.576 120.717 -1.141 1 1 398 . 10 1 1 A 36 36 ILE H H 1804 8.869 8.797 0.072 1 1 399 . 10 1 1 A 36 36 ILE HA H 1804 5.468 5.153 0.315 1 1 409 . 10 1 1 A 36 36 ILE CA C 1804 58.861 58.697 0.164 1 1 410 . 10 1 1 A 36 36 ILE CB C 1804 41.007 41.447 -0.440 1 1 414 . 10 1 1 A 36 36 ILE N N 1804 128.141 125.002 3.139 1 1 415 . 10 1 1 A 37 37 THR H H 1805 9.075 8.856 0.219 1 1 416 . 10 1 1 A 37 37 THR HA H 1805 4.703 5.125 -0.422 1 1 421 . 10 1 1 A 37 37 THR CA C 1805 59.932 60.062 -0.130 1 1 422 . 10 1 1 A 37 37 THR CB C 1805 72.441 72.588 -0.147 1 1 424 . 10 1 1 A 37 37 THR N N 1805 119.846 116.873 2.973 1 1 425 . 10 1 1 A 38 38 GLY H H 1806 8.468 8.389 0.079 1 1 426 . 10 1 1 A 38 38 GLY HA2 H 1806 5.076 4.260 0.816 1 1 427 . 10 1 1 A 38 38 GLY HA3 H 1806 3.503 4.271 -0.768 1 1 428 . 10 1 1 A 38 38 GLY CA C 1806 45.593 45.786 -0.193 1 1 429 . 10 1 1 A 38 38 GLY N N 1806 107.815 108.497 -0.682 1 1 430 . 10 1 1 A 39 39 GLU H H 1807 8.519 8.630 -0.111 1 1 431 . 10 1 1 A 39 39 GLU HA H 1807 4.713 5.061 -0.348 1 1 436 . 10 1 1 A 39 39 GLU CA C 1807 56.936 55.518 1.418 1 1 437 . 10 1 1 A 39 39 GLU CB C 1807 34.937 33.962 0.975 1 1 439 . 10 1 1 A 39 39 GLU N N 1807 120.173 119.538 0.635 1 1 440 . 10 1 1 A 40 40 VAL H H 1808 9.156 9.353 -0.197 1 1 441 . 10 1 1 A 40 40 VAL HA H 1808 4.778 4.957 -0.179 1 1 449 . 10 1 1 A 40 40 VAL CA C 1808 60.574 61.075 -0.501 1 1 450 . 10 1 1 A 40 40 VAL CB C 1808 34.168 33.891 0.277 1 1 452 . 10 1 1 A 40 40 VAL N N 1808 126.330 126.108 0.222 1 1 453 . 10 1 1 A 41 41 ARG H H 1809 9.044 9.168 -0.124 1 1 454 . 10 1 1 A 41 41 ARG HA H 1809 4.778 4.966 -0.188 1 1 462 . 10 1 1 A 41 41 ARG CA C 1809 55.317 54.297 1.020 1 1 463 . 10 1 1 A 41 41 ARG CB C 1809 31.940 33.322 -1.382 1 1 466 . 10 1 1 A 41 41 ARG N N 1809 127.098 126.151 0.947 1 1 468 . 10 1 1 A 42 42 MET H H 1810 8.264 8.746 -0.482 1 1 469 . 10 1 1 A 42 42 MET HA H 1810 4.050 4.431 -0.381 1 1 477 . 10 1 1 A 42 42 MET CA C 1810 53.716 53.185 0.531 1 1 478 . 10 1 1 A 42 42 MET CB C 1810 32.779 33.815 -1.036 1 1 481 . 10 1 1 A 42 42 MET N N 1810 123.461 122.736 0.725 1 1 482 . 10 1 1 A 43 43 PRO HA H 1811 4.179 4.180 -0.001 1 1 489 . 10 1 1 A 43 43 PRO CA C 1811 66.422 64.719 1.703 1 1 490 . 10 1 1 A 43 43 PRO CB C 1811 31.462 31.782 -0.320 1 1 493 . 10 1 1 A 44 44 SER H H 1812 8.860 7.842 1.018 1 1 494 . 10 1 1 A 44 44 SER HA H 1812 5.516 4.134 1.382 1 1 497 . 10 1 1 A 44 44 SER CA C 1812 59.937 58.788 1.149 1 1 498 . 10 1 1 A 44 44 SER CB C 1812 62.755 63.221 -0.466 1 1 499 . 10 1 1 A 44 44 SER N N 1812 112.267 110.306 1.961 1 1 500 . 10 1 1 A 45 45 GLY H H 1813 8.368 8.024 0.344 1 1 501 . 10 1 1 A 45 45 GLY HA2 H 1813 4.461 3.895 0.566 1 1 502 . 10 1 1 A 45 45 GLY HA3 H 1813 3.569 3.902 -0.333 1 1 503 . 10 1 1 A 45 45 GLY CA C 1813 44.525 45.139 -0.614 1 1 504 . 10 1 1 A 45 45 GLY N N 1813 112.727 110.476 2.251 1 1 505 . 10 1 1 A 46 46 LYS H H 1814 7.126 7.788 -0.662 1 1 506 . 10 1 1 A 46 46 LYS HA H 1814 4.206 4.364 -0.158 1 1 515 . 10 1 1 A 46 46 LYS CA C 1814 57.460 56.522 0.938 1 1 516 . 10 1 1 A 46 46 LYS CB C 1814 33.453 33.825 -0.372 1 1 520 . 10 1 1 A 46 46 LYS N N 1814 122.101 120.657 1.444 1 1 521 . 10 1 1 A 47 47 VAL H H 1815 8.056 8.902 -0.846 1 1 522 . 10 1 1 A 47 47 VAL HA H 1815 5.400 5.181 0.219 1 1 530 . 10 1 1 A 47 47 VAL CA C 1815 60.048 59.555 0.493 1 1 531 . 10 1 1 A 47 47 VAL CB C 1815 35.044 36.312 -1.268 1 1 534 . 10 1 1 A 47 47 VAL N N 1815 118.680 118.002 0.678 1 1 535 . 10 1 1 A 48 48 ALA H H 1816 9.110 8.595 0.515 1 1 536 . 10 1 1 A 48 48 ALA HA H 1816 4.804 4.863 -0.059 1 1 540 . 10 1 1 A 48 48 ALA CA C 1816 50.808 51.284 -0.476 1 1 541 . 10 1 1 A 48 48 ALA CB C 1816 24.108 23.640 0.468 1 1 542 . 10 1 1 A 48 48 ALA N N 1816 128.274 123.389 4.885 1 1 543 . 10 1 1 A 49 49 GLN H H 1817 8.725 8.498 0.227 1 1 544 . 10 1 1 A 49 49 GLN HA H 1817 5.069 4.903 0.166 1 1 551 . 10 1 1 A 49 49 GLN CA C 1817 53.524 52.402 1.122 1 1 552 . 10 1 1 A 49 49 GLN CB C 1817 30.432 29.508 0.924 1 1 554 . 10 1 1 A 49 49 GLN N N 1817 120.102 118.366 1.736 1 1 556 . 10 1 1 A 50 50 PRO HA H 1818 5.136 4.859 0.277 1 1 563 . 10 1 1 A 50 50 PRO CA C 1818 61.966 62.406 -0.440 1 1 564 . 10 1 1 A 50 50 PRO CB C 1818 32.722 32.876 -0.154 1 1 567 . 10 1 1 A 51 51 THR H H 1819 9.072 8.666 0.406 1 1 568 . 10 1 1 A 51 51 THR HA H 1819 4.566 4.845 -0.279 1 1 573 . 10 1 1 A 51 51 THR CA C 1819 62.695 61.032 1.663 1 1 574 . 10 1 1 A 51 51 THR CB C 1819 70.056 69.833 0.223 1 1 576 . 10 1 1 A 51 51 THR N N 1819 117.512 113.190 4.322 1 1 577 . 10 1 1 A 52 52 ILE H H 1820 8.900 9.376 -0.476 1 1 578 . 10 1 1 A 52 52 ILE HA H 1820 4.905 4.772 0.133 1 1 588 . 10 1 1 A 52 52 ILE CA C 1820 60.869 60.091 0.778 1 1 589 . 10 1 1 A 52 52 ILE CB C 1820 39.670 39.016 0.654 1 1 593 . 10 1 1 A 52 52 ILE N N 1820 129.513 129.860 -0.347 1 1 594 . 10 1 1 A 53 53 THR H H 1821 9.200 9.353 -0.153 1 1 595 . 10 1 1 A 53 53 THR HA H 1821 4.541 4.857 -0.316 1 1 600 . 10 1 1 A 53 53 THR CA C 1821 61.084 61.979 -0.895 1 1 601 . 10 1 1 A 53 53 THR CB C 1821 71.410 71.369 0.041 1 1 603 . 10 1 1 A 53 53 THR N N 1821 125.271 124.181 1.090 1 1 604 . 10 1 1 A 54 54 ASP H H 1822 8.918 8.662 0.256 1 1 605 . 10 1 1 A 54 54 ASP HA H 1822 4.756 4.801 -0.045 1 1 608 . 10 1 1 A 54 54 ASP CA C 1822 53.906 54.332 -0.426 1 1 609 . 10 1 1 A 54 54 ASP CB C 1822 41.443 41.464 -0.021 1 1 610 . 10 1 1 A 54 54 ASP N N 1822 126.647 127.229 -0.582 1 1 611 . 10 1 1 A 55 55 ASN H H 1823 8.342 8.921 -0.579 1 1 612 . 10 1 1 A 55 55 ASN HA H 1823 4.704 4.599 0.105 1 1 617 . 10 1 1 A 55 55 ASN CA C 1823 54.421 53.153 1.268 1 1 618 . 10 1 1 A 55 55 ASN CB C 1823 38.557 38.546 0.011 1 1 619 . 10 1 1 A 55 55 ASN N N 1823 126.271 124.742 1.529 1 1 621 . 10 1 1 A 56 56 LYS H H 1824 9.232 7.968 1.264 1 1 622 . 10 1 1 A 56 56 LYS HA H 1824 4.099 4.012 0.087 1 1 631 . 10 1 1 A 56 56 LYS CA C 1824 58.015 57.918 0.097 1 1 632 . 10 1 1 A 56 56 LYS CB C 1824 28.691 30.146 -1.455 1 1 636 . 10 1 1 A 56 56 LYS N N 1824 115.352 115.221 0.131 1 1 637 . 10 1 1 A 57 57 ASP H H 1825 7.905 8.437 -0.532 1 1 638 . 10 1 1 A 57 57 ASP HA H 1825 4.791 4.639 0.152 1 1 641 . 10 1 1 A 57 57 ASP CA C 1825 52.401 53.786 -1.385 1 1 642 . 10 1 1 A 57 57 ASP CB C 1825 41.166 41.508 -0.342 1 1 643 . 10 1 1 A 57 57 ASP N N 1825 119.741 118.243 1.498 1 1 644 . 10 1 1 A 58 58 GLY H H 1826 8.930 8.941 -0.011 1 1 645 . 10 1 1 A 58 58 GLY HA2 H 1826 4.265 3.885 0.380 1 1 646 . 10 1 1 A 58 58 GLY HA3 H 1826 3.712 3.898 -0.186 1 1 647 . 10 1 1 A 58 58 GLY CA C 1826 44.870 45.379 -0.509 1 1 648 . 10 1 1 A 58 58 GLY N N 1826 109.578 107.451 2.127 1 1 649 . 10 1 1 A 59 59 THR H H 1827 8.004 7.651 0.353 1 1 650 . 10 1 1 A 59 59 THR HA H 1827 5.394 4.986 0.408 1 1 655 . 10 1 1 A 59 59 THR CA C 1827 60.262 59.182 1.080 1 1 656 . 10 1 1 A 59 59 THR CB C 1827 73.892 72.539 1.353 1 1 658 . 10 1 1 A 59 59 THR N N 1827 112.179 110.131 2.048 1 1 659 . 10 1 1 A 60 60 VAL H H 1828 8.822 9.253 -0.431 1 1 660 . 10 1 1 A 60 60 VAL HA H 1828 5.124 4.950 0.174 1 1 668 . 10 1 1 A 60 60 VAL CA C 1828 59.430 59.858 -0.428 1 1 669 . 10 1 1 A 60 60 VAL CB C 1828 35.088 34.290 0.798 1 1 672 . 10 1 1 A 60 60 VAL N N 1828 115.300 117.115 -1.815 1 1 673 . 10 1 1 A 61 61 THR H H 1829 9.115 9.083 0.032 1 1 674 . 10 1 1 A 61 61 THR HA H 1829 5.128 5.013 0.115 1 1 679 . 10 1 1 A 61 61 THR CA C 1829 61.934 61.839 0.095 1 1 680 . 10 1 1 A 61 61 THR CB C 1829 70.561 70.270 0.291 1 1 682 . 10 1 1 A 61 61 THR N N 1829 121.210 120.473 0.737 1 1 683 . 10 1 1 A 62 62 VAL H H 1830 9.530 9.316 0.214 1 1 684 . 10 1 1 A 62 62 VAL HA H 1830 4.803 4.841 -0.038 1 1 692 . 10 1 1 A 62 62 VAL CA C 1830 60.580 60.878 -0.298 1 1 693 . 10 1 1 A 62 62 VAL CB C 1830 33.747 33.352 0.395 1 1 696 . 10 1 1 A 62 62 VAL N N 1830 129.896 127.290 2.606 1 1 697 . 10 1 1 A 63 63 ARG H H 1831 8.879 9.088 -0.209 1 1 698 . 10 1 1 A 63 63 ARG HA H 1831 5.282 4.979 0.303 1 1 705 . 10 1 1 A 63 63 ARG CA C 1831 54.759 53.902 0.857 1 1 706 . 10 1 1 A 63 63 ARG CB C 1831 34.410 33.971 0.439 1 1 709 . 10 1 1 A 63 63 ARG N N 1831 125.701 126.149 -0.448 1 1 710 . 10 1 1 A 64 64 TYR H H 1832 8.878 8.751 0.127 1 1 711 . 10 1 1 A 64 64 TYR HA H 1832 4.888 4.846 0.042 1 1 718 . 10 1 1 A 64 64 TYR CA C 1832 57.694 58.102 -0.408 1 1 719 . 10 1 1 A 64 64 TYR CB C 1832 42.389 42.109 0.280 1 1 722 . 10 1 1 A 64 64 TYR N N 1832 122.731 123.393 -0.662 1 1 723 . 10 1 1 A 65 65 ALA H H 1833 7.925 8.213 -0.288 1 1 724 . 10 1 1 A 65 65 ALA HA H 1833 4.736 4.544 0.192 1 1 728 . 10 1 1 A 65 65 ALA CA C 1833 47.938 49.324 -1.386 1 1 729 . 10 1 1 A 65 65 ALA CB C 1833 18.320 19.628 -1.308 1 1 730 . 10 1 1 A 65 65 ALA N N 1833 135.415 129.426 5.989 1 1 731 . 10 1 1 A 66 66 PRO HA H 1834 4.198 4.737 -0.539 1 1 738 . 10 1 1 A 66 66 PRO CA C 1834 62.701 62.383 0.318 1 1 739 . 10 1 1 A 66 66 PRO CB C 1834 34.445 32.995 1.450 1 1 742 . 10 1 1 A 67 67 SER H H 1835 9.019 8.910 0.109 1 1 743 . 10 1 1 A 67 67 SER HA H 1835 4.555 4.735 -0.180 1 1 746 . 10 1 1 A 67 67 SER CA C 1835 57.320 58.317 -0.997 1 1 747 . 10 1 1 A 67 67 SER CB C 1835 64.778 64.715 0.063 1 1 748 . 10 1 1 A 67 67 SER N N 1835 112.422 115.301 -2.879 1 1 749 . 10 1 1 A 68 68 GLU H H 1836 7.625 7.629 -0.004 1 1 750 . 10 1 1 A 68 68 GLU HA H 1836 4.513 4.719 -0.206 1 1 755 . 10 1 1 A 68 68 GLU CA C 1836 54.777 56.086 -1.309 1 1 756 . 10 1 1 A 68 68 GLU CB C 1836 33.981 33.616 0.365 1 1 758 . 10 1 1 A 68 68 GLU N N 1836 123.025 120.342 2.683 1 1 759 . 10 1 1 A 69 69 ALA H H 1837 8.133 8.527 -0.394 1 1 760 . 10 1 1 A 69 69 ALA HA H 1837 4.088 4.176 -0.088 1 1 764 . 10 1 1 A 69 69 ALA CA C 1837 51.070 52.174 -1.104 1 1 765 . 10 1 1 A 69 69 ALA CB C 1837 19.665 19.903 -0.238 1 1 766 . 10 1 1 A 69 69 ALA N N 1837 122.311 127.065 -4.754 1 1 767 . 10 1 1 A 70 70 GLY H H 1838 9.120 8.072 1.048 1 1 768 . 10 1 1 A 70 70 GLY HA2 H 1838 4.453 3.768 0.685 1 1 769 . 10 1 1 A 70 70 GLY HA3 H 1838 2.953 3.997 -1.044 1 1 770 . 10 1 1 A 70 70 GLY CA C 1838 43.362 43.392 -0.030 1 1 771 . 10 1 1 A 70 70 GLY N N 1838 107.031 106.026 1.005 1 1 772 . 10 1 1 A 71 71 LEU H H 1839 9.096 8.242 0.854 1 1 773 . 10 1 1 A 71 71 LEU HA H 1839 4.336 4.469 -0.133 1 1 783 . 10 1 1 A 71 71 LEU CA C 1839 56.657 54.343 2.314 1 1 784 . 10 1 1 A 71 71 LEU CB C 1839 42.032 42.545 -0.513 1 1 788 . 10 1 1 A 71 71 LEU N N 1839 127.931 121.474 6.457 1 1 789 . 10 1 1 A 72 72 HIS H H 1840 9.359 9.062 0.297 1 1 790 . 10 1 1 A 72 72 HIS HA H 1840 4.595 4.919 -0.324 1 1 796 . 10 1 1 A 72 72 HIS CA C 1840 54.539 55.548 -1.009 1 1 797 . 10 1 1 A 72 72 HIS CB C 1840 31.421 31.941 -0.520 1 1 800 . 10 1 1 A 72 72 HIS N N 1840 128.527 125.834 2.693 1 1 802 . 10 1 1 A 73 73 GLU H H 1841 7.925 9.013 -1.088 1 1 803 . 10 1 1 A 73 73 GLU HA H 1841 5.142 5.302 -0.160 1 1 808 . 10 1 1 A 73 73 GLU CA C 1841 54.381 54.775 -0.394 1 1 809 . 10 1 1 A 73 73 GLU CB C 1841 34.043 33.676 0.367 1 1 811 . 10 1 1 A 73 73 GLU N N 1841 119.347 118.523 0.824 1 1 812 . 10 1 1 A 74 74 MET H H 1842 9.383 9.216 0.167 1 1 813 . 10 1 1 A 74 74 MET HA H 1842 5.548 5.310 0.238 1 1 821 . 10 1 1 A 74 74 MET CA C 1842 53.859 54.291 -0.432 1 1 822 . 10 1 1 A 74 74 MET CB C 1842 38.571 36.530 2.041 1 1 825 . 10 1 1 A 74 74 MET N N 1842 124.747 120.270 4.477 1 1 826 . 10 1 1 A 75 75 ASP H H 1843 9.005 9.369 -0.364 1 1 827 . 10 1 1 A 75 75 ASP HA H 1843 5.277 5.478 -0.201 1 1 830 . 10 1 1 A 75 75 ASP CA C 1843 52.774 52.854 -0.080 1 1 831 . 10 1 1 A 75 75 ASP CB C 1843 43.493 43.719 -0.226 1 1 832 . 10 1 1 A 75 75 ASP N N 1843 128.148 125.294 2.854 1 1 833 . 10 1 1 A 76 76 ILE H H 1844 9.434 8.860 0.574 1 1 834 . 10 1 1 A 76 76 ILE HA H 1844 4.672 4.819 -0.147 1 1 844 . 10 1 1 A 76 76 ILE CA C 1844 60.715 59.741 0.974 1 1 845 . 10 1 1 A 76 76 ILE CB C 1844 39.470 40.439 -0.969 1 1 849 . 10 1 1 A 76 76 ILE N N 1844 124.097 123.465 0.632 1 1 850 . 10 1 1 A 77 77 ARG H H 1845 8.888 9.070 -0.182 1 1 851 . 10 1 1 A 77 77 ARG HA H 1845 5.050 4.896 0.154 1 1 859 . 10 1 1 A 77 77 ARG CA C 1845 53.780 54.135 -0.355 1 1 860 . 10 1 1 A 77 77 ARG CB C 1845 34.564 33.629 0.935 1 1 863 . 10 1 1 A 77 77 ARG N N 1845 124.944 124.382 0.562 1 1 865 . 10 1 1 A 78 78 TYR H H 1846 8.974 9.173 -0.199 1 1 866 . 10 1 1 A 78 78 TYR HA H 1846 5.151 4.956 0.195 1 1 873 . 10 1 1 A 78 78 TYR CA C 1846 55.909 57.593 -1.684 1 1 874 . 10 1 1 A 78 78 TYR CB C 1846 41.732 40.850 0.882 1 1 877 . 10 1 1 A 78 78 TYR N N 1846 121.774 124.147 -2.373 1 1 878 . 10 1 1 A 79 79 ASP H H 1847 9.026 9.311 -0.285 1 1 879 . 10 1 1 A 79 79 ASP HA H 1847 4.127 4.238 -0.111 1 1 882 . 10 1 1 A 79 79 ASP CA C 1847 55.808 55.099 0.709 1 1 883 . 10 1 1 A 79 79 ASP CB C 1847 39.181 39.588 -0.407 1 1 884 . 10 1 1 A 79 79 ASP N N 1847 131.304 128.035 3.269 1 1 885 . 10 1 1 A 80 80 ASN H H 1848 8.608 8.574 0.034 1 1 886 . 10 1 1 A 80 80 ASN HA H 1848 3.990 4.351 -0.361 1 1 891 . 10 1 1 A 80 80 ASN CA C 1848 55.149 54.895 0.254 1 1 892 . 10 1 1 A 80 80 ASN CB C 1848 38.470 37.032 1.438 1 1 893 . 10 1 1 A 80 80 ASN N N 1848 108.490 109.482 -0.992 1 1 895 . 10 1 1 A 81 81 MET H H 1849 7.820 7.968 -0.148 1 1 896 . 10 1 1 A 81 81 MET HA H 1849 4.819 4.851 -0.032 1 1 904 . 10 1 1 A 81 81 MET CA C 1849 53.852 54.035 -0.183 1 1 905 . 10 1 1 A 81 81 MET CB C 1849 34.665 33.516 1.149 1 1 908 . 10 1 1 A 81 81 MET N N 1849 121.878 118.808 3.070 1 1 909 . 10 1 1 A 82 82 HIS H H 1850 8.575 8.781 -0.206 1 1 910 . 10 1 1 A 82 82 HIS HA H 1850 4.539 4.649 -0.110 1 1 915 . 10 1 1 A 82 82 HIS CA C 1850 58.819 57.282 1.537 1 1 916 . 10 1 1 A 82 82 HIS CB C 1850 32.419 30.578 1.841 1 1 919 . 10 1 1 A 82 82 HIS N N 1850 124.291 121.527 2.764 1 1 920 . 10 1 1 A 83 83 ILE H H 1851 8.333 8.178 0.155 1 1 921 . 10 1 1 A 83 83 ILE HA H 1851 4.608 4.333 0.275 1 1 931 . 10 1 1 A 83 83 ILE CA C 1851 60.727 59.445 1.282 1 1 932 . 10 1 1 A 83 83 ILE CB C 1851 35.928 37.608 -1.680 1 1 936 . 10 1 1 A 83 83 ILE N N 1851 120.786 120.872 -0.086 1 1 937 . 10 1 1 A 84 84 PRO HA H 1852 4.426 4.334 0.092 1 1 944 . 10 1 1 A 84 84 PRO CA C 1852 65.249 63.843 1.406 1 1 945 . 10 1 1 A 84 84 PRO CB C 1852 31.120 31.401 -0.281 1 1 948 . 10 1 1 A 85 85 GLY H H 1853 8.498 8.931 -0.433 1 1 949 . 10 1 1 A 85 85 GLY HA2 H 1853 4.284 4.088 0.196 1 1 950 . 10 1 1 A 85 85 GLY HA3 H 1853 3.397 4.093 -0.696 1 1 951 . 10 1 1 A 85 85 GLY CA C 1853 44.913 45.281 -0.368 1 1 952 . 10 1 1 A 85 85 GLY N N 1853 114.093 113.466 0.627 1 1 953 . 10 1 1 A 86 86 SER H H 1854 7.823 7.991 -0.168 1 1 954 . 10 1 1 A 86 86 SER HA H 1854 4.834 4.793 0.041 1 1 957 . 10 1 1 A 86 86 SER CA C 1854 55.628 55.717 -0.089 1 1 958 . 10 1 1 A 86 86 SER CB C 1854 63.063 64.114 -1.051 1 1 959 . 10 1 1 A 86 86 SER N N 1854 112.722 117.379 -4.657 1 1 960 . 10 1 1 A 87 87 PRO HA H 1855 5.681 4.777 0.904 1 1 967 . 10 1 1 A 87 87 PRO CA C 1855 63.079 62.566 0.513 1 1 968 . 10 1 1 A 87 87 PRO CB C 1855 34.406 32.931 1.475 1 1 971 . 10 1 1 A 88 88 LEU H H 1856 9.168 8.640 0.528 1 1 972 . 10 1 1 A 88 88 LEU HA H 1856 4.909 5.219 -0.310 1 1 982 . 10 1 1 A 88 88 LEU CA C 1856 53.839 53.308 0.531 1 1 983 . 10 1 1 A 88 88 LEU CB C 1856 45.558 46.190 -0.632 1 1 987 . 10 1 1 A 88 88 LEU N N 1856 122.495 121.214 1.281 1 1 988 . 10 1 1 A 89 89 GLN H H 1857 9.583 9.019 0.564 1 1 989 . 10 1 1 A 89 89 GLN HA H 1857 5.508 5.526 -0.018 1 1 996 . 10 1 1 A 89 89 GLN CA C 1857 54.609 54.730 -0.121 1 1 997 . 10 1 1 A 89 89 GLN CB C 1857 32.840 32.799 0.041 1 1 999 . 10 1 1 A 89 89 GLN N N 1857 119.151 118.287 0.864 1 1 1001 . 10 1 1 A 90 90 PHE H H 1858 8.600 8.934 -0.334 1 1 1002 . 10 1 1 A 90 90 PHE HA H 1858 5.095 5.157 -0.062 1 1 1010 . 10 1 1 A 90 90 PHE CA C 1858 56.161 56.389 -0.228 1 1 1011 . 10 1 1 A 90 90 PHE CB C 1858 41.411 40.459 0.952 1 1 1015 . 10 1 1 A 90 90 PHE N N 1858 118.242 117.061 1.181 1 1 1016 . 10 1 1 A 91 91 TYR H H 1859 9.892 8.915 0.977 1 1 1017 . 10 1 1 A 91 91 TYR HA H 1859 4.790 4.789 0.001 1 1 1024 . 10 1 1 A 91 91 TYR CA C 1859 58.205 56.980 1.225 1 1 1025 . 10 1 1 A 91 91 TYR CB C 1859 40.867 40.441 0.426 1 1 1028 . 10 1 1 A 91 91 TYR N N 1859 127.393 122.352 5.041 1 1 1029 . 10 1 1 A 92 92 VAL H H 1860 8.072 8.408 -0.336 1 1 1030 . 10 1 1 A 92 92 VAL HA H 1860 4.377 4.378 -0.001 1 1 1038 . 10 1 1 A 92 92 VAL CA C 1860 62.583 61.289 1.294 1 1 1039 . 10 1 1 A 92 92 VAL CB C 1860 33.609 32.387 1.222 1 1 1042 . 10 1 1 A 92 92 VAL N N 1860 132.007 126.534 5.473 1 1 1043 . 10 1 1 A 93 93 ASP H H 1861 8.438 8.485 -0.047 1 1 1044 . 10 1 1 A 93 93 ASP HA H 1861 5.024 4.665 0.359 1 1 1047 . 10 1 1 A 93 93 ASP CA C 1861 50.678 53.385 -2.707 1 1 1048 . 10 1 1 A 93 93 ASP CB C 1861 46.086 45.323 0.763 1 1 1049 . 10 1 1 A 93 93 ASP N N 1861 130.459 125.681 4.778 1 1 1050 . 10 1 1 A 94 94 TYR H H 1862 9.674 8.529 1.145 1 1 1051 . 10 1 1 A 94 94 TYR HA H 1862 4.606 4.509 0.097 1 1 1058 . 10 1 1 A 94 94 TYR CA C 1862 58.983 58.783 0.200 1 1 1059 . 10 1 1 A 94 94 TYR CB C 1862 39.727 38.914 0.813 1 1 1062 . 10 1 1 A 94 94 TYR N N 1862 120.069 122.635 -2.566 1 1 1063 . 10 1 1 A 95 95 VAL H H 1863 8.371 8.778 -0.407 1 1 1064 . 10 1 1 A 95 95 VAL HA H 1863 3.654 3.981 -0.327 1 1 1072 . 10 1 1 A 95 95 VAL CA C 1863 64.922 64.276 0.646 1 1 1073 . 10 1 1 A 95 95 VAL CB C 1863 32.270 31.807 0.463 1 1 1076 . 10 1 1 A 95 95 VAL N N 1863 121.770 124.665 -2.895 1 1 1077 . 10 1 1 A 96 96 ASN H H 1864 8.729 7.781 0.948 1 1 1078 . 10 1 1 A 96 96 ASN HA H 1864 4.901 4.726 0.175 1 1 1083 . 10 1 1 A 96 96 ASN CA C 1864 52.652 54.911 -2.259 1 1 1084 . 10 1 1 A 96 96 ASN CB C 1864 38.160 39.195 -1.035 1 1 1085 . 10 1 1 A 96 96 ASN N N 1864 120.006 118.343 1.663 1 1 1087 . 10 1 1 A 97 97 CYS H H 1865 7.875 7.495 0.380 1 1 1088 . 10 1 1 A 97 97 CYS HA H 1865 4.575 4.418 0.157 1 1 1091 . 10 1 1 A 97 97 CYS CA C 1865 57.009 59.303 -2.294 1 1 1092 . 10 1 1 A 97 97 CYS CB C 1865 29.845 28.330 1.515 1 1 1093 . 10 1 1 A 97 97 CYS N N 1865 117.023 117.971 -0.948 1 1 1094 . 10 1 1 A 98 98 GLY HA2 H 1866 4.045 3.861 0.184 1 1 1095 . 10 1 1 A 98 98 GLY HA3 H 1866 3.866 3.879 -0.013 1 1 1096 . 10 1 1 A 98 98 GLY CA C 1866 46.078 45.527 0.551 1 1 1097 . 10 1 1 A 99 99 HIS H H 1867 7.144 7.600 -0.456 1 1 1098 . 10 1 1 A 99 99 HIS HA H 1867 4.940 4.512 0.428 1 1 1103 . 10 1 1 A 99 99 HIS CA C 1867 53.843 56.016 -2.173 1 1 1104 . 10 1 1 A 99 99 HIS CB C 1867 31.584 30.643 0.941 1 1 1107 . 10 1 1 A 99 99 HIS N N 1867 115.591 117.988 -2.397 1 1 1108 . 10 1 1 A 100 100 VAL H H 1868 8.434 8.523 -0.089 1 1 1109 . 10 1 1 A 100 100 VAL HA H 1868 4.143 4.231 -0.088 1 1 1117 . 10 1 1 A 100 100 VAL CA C 1868 63.974 63.131 0.843 1 1 1118 . 10 1 1 A 100 100 VAL CB C 1868 31.525 32.416 -0.891 1 1 1121 . 10 1 1 A 100 100 VAL N N 1868 122.851 120.651 2.200 1 1 1122 . 10 1 1 A 101 101 THR H H 1869 7.869 8.327 -0.458 1 1 1123 . 10 1 1 A 101 101 THR HA H 1869 5.217 5.054 0.163 1 1 1128 . 10 1 1 A 101 101 THR CA C 1869 59.495 60.897 -1.402 1 1 1129 . 10 1 1 A 101 101 THR CB C 1869 72.402 71.048 1.354 1 1 1131 . 10 1 1 A 101 101 THR N N 1869 118.578 121.541 -2.963 1 1 1132 . 10 1 1 A 102 102 ALA H H 1870 8.512 9.044 -0.532 1 1 1133 . 10 1 1 A 102 102 ALA HA H 1870 5.687 5.514 0.173 1 1 1137 . 10 1 1 A 102 102 ALA CA C 1870 50.497 50.779 -0.282 1 1 1138 . 10 1 1 A 102 102 ALA CB C 1870 23.128 23.768 -0.640 1 1 1139 . 10 1 1 A 102 102 ALA N N 1870 125.193 126.589 -1.396 1 1 1140 . 10 1 1 A 103 103 TYR H H 1871 8.753 8.758 -0.005 1 1 1141 . 10 1 1 A 103 103 TYR HA H 1871 5.019 5.216 -0.197 1 1 1148 . 10 1 1 A 103 103 TYR CA C 1871 56.303 56.202 0.101 1 1 1149 . 10 1 1 A 103 103 TYR CB C 1871 39.347 41.351 -2.004 1 1 1152 . 10 1 1 A 103 103 TYR N N 1871 119.968 116.551 3.417 1 1 1153 . 10 1 1 A 104 104 GLY H H 1872 9.006 8.693 0.313 1 1 1154 . 10 1 1 A 104 104 GLY HA2 H 1872 5.326 4.316 1.010 1 1 1155 . 10 1 1 A 104 104 GLY HA3 H 1872 4.226 4.368 -0.142 1 1 1156 . 10 1 1 A 104 104 GLY CA C 1872 44.624 44.362 0.262 1 1 1157 . 10 1 1 A 104 104 GLY N N 1872 109.622 106.911 2.711 1 1 1158 . 10 1 1 A 105 105 PRO HA H 1873 4.450 4.468 -0.018 1 1 1165 . 10 1 1 A 105 105 PRO CA C 1873 66.676 65.028 1.648 1 1 1166 . 10 1 1 A 105 105 PRO CB C 1873 32.425 32.121 0.304 1 1 1169 . 10 1 1 A 106 106 GLY H H 1874 9.251 8.598 0.653 1 1 1170 . 10 1 1 A 106 106 GLY HA2 H 1874 4.600 3.865 0.735 1 1 1171 . 10 1 1 A 106 106 GLY HA3 H 1874 3.521 4.085 -0.564 1 1 1172 . 10 1 1 A 106 106 GLY CA C 1874 46.454 47.034 -0.580 1 1 1173 . 10 1 1 A 106 106 GLY N N 1874 105.282 105.564 -0.282 1 1 1174 . 10 1 1 A 107 107 LEU H H 1875 7.161 7.846 -0.685 1 1 1175 . 10 1 1 A 107 107 LEU HA H 1875 4.062 3.880 0.182 1 1 1185 . 10 1 1 A 107 107 LEU CA C 1875 55.592 55.966 -0.374 1 1 1186 . 10 1 1 A 107 107 LEU CB C 1875 41.516 40.491 1.025 1 1 1190 . 10 1 1 A 107 107 LEU N N 1875 117.141 119.267 -2.126 1 1 1191 . 10 1 1 A 108 108 THR H H 1876 8.298 7.874 0.424 1 1 1192 . 10 1 1 A 108 108 THR HA H 1876 5.038 4.441 0.597 1 1 1197 . 10 1 1 A 108 108 THR CA C 1876 64.551 63.831 0.720 1 1 1198 . 10 1 1 A 108 108 THR CB C 1876 72.706 70.934 1.772 1 1 1200 . 10 1 1 A 108 108 THR N N 1876 114.411 112.152 2.259 1 1 1201 . 10 1 1 A 109 109 HIS H H 1877 9.030 7.953 1.077 1 1 1202 . 10 1 1 A 109 109 HIS HA H 1877 5.854 5.080 0.774 1 1 1207 . 10 1 1 A 109 109 HIS CA C 1877 56.127 54.807 1.320 1 1 1208 . 10 1 1 A 109 109 HIS CB C 1877 36.258 33.374 2.884 1 1 1211 . 10 1 1 A 109 109 HIS N N 1877 125.809 117.420 8.389 1 1 1212 . 10 1 1 A 110 110 GLY H H 1878 7.497 7.655 -0.158 1 1 1213 . 10 1 1 A 110 110 GLY HA2 H 1878 4.075 4.037 0.038 1 1 1214 . 10 1 1 A 110 110 GLY HA3 H 1878 3.512 4.044 -0.532 1 1 1215 . 10 1 1 A 110 110 GLY CA C 1878 44.559 44.572 -0.013 1 1 1216 . 10 1 1 A 110 110 GLY N N 1878 111.907 111.084 0.823 1 1 1217 . 10 1 1 A 111 111 VAL H H 1879 8.776 8.224 0.552 1 1 1218 . 10 1 1 A 111 111 VAL HA H 1879 4.741 4.751 -0.010 1 1 1226 . 10 1 1 A 111 111 VAL CA C 1879 60.188 60.429 -0.241 1 1 1227 . 10 1 1 A 111 111 VAL CB C 1879 35.130 35.539 -0.409 1 1 1230 . 10 1 1 A 111 111 VAL N N 1879 119.617 119.775 -0.158 1 1 1231 . 10 1 1 A 112 112 VAL H H 1880 7.841 8.658 -0.817 1 1 1232 . 10 1 1 A 112 112 VAL HA H 1880 3.343 3.935 -0.592 1 1 1240 . 10 1 1 A 112 112 VAL CA C 1880 63.553 62.698 0.855 1 1 1241 . 10 1 1 A 112 112 VAL CB C 1880 32.257 31.629 0.628 1 1 1243 . 10 1 1 A 112 112 VAL N N 1880 122.070 126.155 -4.085 1 1 1244 . 10 1 1 A 113 113 ASN H H 1881 8.822 9.114 -0.292 1 1 1245 . 10 1 1 A 113 113 ASN HA H 1881 4.079 4.345 -0.266 1 1 1250 . 10 1 1 A 113 113 ASN CA C 1881 55.459 54.974 0.485 1 1 1251 . 10 1 1 A 113 113 ASN CB C 1881 37.330 37.151 0.179 1 1 1252 . 10 1 1 A 113 113 ASN N N 1881 115.063 117.850 -2.787 1 1 1254 . 10 1 1 A 114 114 LYS H H 1882 8.073 7.483 0.590 1 1 1255 . 10 1 1 A 114 114 LYS HA H 1882 4.818 4.678 0.140 1 1 1260 . 10 1 1 A 114 114 LYS CA C 1882 53.039 52.790 0.249 1 1 1261 . 10 1 1 A 114 114 LYS CB C 1882 34.020 33.174 0.846 1 1 1263 . 10 1 1 A 114 114 LYS N N 1882 121.439 119.228 2.211 1 1 1264 . 10 1 1 A 115 115 PRO HA H 1883 4.409 4.697 -0.288 1 1 1271 . 10 1 1 A 115 115 PRO CA C 1883 63.121 62.639 0.482 1 1 1272 . 10 1 1 A 115 115 PRO CB C 1883 31.515 31.815 -0.300 1 1 1275 . 10 1 1 A 116 116 ALA H H 1884 8.868 8.141 0.727 1 1 1276 . 10 1 1 A 116 116 ALA HA H 1884 4.804 5.050 -0.246 1 1 1280 . 10 1 1 A 116 116 ALA CA C 1884 50.620 50.298 0.322 1 1 1281 . 10 1 1 A 116 116 ALA CB C 1884 19.426 20.907 -1.481 1 1 1282 . 10 1 1 A 116 116 ALA N N 1884 132.329 125.913 6.416 1 1 1283 . 10 1 1 A 117 117 THR H H 1885 8.433 8.805 -0.372 1 1 1284 . 10 1 1 A 117 117 THR HA H 1885 5.747 5.549 0.198 1 1 1289 . 10 1 1 A 117 117 THR CA C 1885 60.364 59.482 0.882 1 1 1290 . 10 1 1 A 117 117 THR CB C 1885 72.204 71.857 0.347 1 1 1292 . 10 1 1 A 117 117 THR N N 1885 113.428 111.440 1.988 1 1 1293 . 10 1 1 A 118 118 PHE H H 1886 9.069 8.538 0.531 1 1 1294 . 10 1 1 A 118 118 PHE HA H 1886 5.123 5.269 -0.146 1 1 1301 . 10 1 1 A 118 118 PHE CA C 1886 57.059 55.973 1.086 1 1 1302 . 10 1 1 A 118 118 PHE CB C 1886 39.994 41.012 -1.018 1 1 1305 . 10 1 1 A 118 118 PHE N N 1886 119.166 117.934 1.232 1 1 1306 . 10 1 1 A 119 119 THR H H 1887 9.451 8.916 0.535 1 1 1307 . 10 1 1 A 119 119 THR HA H 1887 5.097 5.231 -0.134 1 1 1312 . 10 1 1 A 119 119 THR CA C 1887 62.050 61.205 0.845 1 1 1313 . 10 1 1 A 119 119 THR CB C 1887 71.696 72.570 -0.874 1 1 1315 . 10 1 1 A 119 119 THR N N 1887 119.436 114.384 5.052 1 1 1316 . 10 1 1 A 120 120 VAL H H 1888 8.812 9.335 -0.523 1 1 1317 . 10 1 1 A 120 120 VAL HA H 1888 4.807 4.612 0.195 1 1 1325 . 10 1 1 A 120 120 VAL CA C 1888 61.140 61.010 0.130 1 1 1326 . 10 1 1 A 120 120 VAL CB C 1888 34.059 34.030 0.029 1 1 1329 . 10 1 1 A 120 120 VAL N N 1888 124.304 126.546 -2.242 1 1 1330 . 10 1 1 A 121 121 ASN H H 1889 9.291 9.207 0.084 1 1 1331 . 10 1 1 A 121 121 ASN HA H 1889 5.177 5.305 -0.128 1 1 1336 . 10 1 1 A 121 121 ASN CA C 1889 52.470 52.584 -0.114 1 1 1337 . 10 1 1 A 121 121 ASN CB C 1889 39.766 40.290 -0.524 1 1 1338 . 10 1 1 A 121 121 ASN N N 1889 128.674 125.644 3.030 1 1 1340 . 10 1 1 A 122 122 THR H H 1890 8.553 8.539 0.014 1 1 1341 . 10 1 1 A 122 122 THR HA H 1890 4.236 4.900 -0.664 1 1 1346 . 10 1 1 A 122 122 THR CA C 1890 61.062 61.009 0.053 1 1 1347 . 10 1 1 A 122 122 THR CB C 1890 68.437 70.328 -1.891 1 1 1349 . 10 1 1 A 122 122 THR N N 1890 116.203 113.596 2.607 1 1 1350 . 10 1 1 A 123 123 LYS H H 1891 8.210 7.584 0.626 1 1 1351 . 10 1 1 A 123 123 LYS HA H 1891 4.019 3.996 0.023 1 1 1360 . 10 1 1 A 123 123 LYS CA C 1891 58.646 59.726 -1.080 1 1 1361 . 10 1 1 A 123 123 LYS CB C 1891 31.868 32.207 -0.339 1 1 1365 . 10 1 1 A 123 123 LYS N N 1891 124.070 122.524 1.546 1 1 1366 . 10 1 1 A 124 124 ASP H H 1892 8.596 7.887 0.709 1 1 1367 . 10 1 1 A 124 124 ASP HA H 1892 4.638 4.914 -0.276 1 1 1370 . 10 1 1 A 124 124 ASP CA C 1892 54.928 52.872 2.056 1 1 1371 . 10 1 1 A 124 124 ASP CB C 1892 40.725 41.395 -0.670 1 1 1372 . 10 1 1 A 124 124 ASP N N 1892 119.838 117.362 2.476 1 1 1373 . 10 1 1 A 125 125 ALA H H 1893 7.792 7.708 0.084 1 1 1374 . 10 1 1 A 125 125 ALA HA H 1893 4.248 4.136 0.112 1 1 1378 . 10 1 1 A 125 125 ALA CA C 1893 52.852 52.779 0.073 1 1 1379 . 10 1 1 A 125 125 ALA CB C 1893 20.199 19.356 0.843 1 1 1380 . 10 1 1 A 125 125 ALA N N 1893 122.999 122.067 0.932 1 1 1381 . 10 1 1 A 126 126 GLY H H 1894 8.214 7.702 0.512 1 1 1382 . 10 1 1 A 126 126 GLY HA2 H 1894 4.183 3.924 0.259 1 1 1383 . 10 1 1 A 126 126 GLY HA3 H 1894 3.993 3.970 0.023 1 1 1384 . 10 1 1 A 126 126 GLY CA C 1894 44.725 44.590 0.135 1 1 1385 . 10 1 1 A 126 126 GLY N N 1894 108.359 104.015 4.344 1 1 1386 . 10 1 1 A 127 127 GLU H H 1895 8.633 8.407 0.226 1 1 1387 . 10 1 1 A 127 127 GLU HA H 1895 4.318 4.591 -0.273 1 1 1392 . 10 1 1 A 127 127 GLU CA C 1895 57.280 56.818 0.462 1 1 1393 . 10 1 1 A 127 127 GLU CB C 1895 30.434 30.711 -0.277 1 1 1395 . 10 1 1 A 127 127 GLU N N 1895 122.934 120.721 2.213 1 1 1396 . 10 1 1 A 128 128 GLY H H 1896 8.351 8.512 -0.161 1 1 1397 . 10 1 1 A 128 128 GLY HA2 H 1896 3.853 4.053 -0.200 1 1 1398 . 10 1 1 A 128 128 GLY HA3 H 1896 3.853 4.057 -0.204 1 1 1399 . 10 1 1 A 128 128 GLY CA C 1896 45.766 45.534 0.232 1 1 1400 . 10 1 1 A 128 128 GLY N N 1896 111.048 113.516 -2.468 1 1 1401 . 10 1 1 A 129 129 GLY H H 1897 7.580 7.621 -0.041 1 1 1402 . 10 1 1 A 129 129 GLY HA2 H 1897 4.170 4.091 0.079 1 1 1403 . 10 1 1 A 129 129 GLY HA3 H 1897 3.463 4.099 -0.636 1 1 1404 . 10 1 1 A 129 129 GLY CA C 1897 44.670 45.502 -0.832 1 1 1405 . 10 1 1 A 129 129 GLY N N 1897 106.306 106.735 -0.429 1 1 1406 . 10 1 1 A 130 130 LEU H H 1898 8.416 8.482 -0.066 1 1 1407 . 10 1 1 A 130 130 LEU HA H 1898 5.077 4.450 0.627 1 1 1417 . 10 1 1 A 130 130 LEU CA C 1898 54.526 54.269 0.257 1 1 1418 . 10 1 1 A 130 130 LEU CB C 1898 44.499 43.001 1.498 1 1 1422 . 10 1 1 A 130 130 LEU N N 1898 126.737 125.238 1.499 1 1 1423 . 10 1 1 A 131 131 SER H H 1899 9.254 9.416 -0.162 1 1 1424 . 10 1 1 A 131 131 SER HA H 1899 4.803 5.441 -0.638 1 1 1427 . 10 1 1 A 131 131 SER CA C 1899 57.293 57.164 0.129 1 1 1428 . 10 1 1 A 131 131 SER CB C 1899 65.376 66.474 -1.098 1 1 1429 . 10 1 1 A 131 131 SER N N 1899 123.028 124.715 -1.687 1 1 1430 . 10 1 1 A 132 132 LEU H H 1900 8.410 8.542 -0.132 1 1 1431 . 10 1 1 A 132 132 LEU HA H 1900 5.452 4.973 0.479 1 1 1441 . 10 1 1 A 132 132 LEU CA C 1900 53.045 54.406 -1.361 1 1 1442 . 10 1 1 A 132 132 LEU CB C 1900 46.982 45.970 1.012 1 1 1446 . 10 1 1 A 132 132 LEU N N 1900 126.218 123.037 3.181 1 1 1447 . 10 1 1 A 133 133 ALA H H 1901 8.708 8.528 0.180 1 1 1448 . 10 1 1 A 133 133 ALA HA H 1901 4.591 4.939 -0.348 1 1 1452 . 10 1 1 A 133 133 ALA CA C 1901 52.140 51.398 0.742 1 1 1453 . 10 1 1 A 133 133 ALA CB C 1901 22.653 23.666 -1.013 1 1 1454 . 10 1 1 A 133 133 ALA N N 1901 124.744 126.096 -1.352 1 1 1455 . 10 1 1 A 134 134 ILE H H 1902 8.641 8.554 0.087 1 1 1456 . 10 1 1 A 134 134 ILE HA H 1902 5.256 5.173 0.083 1 1 1466 . 10 1 1 A 134 134 ILE CA C 1902 59.873 60.023 -0.150 1 1 1467 . 10 1 1 A 134 134 ILE CB C 1902 41.214 42.059 -0.845 1 1 1471 . 10 1 1 A 134 134 ILE N N 1902 121.132 120.082 1.050 1 1 1472 . 10 1 1 A 135 135 GLU H H 1903 9.294 8.884 0.410 1 1 1473 . 10 1 1 A 135 135 GLU HA H 1903 4.869 5.260 -0.391 1 1 1478 . 10 1 1 A 135 135 GLU CA C 1903 54.307 54.689 -0.382 1 1 1479 . 10 1 1 A 135 135 GLU CB C 1903 32.474 33.213 -0.739 1 1 1481 . 10 1 1 A 135 135 GLU N N 1903 129.644 124.183 5.461 1 1 1482 . 10 1 1 A 136 136 GLY H H 1904 8.347 8.286 0.061 1 1 1483 . 10 1 1 A 136 136 GLY HA2 H 1904 4.005 3.397 0.608 1 1 1484 . 10 1 1 A 136 136 GLY HA3 H 1904 3.629 3.933 -0.304 1 1 1485 . 10 1 1 A 136 136 GLY CA C 1904 45.530 44.934 0.596 1 1 1486 . 10 1 1 A 136 136 GLY N N 1904 112.326 110.071 2.255 1 1 1487 . 10 1 1 A 137 137 PRO HA H 1905 4.268 4.312 -0.044 1 1 1494 . 10 1 1 A 137 137 PRO CA C 1905 64.189 64.158 0.031 1 1 1495 . 10 1 1 A 137 137 PRO CB C 1905 32.482 31.955 0.527 1 1 1498 . 10 1 1 A 138 138 SER H H 1906 7.060 7.356 -0.296 1 1 1499 . 10 1 1 A 138 138 SER HA H 1906 4.603 4.690 -0.087 1 1 1502 . 10 1 1 A 138 138 SER CA C 1906 56.433 56.684 -0.251 1 1 1503 . 10 1 1 A 138 138 SER CB C 1906 66.672 65.421 1.251 1 1 1504 . 10 1 1 A 138 138 SER N N 1906 109.100 111.702 -2.602 1 1 1505 . 10 1 1 A 139 139 LYS H H 1907 8.479 8.314 0.165 1 1 1506 . 10 1 1 A 139 139 LYS HA H 1907 4.413 4.386 0.027 1 1 1515 . 10 1 1 A 139 139 LYS CA C 1907 56.638 56.715 -0.077 1 1 1516 . 10 1 1 A 139 139 LYS CB C 1907 31.873 33.013 -1.140 1 1 1520 . 10 1 1 A 139 139 LYS N N 1907 124.545 125.106 -0.561 1 1 1521 . 10 1 1 A 140 140 ALA H H 1908 8.358 8.521 -0.163 1 1 1522 . 10 1 1 A 140 140 ALA HA H 1908 4.706 4.530 0.176 1 1 1526 . 10 1 1 A 140 140 ALA CA C 1908 51.081 52.641 -1.560 1 1 1527 . 10 1 1 A 140 140 ALA CB C 1908 20.724 19.397 1.327 1 1 1528 . 10 1 1 A 140 140 ALA N N 1908 131.020 129.562 1.458 1 1 1529 . 10 1 1 A 141 141 GLU H H 1909 8.625 8.351 0.274 1 1 1530 . 10 1 1 A 141 141 GLU HA H 1909 4.248 4.819 -0.571 1 1 1535 . 10 1 1 A 141 141 GLU CA C 1909 56.991 55.989 1.002 1 1 1536 . 10 1 1 A 141 141 GLU CB C 1909 30.453 31.107 -0.654 1 1 1538 . 10 1 1 A 141 141 GLU N N 1909 124.862 121.047 3.815 1 1 1539 . 10 1 1 A 142 142 ILE H H 1910 8.588 8.701 -0.113 1 1 1540 . 10 1 1 A 142 142 ILE HA H 1910 4.871 5.131 -0.260 1 1 1550 . 10 1 1 A 142 142 ILE CA C 1910 60.733 59.982 0.751 1 1 1551 . 10 1 1 A 142 142 ILE CB C 1910 41.494 41.502 -0.008 1 1 1555 . 10 1 1 A 142 142 ILE N N 1910 126.220 124.952 1.268 1 1 1556 . 10 1 1 A 143 143 SER H H 1911 9.269 8.910 0.359 1 1 1557 . 10 1 1 A 143 143 SER HA H 1911 4.804 5.474 -0.670 1 1 1560 . 10 1 1 A 143 143 SER CA C 1911 56.988 57.161 -0.173 1 1 1561 . 10 1 1 A 143 143 SER CB C 1911 65.172 65.913 -0.741 1 1 1562 . 10 1 1 A 143 143 SER N N 1911 124.083 122.774 1.309 1 1 1563 . 10 1 1 A 144 144 CYS H H 1912 8.773 9.011 -0.238 1 1 1564 . 10 1 1 A 144 144 CYS HA H 1912 5.200 5.290 -0.090 1 1 1567 . 10 1 1 A 144 144 CYS CA C 1912 57.256 56.212 1.044 1 1 1568 . 10 1 1 A 144 144 CYS CB C 1912 29.137 30.988 -1.851 1 1 1569 . 10 1 1 A 144 144 CYS N N 1912 125.729 119.053 6.676 1 1 1570 . 10 1 1 A 145 145 THR H H 1913 8.976 8.954 0.022 1 1 1571 . 10 1 1 A 145 145 THR HA H 1913 4.510 4.939 -0.429 1 1 1576 . 10 1 1 A 145 145 THR CA C 1913 61.388 61.522 -0.134 1 1 1577 . 10 1 1 A 145 145 THR CB C 1913 71.558 71.705 -0.147 1 1 1579 . 10 1 1 A 145 145 THR N N 1913 124.914 117.621 7.293 1 1 1580 . 10 1 1 A 146 146 ASP H H 1914 8.843 8.833 0.010 1 1 1581 . 10 1 1 A 146 146 ASP HA H 1914 4.842 4.815 0.027 1 1 1584 . 10 1 1 A 146 146 ASP CA C 1914 54.307 54.535 -0.228 1 1 1585 . 10 1 1 A 146 146 ASP CB C 1914 41.262 41.204 0.058 1 1 1586 . 10 1 1 A 146 146 ASP N N 1914 128.084 127.682 0.402 1 1 1587 . 10 1 1 A 147 147 ASN H H 1915 8.700 8.887 -0.187 1 1 1588 . 10 1 1 A 147 147 ASN HA H 1915 4.798 5.048 -0.250 1 1 1593 . 10 1 1 A 147 147 ASN CA C 1915 54.283 51.957 2.326 1 1 1594 . 10 1 1 A 147 147 ASN CB C 1915 38.986 40.947 -1.961 1 1 1595 . 10 1 1 A 147 147 ASN N N 1915 125.720 121.912 3.808 1 1 1597 . 10 1 1 A 148 148 GLN HA H 1916 4.057 4.098 -0.041 1 1 1602 . 10 1 1 A 148 148 GLN CA C 1916 57.839 57.951 -0.112 1 1 1603 . 10 1 1 A 148 148 GLN CB C 1916 26.281 28.003 -1.722 1 1 1605 . 10 1 1 A 149 149 ASP H H 1917 7.892 7.945 -0.053 1 1 1606 . 10 1 1 A 149 149 ASP HA H 1917 4.755 4.549 0.206 1 1 1609 . 10 1 1 A 149 149 ASP CA C 1917 52.659 53.467 -0.808 1 1 1610 . 10 1 1 A 149 149 ASP CB C 1917 41.111 40.099 1.012 1 1 1611 . 10 1 1 A 149 149 ASP N N 1917 118.769 117.022 1.747 1 1 1612 . 10 1 1 A 150 150 GLY H H 1918 8.673 8.507 0.166 1 1 1613 . 10 1 1 A 150 150 GLY HA2 H 1918 4.358 3.931 0.427 1 1 1614 . 10 1 1 A 150 150 GLY HA3 H 1918 3.700 3.933 -0.233 1 1 1615 . 10 1 1 A 150 150 GLY CA C 1918 45.319 46.044 -0.725 1 1 1616 . 10 1 1 A 150 150 GLY N N 1918 110.464 111.519 -1.055 1 1 1617 . 10 1 1 A 151 151 THR H H 1919 8.154 7.565 0.589 1 1 1618 . 10 1 1 A 151 151 THR HA H 1919 4.109 5.056 -0.947 1 1 1623 . 10 1 1 A 151 151 THR CA C 1919 60.041 59.473 0.568 1 1 1624 . 10 1 1 A 151 151 THR CB C 1919 73.422 72.844 0.578 1 1 1626 . 10 1 1 A 151 151 THR N N 1919 111.043 109.912 1.131 1 1 1627 . 10 1 1 A 152 152 CYS H H 1920 9.088 9.210 -0.122 1 1 1628 . 10 1 1 A 152 152 CYS HA H 1920 5.362 5.344 0.018 1 1 1631 . 10 1 1 A 152 152 CYS CA C 1920 56.990 56.999 -0.009 1 1 1632 . 10 1 1 A 152 152 CYS CB C 1920 30.740 30.874 -0.134 1 1 1633 . 10 1 1 A 152 152 CYS N N 1920 118.508 120.732 -2.224 1 1 1634 . 10 1 1 A 153 153 SER H H 1921 9.102 8.950 0.152 1 1 1635 . 10 1 1 A 153 153 SER HA H 1921 4.865 4.945 -0.080 1 1 1638 . 10 1 1 A 153 153 SER CA C 1921 58.023 57.287 0.736 1 1 1639 . 10 1 1 A 153 153 SER CB C 1921 64.133 64.352 -0.219 1 1 1640 . 10 1 1 A 153 153 SER N N 1921 122.048 122.129 -0.081 1 1 1641 . 10 1 1 A 154 154 VAL H H 1922 8.983 8.751 0.232 1 1 1642 . 10 1 1 A 154 154 VAL HA H 1922 4.608 4.780 -0.172 1 1 1650 . 10 1 1 A 154 154 VAL CA C 1922 60.575 59.766 0.809 1 1 1651 . 10 1 1 A 154 154 VAL CB C 1922 32.710 34.590 -1.880 1 1 1654 . 10 1 1 A 154 154 VAL N N 1922 130.262 124.820 5.442 1 1 1655 . 10 1 1 A 155 155 SER H H 1923 8.737 8.807 -0.070 1 1 1656 . 10 1 1 A 155 155 SER HA H 1923 5.680 5.439 0.241 1 1 1659 . 10 1 1 A 155 155 SER CA C 1923 55.991 56.437 -0.446 1 1 1660 . 10 1 1 A 155 155 SER CB C 1923 66.306 65.350 0.956 1 1 1661 . 10 1 1 A 155 155 SER N N 1923 121.504 121.499 0.005 1 1 1662 . 10 1 1 A 156 156 TYR H H 1924 9.061 8.935 0.126 1 1 1663 . 10 1 1 A 156 156 TYR HA H 1924 5.790 5.638 0.152 1 1 1671 . 10 1 1 A 156 156 TYR CA C 1924 55.118 55.717 -0.599 1 1 1672 . 10 1 1 A 156 156 TYR CB C 1924 42.344 42.174 0.170 1 1 1675 . 10 1 1 A 156 156 TYR N N 1924 121.858 121.343 0.515 1 1 1676 . 10 1 1 A 157 157 LEU H H 1925 7.505 9.282 -1.777 1 1 1677 . 10 1 1 A 157 157 LEU HA H 1925 4.996 4.728 0.268 1 1 1687 . 10 1 1 A 157 157 LEU CA C 1925 50.476 51.258 -0.782 1 1 1688 . 10 1 1 A 157 157 LEU CB C 1925 43.334 43.117 0.217 1 1 1692 . 10 1 1 A 157 157 LEU N N 1925 123.272 121.980 1.292 1 1 1693 . 10 1 1 A 158 158 PRO HA H 1926 4.691 4.926 -0.235 1 1 1700 . 10 1 1 A 158 158 PRO CA C 1926 61.808 62.511 -0.703 1 1 1701 . 10 1 1 A 158 158 PRO CB C 1926 32.551 33.407 -0.856 1 1 1704 . 10 1 1 A 159 159 VAL H H 1927 8.388 8.241 0.147 1 1 1705 . 10 1 1 A 159 159 VAL HA H 1927 4.510 4.483 0.027 1 1 1713 . 10 1 1 A 159 159 VAL CA C 1927 61.778 61.578 0.200 1 1 1714 . 10 1 1 A 159 159 VAL CB C 1927 32.432 34.086 -1.654 1 1 1717 . 10 1 1 A 159 159 VAL N N 1927 115.680 117.011 -1.331 1 1 1718 . 10 1 1 A 160 160 LEU H H 1928 6.931 7.751 -0.820 1 1 1719 . 10 1 1 A 160 160 LEU HA H 1928 4.931 4.830 0.101 1 1 1729 . 10 1 1 A 160 160 LEU CA C 1928 51.971 51.369 0.602 1 1 1730 . 10 1 1 A 160 160 LEU CB C 1928 45.905 44.488 1.417 1 1 1734 . 10 1 1 A 160 160 LEU N N 1928 120.258 123.547 -3.289 1 1 1735 . 10 1 1 A 161 161 PRO HA H 1929 4.317 4.834 -0.517 1 1 1742 . 10 1 1 A 161 161 PRO CA C 1929 62.809 62.949 -0.140 1 1 1743 . 10 1 1 A 161 161 PRO CB C 1929 32.662 33.052 -0.390 1 1 1746 . 10 1 1 A 162 162 GLY H H 1930 8.916 8.177 0.739 1 1 1747 . 10 1 1 A 162 162 GLY HA2 H 1930 4.461 4.175 0.286 1 1 1748 . 10 1 1 A 162 162 GLY HA3 H 1930 3.852 4.199 -0.347 1 1 1749 . 10 1 1 A 162 162 GLY CA C 1930 44.496 44.120 0.376 1 1 1750 . 10 1 1 A 162 162 GLY N N 1930 107.609 107.159 0.450 1 1 1751 . 10 1 1 A 163 163 ASP H H 1931 8.245 8.394 -0.149 1 1 1752 . 10 1 1 A 163 163 ASP HA H 1931 5.565 5.566 -0.001 1 1 1755 . 10 1 1 A 163 163 ASP CA C 1931 53.628 53.229 0.399 1 1 1756 . 10 1 1 A 163 163 ASP CB C 1931 41.058 42.291 -1.233 1 1 1757 . 10 1 1 A 163 163 ASP N N 1931 121.979 119.070 2.909 1 1 1758 . 10 1 1 A 164 164 TYR H H 1932 9.606 9.462 0.144 1 1 1759 . 10 1 1 A 164 164 TYR HA H 1932 4.896 5.237 -0.341 1 1 1767 . 10 1 1 A 164 164 TYR CA C 1932 56.955 56.446 0.509 1 1 1768 . 10 1 1 A 164 164 TYR CB C 1932 40.339 41.195 -0.856 1 1 1771 . 10 1 1 A 164 164 TYR N N 1932 125.257 121.935 3.322 1 1 1772 . 10 1 1 A 165 165 SER H H 1933 9.095 9.312 -0.217 1 1 1773 . 10 1 1 A 165 165 SER HA H 1933 5.500 5.112 0.388 1 1 1776 . 10 1 1 A 165 165 SER CA C 1933 56.509 58.504 -1.995 1 1 1777 . 10 1 1 A 165 165 SER CB C 1933 64.486 63.942 0.544 1 1 1778 . 10 1 1 A 165 165 SER N N 1933 119.162 120.767 -1.605 1 1 1779 . 10 1 1 A 166 166 ILE H H 1934 9.598 9.360 0.238 1 1 1780 . 10 1 1 A 166 166 ILE HA H 1934 4.541 4.921 -0.380 1 1 1790 . 10 1 1 A 166 166 ILE CA C 1934 61.080 59.897 1.183 1 1 1791 . 10 1 1 A 166 166 ILE CB C 1934 39.282 39.499 -0.217 1 1 1795 . 10 1 1 A 166 166 ILE N N 1934 128.701 127.530 1.171 1 1 1796 . 10 1 1 A 167 167 LEU H H 1935 9.359 9.348 0.011 1 1 1797 . 10 1 1 A 167 167 LEU HA H 1935 4.779 5.354 -0.575 1 1 1807 . 10 1 1 A 167 167 LEU CA C 1935 55.921 53.311 2.610 1 1 1808 . 10 1 1 A 167 167 LEU CB C 1935 42.473 45.087 -2.614 1 1 1811 . 10 1 1 A 167 167 LEU N N 1935 131.315 130.568 0.747 1 1 1812 . 10 1 1 A 168 168 VAL H H 1936 9.425 9.088 0.337 1 1 1813 . 10 1 1 A 168 168 VAL HA H 1936 4.617 4.787 -0.170 1 1 1821 . 10 1 1 A 168 168 VAL CA C 1936 61.418 60.971 0.447 1 1 1822 . 10 1 1 A 168 168 VAL CB C 1936 33.616 34.887 -1.271 1 1 1824 . 10 1 1 A 168 168 VAL N N 1936 126.961 126.055 0.906 1 1 1825 . 10 1 1 A 169 169 LYS H H 1937 8.643 8.428 0.215 1 1 1826 . 10 1 1 A 169 169 LYS HA H 1937 5.067 4.949 0.118 1 1 1835 . 10 1 1 A 169 169 LYS CA C 1937 53.949 55.438 -1.489 1 1 1836 . 10 1 1 A 169 169 LYS CB C 1937 36.691 35.940 0.751 1 1 1840 . 10 1 1 A 169 169 LYS N N 1937 124.773 127.430 -2.657 1 1 1841 . 10 1 1 A 170 170 TYR H H 1938 8.877 9.253 -0.376 1 1 1842 . 10 1 1 A 170 170 TYR HA H 1938 5.137 5.059 0.078 1 1 1849 . 10 1 1 A 170 170 TYR CA C 1938 57.034 57.521 -0.487 1 1 1850 . 10 1 1 A 170 170 TYR CB C 1938 42.105 41.979 0.126 1 1 1853 . 10 1 1 A 170 170 TYR N N 1938 122.371 127.089 -4.718 1 1 1854 . 10 1 1 A 171 171 ASN H H 1939 8.933 9.791 -0.858 1 1 1855 . 10 1 1 A 171 171 ASN HA H 1939 4.405 4.446 -0.041 1 1 1860 . 10 1 1 A 171 171 ASN CA C 1939 54.512 54.225 0.287 1 1 1861 . 10 1 1 A 171 171 ASN CB C 1939 37.025 37.215 -0.190 1 1 1862 . 10 1 1 A 171 171 ASN N N 1939 129.922 126.475 3.447 1 1 1864 . 10 1 1 A 172 172 GLU H H 1940 8.857 8.862 -0.005 1 1 1865 . 10 1 1 A 172 172 GLU HA H 1940 3.511 4.051 -0.540 1 1 1870 . 10 1 1 A 172 172 GLU CA C 1940 57.910 57.467 0.443 1 1 1871 . 10 1 1 A 172 172 GLU CB C 1940 27.139 27.401 -0.262 1 1 1873 . 10 1 1 A 172 172 GLU N N 1940 107.943 116.275 -8.332 1 1 1874 . 10 1 1 A 173 173 GLN H H 1941 7.544 7.683 -0.139 1 1 1875 . 10 1 1 A 173 173 GLN HA H 1941 4.749 4.826 -0.077 1 1 1882 . 10 1 1 A 173 173 GLN CA C 1941 53.770 54.301 -0.531 1 1 1883 . 10 1 1 A 173 173 GLN CB C 1941 31.078 31.325 -0.247 1 1 1885 . 10 1 1 A 173 173 GLN N N 1941 119.865 120.187 -0.322 1 1 1887 . 10 1 1 A 174 174 HIS H H 1942 8.848 8.966 -0.118 1 1 1888 . 10 1 1 A 174 174 HIS HA H 1942 4.513 4.704 -0.191 1 1 1893 . 10 1 1 A 174 174 HIS CA C 1942 58.893 56.867 2.026 1 1 1894 . 10 1 1 A 174 174 HIS CB C 1942 32.196 30.285 1.911 1 1 1897 . 10 1 1 A 174 174 HIS N N 1942 126.437 121.810 4.627 1 1 1898 . 10 1 1 A 175 175 VAL H H 1943 8.483 8.423 0.060 1 1 1899 . 10 1 1 A 175 175 VAL HA H 1943 4.643 4.328 0.315 1 1 1907 . 10 1 1 A 175 175 VAL CA C 1943 60.025 61.103 -1.078 1 1 1908 . 10 1 1 A 175 175 VAL CB C 1943 29.439 31.606 -2.167 1 1 1911 . 10 1 1 A 175 175 VAL N N 1943 121.671 121.622 0.049 1 1 1912 . 10 1 1 A 176 176 PRO HA H 1944 4.045 4.114 -0.069 1 1 1919 . 10 1 1 A 176 176 PRO CA C 1944 64.943 65.274 -0.331 1 1 1920 . 10 1 1 A 176 176 PRO CB C 1944 31.120 31.369 -0.249 1 1 1923 . 10 1 1 A 177 177 GLY H H 1945 7.579 8.045 -0.466 1 1 1924 . 10 1 1 A 177 177 GLY HA2 H 1945 3.210 3.193 0.017 1 1 1925 . 10 1 1 A 177 177 GLY HA3 H 1945 2.311 3.214 -0.903 1 1 1926 . 10 1 1 A 177 177 GLY CA C 1945 44.184 44.253 -0.069 1 1 1927 . 10 1 1 A 177 177 GLY N N 1945 113.696 106.964 6.732 1 1 1928 . 10 1 1 A 178 178 SER H H 1946 7.469 7.286 0.183 1 1 1929 . 10 1 1 A 178 178 SER HA H 1946 4.023 3.852 0.171 1 1 1932 . 10 1 1 A 178 178 SER CA C 1946 54.593 54.919 -0.326 1 1 1933 . 10 1 1 A 178 178 SER CB C 1946 62.282 63.594 -1.312 1 1 1934 . 10 1 1 A 178 178 SER N N 1946 113.219 116.220 -3.001 1 1 1935 . 10 1 1 A 179 179 PRO HA H 1947 5.314 4.807 0.507 1 1 1942 . 10 1 1 A 179 179 PRO CA C 1947 62.198 62.312 -0.114 1 1 1943 . 10 1 1 A 179 179 PRO CB C 1947 33.923 32.915 1.008 1 1 1946 . 10 1 1 A 180 180 PHE H H 1948 9.395 8.780 0.615 1 1 1947 . 10 1 1 A 180 180 PHE HA H 1948 4.706 4.939 -0.233 1 1 1955 . 10 1 1 A 180 180 PHE CA C 1948 57.298 57.596 -0.298 1 1 1956 . 10 1 1 A 180 180 PHE CB C 1948 41.116 40.567 0.549 1 1 1960 . 10 1 1 A 180 180 PHE N N 1948 127.510 120.648 6.862 1 1 1961 . 10 1 1 A 181 181 THR H H 1949 9.111 8.870 0.241 1 1 1962 . 10 1 1 A 181 181 THR HA H 1949 5.091 5.251 -0.160 1 1 1967 . 10 1 1 A 181 181 THR CA C 1949 62.668 61.283 1.385 1 1 1968 . 10 1 1 A 181 181 THR CB C 1949 70.354 71.483 -1.129 1 1 1970 . 10 1 1 A 181 181 THR N N 1949 120.325 115.924 4.401 1 1 1971 . 10 1 1 A 182 182 ALA H H 1950 8.992 9.443 -0.451 1 1 1972 . 10 1 1 A 182 182 ALA HA H 1950 4.521 5.151 -0.630 1 1 1976 . 10 1 1 A 182 182 ALA CA C 1950 50.080 51.238 -1.158 1 1 1977 . 10 1 1 A 182 182 ALA CB C 1950 21.717 20.358 1.359 1 1 1978 . 10 1 1 A 182 182 ALA N N 1950 130.794 130.647 0.147 1 1 1979 . 10 1 1 A 183 183 ARG H H 1951 7.764 8.513 -0.749 1 1 1980 . 10 1 1 A 183 183 ARG HA H 1951 5.001 5.204 -0.203 1 1 1988 . 10 1 1 A 183 183 ARG CA C 1951 55.116 54.706 0.410 1 1 1989 . 10 1 1 A 183 183 ARG CB C 1951 30.631 33.480 -2.849 1 1 1992 . 10 1 1 A 183 183 ARG N N 1951 121.920 121.304 0.616 1 1 1994 . 10 1 1 A 184 184 VAL H H 1952 9.121 9.576 -0.455 1 1 1995 . 10 1 1 A 184 184 VAL HA H 1952 4.865 4.754 0.111 1 1 2003 . 10 1 1 A 184 184 VAL CA C 1952 60.375 61.153 -0.778 1 1 2004 . 10 1 1 A 184 184 VAL CB C 1952 32.179 33.837 -1.658 1 1 2007 . 10 1 1 A 184 184 VAL N N 1952 125.421 127.671 -2.250 1 1 2008 . 10 1 1 A 185 185 THR H H 1953 8.799 8.926 -0.127 1 1 2009 . 10 1 1 A 185 185 THR HA H 1953 4.829 5.066 -0.237 1 1 2014 . 10 1 1 A 185 185 THR CA C 1953 60.316 60.116 0.200 1 1 2015 . 10 1 1 A 185 185 THR CB C 1953 70.825 70.982 -0.157 1 1 2017 . 10 1 1 A 185 185 THR N N 1953 121.794 122.933 -1.139 1 1 2018 . 10 1 1 A 186 186 GLY H H 1954 8.586 8.389 0.197 1 1 2019 . 10 1 1 A 186 186 GLY HA2 H 1954 4.261 4.075 0.186 1 1 2020 . 10 1 1 A 186 186 GLY HA3 H 1954 4.033 4.081 -0.048 1 1 2021 . 10 1 1 A 186 186 GLY CA C 1954 45.038 45.359 -0.321 1 1 2022 . 10 1 1 A 186 186 GLY N N 1954 107.588 111.378 -3.790 1 1 2023 . 10 1 1 A 187 187 ASP H H 1955 8.386 9.243 -0.857 1 1 2024 . 10 1 1 A 187 187 ASP HA H 1955 4.772 4.596 0.176 1 1 2027 . 10 1 1 A 187 187 ASP CA C 1955 53.909 55.506 -1.597 1 1 2028 . 10 1 1 A 187 187 ASP CB C 1955 41.510 41.048 0.462 1 1 2029 . 10 1 1 A 187 187 ASP N N 1955 121.829 122.252 -0.423 1 1 4 . 11 1 1 A 2 2 ALA HA H -2 4.368 4.078 0.290 1 1 8 . 11 1 1 A 2 2 ALA CA C -2 52.604 54.100 -1.496 1 1 9 . 11 1 1 A 2 2 ALA CB C -2 19.551 18.496 1.055 1 1 32 . 11 1 1 A 5 5 PRO HA H 1773 4.433 4.664 -0.231 1 1 39 . 11 1 1 A 5 5 PRO CA C 1773 63.017 62.415 0.602 1 1 40 . 11 1 1 A 5 5 PRO CB C 1773 32.155 32.400 -0.245 1 1 43 . 11 1 1 A 6 6 GLU H H 1774 8.495 8.509 -0.014 1 1 44 . 11 1 1 A 6 6 GLU HA H 1774 4.242 4.914 -0.672 1 1 49 . 11 1 1 A 6 6 GLU CA C 1774 56.735 56.139 0.596 1 1 50 . 11 1 1 A 6 6 GLU CB C 1774 30.401 30.923 -0.522 1 1 52 . 11 1 1 A 6 6 GLU N N 1774 122.494 120.921 1.573 1 1 53 . 11 1 1 A 7 7 ARG H H 1775 8.275 8.454 -0.179 1 1 54 . 11 1 1 A 7 7 ARG HA H 1775 4.648 4.701 -0.053 1 1 61 . 11 1 1 A 7 7 ARG CA C 1775 53.827 53.743 0.084 1 1 62 . 11 1 1 A 7 7 ARG CB C 1775 30.417 33.779 -3.362 1 1 65 . 11 1 1 A 7 7 ARG N N 1775 124.017 123.085 0.932 1 1 66 . 11 1 1 A 8 8 PRO HA H 1776 4.433 4.774 -0.341 1 1 73 . 11 1 1 A 8 8 PRO CA C 1776 63.036 62.283 0.753 1 1 74 . 11 1 1 A 8 8 PRO CB C 1776 32.201 33.256 -1.055 1 1 77 . 11 1 1 A 9 9 LEU H H 1777 8.349 8.187 0.162 1 1 78 . 11 1 1 A 9 9 LEU HA H 1777 4.365 4.182 0.183 1 1 88 . 11 1 1 A 9 9 LEU CA C 1777 55.275 54.772 0.503 1 1 89 . 11 1 1 A 9 9 LEU CB C 1777 42.376 41.322 1.054 1 1 93 . 11 1 1 A 9 9 LEU N N 1777 123.820 119.741 4.079 1 1 94 . 11 1 1 A 10 10 VAL H H 1778 7.989 7.428 0.561 1 1 95 . 11 1 1 A 10 10 VAL HA H 1778 4.182 3.708 0.474 1 1 103 . 11 1 1 A 10 10 VAL CA C 1778 62.141 65.479 -3.338 1 1 104 . 11 1 1 A 10 10 VAL CB C 1778 33.175 31.418 1.757 1 1 106 . 11 1 1 A 10 10 VAL N N 1778 121.714 122.705 -0.991 1 1 107 . 11 1 1 A 11 11 GLY H H 1779 8.450 8.901 -0.451 1 1 108 . 11 1 1 A 11 11 GLY HA2 H 1779 4.002 4.006 -0.004 1 1 109 . 11 1 1 A 11 11 GLY HA3 H 1779 4.002 4.007 -0.005 1 1 110 . 11 1 1 A 11 11 GLY CA C 1779 45.297 44.946 0.351 1 1 111 . 11 1 1 A 11 11 GLY N N 1779 113.826 115.307 -1.481 1 1 112 . 11 1 1 A 12 12 VAL H H 1780 8.013 7.720 0.293 1 1 113 . 11 1 1 A 12 12 VAL HA H 1780 4.136 4.152 -0.016 1 1 121 . 11 1 1 A 12 12 VAL CA C 1780 62.466 61.777 0.689 1 1 122 . 11 1 1 A 12 12 VAL CB C 1780 32.752 32.313 0.439 1 1 125 . 11 1 1 A 12 12 VAL N N 1780 120.109 119.148 0.961 1 1 126 . 11 1 1 A 13 13 ASN H H 1781 8.528 8.796 -0.268 1 1 127 . 11 1 1 A 13 13 ASN HA H 1781 4.712 4.803 -0.091 1 1 132 . 11 1 1 A 13 13 ASN CA C 1781 53.485 54.190 -0.705 1 1 133 . 11 1 1 A 13 13 ASN CB C 1781 38.996 39.111 -0.115 1 1 134 . 11 1 1 A 13 13 ASN N N 1781 122.648 122.084 0.564 1 1 136 . 11 1 1 A 14 14 GLY H H 1782 8.283 8.561 -0.278 1 1 137 . 11 1 1 A 14 14 GLY HA2 H 1782 3.929 4.004 -0.075 1 1 138 . 11 1 1 A 14 14 GLY HA3 H 1782 3.929 4.004 -0.075 1 1 139 . 11 1 1 A 14 14 GLY CA C 1782 45.531 44.662 0.869 1 1 140 . 11 1 1 A 14 14 GLY N N 1782 110.229 109.349 0.880 1 1 141 . 11 1 1 A 15 15 LEU H H 1783 7.925 8.214 -0.289 1 1 142 . 11 1 1 A 15 15 LEU HA H 1783 4.340 5.125 -0.785 1 1 152 . 11 1 1 A 15 15 LEU CA C 1783 55.045 53.164 1.881 1 1 153 . 11 1 1 A 15 15 LEU CB C 1783 42.682 44.736 -2.054 1 1 157 . 11 1 1 A 15 15 LEU N N 1783 122.626 119.712 2.914 1 1 158 . 11 1 1 A 16 16 ASP H H 1784 8.360 8.857 -0.497 1 1 159 . 11 1 1 A 16 16 ASP HA H 1784 4.747 4.913 -0.166 1 1 162 . 11 1 1 A 16 16 ASP CA C 1784 53.939 54.090 -0.151 1 1 163 . 11 1 1 A 16 16 ASP CB C 1784 41.150 42.040 -0.890 1 1 164 . 11 1 1 A 16 16 ASP N N 1784 122.868 123.088 -0.220 1 1 165 . 11 1 1 A 17 17 VAL H H 1785 8.201 8.698 -0.497 1 1 166 . 11 1 1 A 17 17 VAL HA H 1785 4.237 4.963 -0.726 1 1 174 . 11 1 1 A 17 17 VAL CA C 1785 62.881 59.659 3.222 1 1 175 . 11 1 1 A 17 17 VAL CB C 1785 31.967 35.722 -3.755 1 1 178 . 11 1 1 A 17 17 VAL N N 1785 121.110 119.019 2.091 1 1 179 . 11 1 1 A 18 18 THR H H 1786 8.291 8.712 -0.421 1 1 180 . 11 1 1 A 18 18 THR HA H 1786 4.466 4.517 -0.051 1 1 185 . 11 1 1 A 18 18 THR CA C 1786 62.388 62.785 -0.397 1 1 186 . 11 1 1 A 18 18 THR CB C 1786 69.719 71.905 -2.186 1 1 188 . 11 1 1 A 18 18 THR N N 1786 115.267 119.033 -3.766 1 1 189 . 11 1 1 A 19 19 SER H H 1787 8.148 8.038 0.110 1 1 190 . 11 1 1 A 19 19 SER HA H 1787 4.542 4.374 0.168 1 1 193 . 11 1 1 A 19 19 SER CA C 1787 59.096 59.299 -0.203 1 1 194 . 11 1 1 A 19 19 SER CB C 1787 63.993 63.676 0.317 1 1 195 . 11 1 1 A 19 19 SER N N 1787 118.576 118.225 0.351 1 1 196 . 11 1 1 A 20 20 LEU H H 1788 8.263 8.518 -0.255 1 1 197 . 11 1 1 A 20 20 LEU HA H 1788 4.243 4.762 -0.519 1 1 207 . 11 1 1 A 20 20 LEU CA C 1788 54.087 53.417 0.670 1 1 208 . 11 1 1 A 20 20 LEU CB C 1788 43.006 45.331 -2.325 1 1 212 . 11 1 1 A 20 20 LEU N N 1788 125.834 123.606 2.228 1 1 213 . 11 1 1 A 21 21 ARG H H 1789 8.191 7.925 0.266 1 1 214 . 11 1 1 A 21 21 ARG HA H 1789 4.080 4.215 -0.135 1 1 222 . 11 1 1 A 21 21 ARG CA C 1789 54.894 54.078 0.816 1 1 223 . 11 1 1 A 21 21 ARG CB C 1789 30.881 30.546 0.335 1 1 226 . 11 1 1 A 21 21 ARG N N 1789 127.213 122.165 5.048 1 1 228 . 11 1 1 A 22 22 PRO HA H 1790 4.441 4.711 -0.270 1 1 233 . 11 1 1 A 22 22 PRO CA C 1790 62.882 62.540 0.342 1 1 234 . 11 1 1 A 22 22 PRO CB C 1790 32.204 32.198 0.006 1 1 237 . 11 1 1 A 23 23 PHE H H 1791 8.336 8.344 -0.008 1 1 238 . 11 1 1 A 23 23 PHE HA H 1791 4.701 4.927 -0.226 1 1 246 . 11 1 1 A 23 23 PHE CA C 1791 57.504 56.925 0.579 1 1 247 . 11 1 1 A 23 23 PHE CB C 1791 42.192 42.076 0.116 1 1 251 . 11 1 1 A 23 23 PHE N N 1791 122.145 122.579 -0.434 1 1 252 . 11 1 1 A 24 24 ASP H H 1792 6.954 8.963 -2.009 1 1 253 . 11 1 1 A 24 24 ASP HA H 1792 5.039 5.286 -0.247 1 1 256 . 11 1 1 A 24 24 ASP CA C 1792 52.871 52.695 0.176 1 1 257 . 11 1 1 A 24 24 ASP CB C 1792 44.696 44.864 -0.168 1 1 258 . 11 1 1 A 24 24 ASP N N 1792 127.481 125.622 1.859 1 1 259 . 11 1 1 A 25 25 LEU H H 1793 8.372 8.363 0.009 1 1 260 . 11 1 1 A 25 25 LEU HA H 1793 4.336 4.711 -0.375 1 1 270 . 11 1 1 A 25 25 LEU CA C 1793 54.860 53.724 1.136 1 1 271 . 11 1 1 A 25 25 LEU CB C 1793 47.575 45.846 1.729 1 1 274 . 11 1 1 A 25 25 LEU N N 1793 123.241 121.652 1.589 1 1 275 . 11 1 1 A 26 26 VAL H H 1794 8.489 9.053 -0.564 1 1 276 . 11 1 1 A 26 26 VAL HA H 1794 4.903 5.126 -0.223 1 1 284 . 11 1 1 A 26 26 VAL CA C 1794 61.669 59.739 1.930 1 1 285 . 11 1 1 A 26 26 VAL CB C 1794 32.458 34.846 -2.388 1 1 288 . 11 1 1 A 26 26 VAL N N 1794 128.849 121.385 7.464 1 1 289 . 11 1 1 A 27 27 ILE H H 1795 9.101 9.247 -0.146 1 1 290 . 11 1 1 A 27 27 ILE HA H 1795 4.701 4.588 0.113 1 1 300 . 11 1 1 A 27 27 ILE CA C 1795 57.433 57.513 -0.080 1 1 301 . 11 1 1 A 27 27 ILE CB C 1795 41.865 41.635 0.230 1 1 305 . 11 1 1 A 27 27 ILE N N 1795 127.511 128.357 -0.846 1 1 306 . 11 1 1 A 28 28 PRO HA H 1796 4.838 4.860 -0.022 1 1 313 . 11 1 1 A 28 28 PRO CA C 1796 62.406 62.727 -0.321 1 1 314 . 11 1 1 A 28 28 PRO CB C 1796 30.684 31.694 -1.010 1 1 317 . 11 1 1 A 29 29 PHE H H 1797 8.255 8.440 -0.185 1 1 318 . 11 1 1 A 29 29 PHE HA H 1797 4.151 4.927 -0.776 1 1 326 . 11 1 1 A 29 29 PHE CA C 1797 60.405 58.227 2.178 1 1 327 . 11 1 1 A 29 29 PHE CB C 1797 41.395 42.182 -0.787 1 1 331 . 11 1 1 A 29 29 PHE N N 1797 128.572 123.063 5.509 1 1 332 . 11 1 1 A 30 30 THR H H 1798 7.433 7.701 -0.268 1 1 333 . 11 1 1 A 30 30 THR HA H 1798 4.108 4.957 -0.849 1 1 338 . 11 1 1 A 30 30 THR CA C 1798 61.473 61.098 0.375 1 1 339 . 11 1 1 A 30 30 THR CB C 1798 69.324 71.707 -2.383 1 1 341 . 11 1 1 A 30 30 THR N N 1798 123.124 118.628 4.496 1 1 342 . 11 1 1 A 31 31 ILE H H 1799 8.402 9.125 -0.723 1 1 343 . 11 1 1 A 31 31 ILE HA H 1799 3.653 4.350 -0.697 1 1 353 . 11 1 1 A 31 31 ILE CA C 1799 61.802 61.691 0.111 1 1 354 . 11 1 1 A 31 31 ILE CB C 1799 38.548 37.186 1.362 1 1 358 . 11 1 1 A 31 31 ILE N N 1799 128.616 127.937 0.679 1 1 359 . 11 1 1 A 32 32 LYS H H 1800 7.742 8.428 -0.686 1 1 360 . 11 1 1 A 32 32 LYS HA H 1800 4.558 4.624 -0.066 1 1 365 . 11 1 1 A 32 32 LYS CA C 1800 56.566 54.366 2.200 1 1 366 . 11 1 1 A 32 32 LYS CB C 1800 31.982 32.663 -0.681 1 1 368 . 11 1 1 A 32 32 LYS N N 1800 128.656 128.175 0.481 1 1 369 . 11 1 1 A 33 33 LYS HA H 1801 4.531 4.173 0.358 1 1 378 . 11 1 1 A 33 33 LYS CA C 1801 56.310 58.039 -1.729 1 1 379 . 11 1 1 A 33 33 LYS CB C 1801 33.027 32.077 0.950 1 1 383 . 11 1 1 A 34 34 GLY H H 1802 8.088 7.702 0.386 1 1 384 . 11 1 1 A 34 34 GLY HA2 H 1802 4.159 4.035 0.124 1 1 385 . 11 1 1 A 34 34 GLY HA3 H 1802 3.712 4.074 -0.362 1 1 386 . 11 1 1 A 34 34 GLY CA C 1802 45.302 44.253 1.049 1 1 387 . 11 1 1 A 34 34 GLY N N 1802 110.338 109.904 0.434 1 1 388 . 11 1 1 A 35 35 GLU H H 1803 8.219 8.120 0.099 1 1 389 . 11 1 1 A 35 35 GLU HA H 1803 4.692 5.124 -0.432 1 1 394 . 11 1 1 A 35 35 GLU CA C 1803 55.160 54.371 0.789 1 1 395 . 11 1 1 A 35 35 GLU CB C 1803 32.407 34.289 -1.882 1 1 397 . 11 1 1 A 35 35 GLU N N 1803 119.576 118.949 0.627 1 1 398 . 11 1 1 A 36 36 ILE H H 1804 8.869 8.753 0.116 1 1 399 . 11 1 1 A 36 36 ILE HA H 1804 5.468 5.131 0.337 1 1 409 . 11 1 1 A 36 36 ILE CA C 1804 58.861 58.744 0.117 1 1 410 . 11 1 1 A 36 36 ILE CB C 1804 41.007 41.998 -0.991 1 1 414 . 11 1 1 A 36 36 ILE N N 1804 128.141 122.932 5.209 1 1 415 . 11 1 1 A 37 37 THR H H 1805 9.075 8.812 0.263 1 1 416 . 11 1 1 A 37 37 THR HA H 1805 4.703 5.166 -0.463 1 1 421 . 11 1 1 A 37 37 THR CA C 1805 59.932 59.879 0.053 1 1 422 . 11 1 1 A 37 37 THR CB C 1805 72.441 72.350 0.091 1 1 424 . 11 1 1 A 37 37 THR N N 1805 119.846 117.122 2.724 1 1 425 . 11 1 1 A 38 38 GLY H H 1806 8.468 8.288 0.180 1 1 426 . 11 1 1 A 38 38 GLY HA2 H 1806 5.076 4.284 0.792 1 1 427 . 11 1 1 A 38 38 GLY HA3 H 1806 3.503 4.306 -0.803 1 1 428 . 11 1 1 A 38 38 GLY CA C 1806 45.593 45.039 0.554 1 1 429 . 11 1 1 A 38 38 GLY N N 1806 107.815 108.401 -0.586 1 1 430 . 11 1 1 A 39 39 GLU H H 1807 8.519 8.518 0.001 1 1 431 . 11 1 1 A 39 39 GLU HA H 1807 4.713 5.085 -0.372 1 1 436 . 11 1 1 A 39 39 GLU CA C 1807 56.936 55.541 1.395 1 1 437 . 11 1 1 A 39 39 GLU CB C 1807 34.937 33.949 0.988 1 1 439 . 11 1 1 A 39 39 GLU N N 1807 120.173 119.788 0.385 1 1 440 . 11 1 1 A 40 40 VAL H H 1808 9.156 9.364 -0.208 1 1 441 . 11 1 1 A 40 40 VAL HA H 1808 4.778 4.748 0.030 1 1 449 . 11 1 1 A 40 40 VAL CA C 1808 60.574 61.109 -0.535 1 1 450 . 11 1 1 A 40 40 VAL CB C 1808 34.168 33.338 0.830 1 1 452 . 11 1 1 A 40 40 VAL N N 1808 126.330 127.410 -1.080 1 1 453 . 11 1 1 A 41 41 ARG H H 1809 9.044 9.177 -0.133 1 1 454 . 11 1 1 A 41 41 ARG HA H 1809 4.778 4.899 -0.121 1 1 462 . 11 1 1 A 41 41 ARG CA C 1809 55.317 54.008 1.309 1 1 463 . 11 1 1 A 41 41 ARG CB C 1809 31.940 33.357 -1.417 1 1 466 . 11 1 1 A 41 41 ARG N N 1809 127.098 126.283 0.815 1 1 468 . 11 1 1 A 42 42 MET H H 1810 8.264 8.907 -0.643 1 1 469 . 11 1 1 A 42 42 MET HA H 1810 4.050 4.475 -0.425 1 1 477 . 11 1 1 A 42 42 MET CA C 1810 53.716 54.188 -0.472 1 1 478 . 11 1 1 A 42 42 MET CB C 1810 32.779 32.480 0.299 1 1 481 . 11 1 1 A 42 42 MET N N 1810 123.461 123.065 0.396 1 1 482 . 11 1 1 A 43 43 PRO HA H 1811 4.179 4.368 -0.189 1 1 489 . 11 1 1 A 43 43 PRO CA C 1811 66.422 64.048 2.374 1 1 490 . 11 1 1 A 43 43 PRO CB C 1811 31.462 31.733 -0.271 1 1 493 . 11 1 1 A 44 44 SER H H 1812 8.860 7.770 1.090 1 1 494 . 11 1 1 A 44 44 SER HA H 1812 5.516 4.269 1.247 1 1 497 . 11 1 1 A 44 44 SER CA C 1812 59.937 58.696 1.241 1 1 498 . 11 1 1 A 44 44 SER CB C 1812 62.755 63.291 -0.536 1 1 499 . 11 1 1 A 44 44 SER N N 1812 112.267 110.268 1.999 1 1 500 . 11 1 1 A 45 45 GLY H H 1813 8.368 8.930 -0.562 1 1 501 . 11 1 1 A 45 45 GLY HA2 H 1813 4.461 3.924 0.537 1 1 502 . 11 1 1 A 45 45 GLY HA3 H 1813 3.569 3.932 -0.363 1 1 503 . 11 1 1 A 45 45 GLY CA C 1813 44.525 46.505 -1.980 1 1 504 . 11 1 1 A 45 45 GLY N N 1813 112.727 112.350 0.377 1 1 505 . 11 1 1 A 46 46 LYS H H 1814 7.126 7.457 -0.331 1 1 506 . 11 1 1 A 46 46 LYS HA H 1814 4.206 4.903 -0.697 1 1 515 . 11 1 1 A 46 46 LYS CA C 1814 57.460 54.648 2.812 1 1 516 . 11 1 1 A 46 46 LYS CB C 1814 33.453 36.309 -2.856 1 1 520 . 11 1 1 A 46 46 LYS N N 1814 122.101 114.416 7.685 1 1 521 . 11 1 1 A 47 47 VAL H H 1815 8.056 8.613 -0.557 1 1 522 . 11 1 1 A 47 47 VAL HA H 1815 5.400 5.171 0.229 1 1 530 . 11 1 1 A 47 47 VAL CA C 1815 60.048 59.416 0.632 1 1 531 . 11 1 1 A 47 47 VAL CB C 1815 35.044 36.168 -1.124 1 1 534 . 11 1 1 A 47 47 VAL N N 1815 118.680 115.596 3.084 1 1 535 . 11 1 1 A 48 48 ALA H H 1816 9.110 8.576 0.534 1 1 536 . 11 1 1 A 48 48 ALA HA H 1816 4.804 4.915 -0.111 1 1 540 . 11 1 1 A 48 48 ALA CA C 1816 50.808 51.221 -0.413 1 1 541 . 11 1 1 A 48 48 ALA CB C 1816 24.108 23.708 0.400 1 1 542 . 11 1 1 A 48 48 ALA N N 1816 128.274 123.842 4.432 1 1 543 . 11 1 1 A 49 49 GLN H H 1817 8.725 8.530 0.195 1 1 544 . 11 1 1 A 49 49 GLN HA H 1817 5.069 4.840 0.229 1 1 551 . 11 1 1 A 49 49 GLN CA C 1817 53.524 52.247 1.277 1 1 552 . 11 1 1 A 49 49 GLN CB C 1817 30.432 30.709 -0.277 1 1 554 . 11 1 1 A 49 49 GLN N N 1817 120.102 117.470 2.632 1 1 556 . 11 1 1 A 50 50 PRO HA H 1818 5.136 4.830 0.306 1 1 563 . 11 1 1 A 50 50 PRO CA C 1818 61.966 62.448 -0.482 1 1 564 . 11 1 1 A 50 50 PRO CB C 1818 32.722 32.914 -0.192 1 1 567 . 11 1 1 A 51 51 THR H H 1819 9.072 8.653 0.419 1 1 568 . 11 1 1 A 51 51 THR HA H 1819 4.566 5.037 -0.471 1 1 573 . 11 1 1 A 51 51 THR CA C 1819 62.695 60.894 1.801 1 1 574 . 11 1 1 A 51 51 THR CB C 1819 70.056 70.800 -0.744 1 1 576 . 11 1 1 A 51 51 THR N N 1819 117.512 113.215 4.297 1 1 577 . 11 1 1 A 52 52 ILE H H 1820 8.900 9.208 -0.308 1 1 578 . 11 1 1 A 52 52 ILE HA H 1820 4.905 5.170 -0.265 1 1 588 . 11 1 1 A 52 52 ILE CA C 1820 60.869 59.529 1.340 1 1 589 . 11 1 1 A 52 52 ILE CB C 1820 39.670 40.511 -0.841 1 1 593 . 11 1 1 A 52 52 ILE N N 1820 129.513 127.142 2.371 1 1 594 . 11 1 1 A 53 53 THR H